A0A5K4F0V2_SCHMA Loading...

COesterase domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0V2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,205 aa.

						>A0A5K4F0V2_SCHMA|A0A5K4F0V2
MLFVLLILIQNLVIKFTLNTNSNNSRMINNEKDSNNPKITLKKQETMHNGINIDDDVDDDNIITLIDGKRLTGIKLHLPLSSLNPVIAYYGVRYASLGVQHNNDKDQLSRMATTTNHSDSFKFNNNHDIMKVPALHRFSHSVASFFYESPIGVYSHSILPPVCPQPSMHVHLEDKDIPKQVKDRLIHLLPFLRNQDEDCLTLNIYVPQQDKTRKSYKRPIFLFVHGESYEYGSGNAYDLSVLASYSDTVGITLNYRLGLLGFLFTNNHGISGNYALYDLHAAIMWIKTNIESFNGNSNEITLIGYGHGAALVHLFSLSKMSQGTTGSGIKRIILLNGSGFAPWSTSHQTSSILIELLKQLNITNQNLRNNKSLNENNPYQHHNIEYSNRQKSLFPQTNNMKSLKAYNDSLHNLGPFTTNTNIPLQLLKHLFMTLKNSTIEFLINLQEKLTQSFLITRLGPVILRNLFPNYLIDRNSIKQIQYDQGYHKPPLPQQQQPQQWYSQFIGKSNELNNRILETLSIETSLFMNTDLLIGWTEAPASNLYYSHSNIHKMPYSLLIQKLVYEMYPYNQDVIKEIIEYAYCNSDIFHFNNNNNNDDYIGNSEKQFKEVDCRWKVLDILSDGLYTVPIIQTLKMHSDFYTSQRMINRMQNPSLSSSLPTLLFPTGTPTITRLKEQINNYDKHRKSTYALFFNYKTSQQITKHRNATRKQLQMGKIGFADDLPYLLGAPFISPNQLEPFSNEYTDMDKKISVNLMNYLANFIHNGDPNKEFMGHQTKKIPVHWPEYTYDSRLYLHVGDESRSKQSFHQTKNHIRNLWGNKENEHFTMKQLYESDKHKLWSTLFPRLTMMDRKTKGFSMHNGNEDNIEQYPYQQTLFNKYFYFLQLKETDWLNGQVNKMKTNSRLFQNYNQNVENLLNLVENSRLYETTHSAISNVSYSGNFSQLPLYKESDIDPNSNIIIEVPFENNKLLMHSNLSNKSQSIDDETNIEIQSYSQSLRTSGHLSYSYSTLIWIILTGSILFLLNTLIFIAIYYQTHQLRKNSIYQQSKSNMKTSSIDKGTKQMLRIKQKRVSNINSLNKNESWQINEKDGKIITYPDVSNSLYSVNVSSSTATSSAVDCYALNDLSYSLHQPQHVVFNTCRNKITPALHEIPTVTTNLYNTTDNKGSISKSYDKCFVNLWNMDSPTVIGQTTNSLETKYLIQYPH
					

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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	45.3	Very low	62.2	Low	199 Å²	199	114.7 Å²	114.7	98%	0.98	58%	0.582	S	S	*	*				0	-64.4	0	-90.6	-70.3	162.4	0	0	112.1	F3 V4 L5	M1-F3 VanDerWaalsContact C-N 3.31Å; M1-F3 PolarHBondContact O-N 3.09Å; M1-V4 PolarHBondContact O-N 3.46Å; M1-L5 PolarHBondContact O-N 2.82Å
2	L	44.8	Very low	62.5	Low	139 Å²	139	113.7 Å²	113.7	73%	0.728	58%	0.578	S	S	*	*	H	α-helix	trans	-55.3	-39.4	178.4	-115.6	124.8	0	0	0	114.4	V4 L5 L6	L2-V4 PolarHBondContact O-N 3.34Å; L2-L5 WeakPolarHBondContact O-CB 3.04Å; L2-L5 PolarHBondContact O-N 3.36Å; L2-L6 WeakPolarHBondContact O-CB 3.24Å; L2-L6 PolarHBondContact O-N 3.48Å
3	F	47.3	Very low	62.3	Low	164 Å²	164	111.2 Å²	111.2	72%	0.719	57%	0.571	S	S	*	*	H	α-helix	trans	-66.4	-36	176.8	-146.1	-92.9	0	0	0	112.8	M1 L6 I7	M1-F3 VanDerWaalsContact C-N 3.31Å; M1-F3 PolarHBondContact O-N 3.09Å; F3-L6 PolarHBondContact O-N 3.22Å; F3-I7 HydrophobicContact CD1-CD1 3.91Å; F3-I7 HydrophobicContact CE1-CD1 4.17Å; F3-I7 VanDerWaalsContact O-CG1 3.32Å; F3-I7 WeakPolarHBondContact O-CG1 2.91Å; F3-I7 PolarHBondContact O-N 3.03Å
4	V	63.5	Low	61.4	Low	87 Å²	87	108.8 Å²	108.8	53%	0.527	56%	0.559	S	S	.	*	H	α-helix	trans	-71.8	-37.8	174.6	179.1	0	0	0	0	110.3	M1 L2 I7 L8	M1-V4 PolarHBondContact O-N 3.46Å; L2-V4 PolarHBondContact O-N 3.34Å; V4-I7 PolarHBondContact O-N 2.78Å; V4-L8 HydrophobicContact CG1-CD1 4.16Å; V4-L8 WeakPolarHBondContact O-CB 3.28Å; V4-L8 WeakPolarHBondContact O-CG 3.32Å; V4-L8 PolarHBondContact O-N 3.25Å
5	L	69.7	Low	60	Low	102 Å²	102	112.3 Å²	112.3	53%	0.534	57%	0.568	S	S	.	*	H	α-helix	trans	-63.2	-41.7	173.4	-154	87.7	0	0	0	111.3	M1 L2 L8 I9	M1-L5 PolarHBondContact O-N 2.82Å; L2-L5 WeakPolarHBondContact O-CB 3.04Å; L2-L5 PolarHBondContact O-N 3.36Å; L5-L8 PolarHBondContact O-N 3.36Å; L5-I9 HydrophobicContact CD2-CD1 4.09Å; L5-I9 HydrophobicContact CG-CD1 4.11Å; L5-I9 WeakPolarHBondContact O-CB 3.47Å; L5-I9 WeakPolarHBondContact O-CD1 3.46Å; L5-I9 WeakPolarHBondContact O-CG1 3.49Å; L5-I9 PolarHBondContact O-N 3.44Å
6	L	69.8	Low	58.7	Low	94 Å²	94	114.3 Å²	114.3	49%	0.492	57%	0.573	S	S	.	*	H	α-helix	trans	-64.1	-40.1	175.3	-91.1	155.3	0	0	0	112.6	L2 F3 I9 Q10	L2-L6 WeakPolarHBondContact O-CB 3.24Å; L2-L6 PolarHBondContact O-N 3.48Å; F3-L6 PolarHBondContact O-N 3.22Å; L6-I9 PolarHBondContact O-N 3Å; L6-Q10 WeakPolarHBondContact O-CB 3.49Å; L6-Q10 PolarHBondContact O-N 3.27Å
7	I	70.6	Confident	57.7	Low	79 Å²	79	112.5 Å²	112.5	41%	0.405	57%	0.569	S	S	.	*	H	α-helix	trans	-67.3	-39.6	174.3	-68.3	168	0	0	0	110.9	F3 V4 Q10 N11	F3-I7 HydrophobicContact CD1-CD1 3.91Å; F3-I7 HydrophobicContact CE1-CD1 4.17Å; F3-I7 VanDerWaalsContact O-CG1 3.32Å; F3-I7 WeakPolarHBondContact O-CG1 2.91Å; F3-I7 PolarHBondContact O-N 3.03Å; V4-I7 PolarHBondContact O-N 2.78Å; I7-Q10 PolarHBondContact O-N 3.16Å; I7-N11 WeakPolarHBondContact O-CB 3.46Å; I7-N11 PolarHBondContact O-N 2.82Å; I7-N11 PolarHBondContact O-ND2 3.06Å
8	L	71.1	Confident	56.5	Low	95 Å²	95	114 Å²	114	50%	0.497	58%	0.578	S	S	.	*	H	α-helix	trans	-66.7	-39.7	175	-75.5	168.3	0	0	0	111.9	V4 L5 N11 L12	V4-L8 HydrophobicContact CG1-CD1 4.16Å; V4-L8 WeakPolarHBondContact O-CB 3.28Å; V4-L8 WeakPolarHBondContact O-CG 3.32Å; V4-L8 PolarHBondContact O-N 3.25Å; L5-L8 PolarHBondContact O-N 3.36Å; L8-N11 PolarHBondContact O-N 2.66Å; L8-L12 WeakPolarHBondContact O-CB 3.29Å; L8-L12 PolarHBondContact O-N 3.09Å
9	I	75.8	Confident	55.4	Low	84 Å²	84	114.8 Å²	114.8	43%	0.431	58%	0.584	S	S	.	*	H	α-helix	trans	-67.9	-42.1	175.4	-67.9	164.1	0	0	0	110.5	L5 L6 N11 L12 V13	L5-I9 HydrophobicContact CD2-CD1 4.09Å; L5-I9 HydrophobicContact CG-CD1 4.11Å; L5-I9 WeakPolarHBondContact O-CB 3.47Å; L5-I9 WeakPolarHBondContact O-CD1 3.46Å; L5-I9 WeakPolarHBondContact O-CG1 3.49Å; L5-I9 PolarHBondContact O-N 3.44Å; L6-I9 PolarHBondContact O-N 3Å; I9-N11 VanDerWaalsContact C-N 3.34Å; I9-N11 PolarHBondContact O-N 3.48Å; I9-L12 PolarHBondContact O-N 3.21Å; I9-V13 HydrophobicContact CG2-CG2 4.18Å; I9-V13 WeakPolarHBondContact O-CB 3.21Å; I9-V13 VanDerWaalsContact O-CG2 3.23Å; I9-V13 WeakPolarHBondContact O-CG2 3.45Å; I9-V13 PolarHBondContact O-N 3.47Å
10	Q	64.3	Low	54.4	Low	127 Å²	127	114 Å²	114	59%	0.593	59%	0.585	S	S	*	*	H	α-helix	trans	-61.9	-41.1	172.7	-90.1	-179.2	-35.2	0	0	111.8	L6 I7 V13 I14	L6-Q10 WeakPolarHBondContact O-CB 3.49Å; L6-Q10 PolarHBondContact O-N 3.27Å; I7-Q10 PolarHBondContact O-N 3.16Å; Q10-V13 PolarHBondContact O-N 3.24Å; Q10-I14 WeakPolarHBondContact O-CB 3.42Å; Q10-I14 WeakPolarHBondContact O-CD1 3.35Å; Q10-I14 WeakPolarHBondContact O-CG1 3.49Å; Q10-I14 PolarHBondContact O-N 3.35Å
11	N	62.5	Low	53.3	Low	92 Å²	92	116 Å²	116	49%	0.492	60%	0.597	S	S	.	*	H	α-helix	trans	-68.9	-33.1	175.9	-76.5	-29.4	0	0	0	112.8	I7 L8 I9 K15	I7-N11 WeakPolarHBondContact O-CB 3.46Å; I7-N11 PolarHBondContact O-N 2.82Å; I7-N11 PolarHBondContact O-ND2 3.06Å; L8-N11 PolarHBondContact O-N 2.66Å; I9-N11 VanDerWaalsContact C-N 3.34Å; I9-N11 PolarHBondContact O-N 3.48Å; N11-K15 WeakPolarHBondContact O-CB 3.43Å; N11-K15 PolarHBondContact O-N 2.94Å
12	L	65.3	Low	52.5	Low	102 Å²	102	110.3 Å²	110.3	53%	0.534	58%	0.576	S	S	.	*	H	α-helix	trans	-71.7	-40.2	173.1	-95	151	0	0	0	112.2	L8 I9 K15 F16	L8-L12 WeakPolarHBondContact O-CB 3.29Å; L8-L12 PolarHBondContact O-N 3.09Å; I9-L12 PolarHBondContact O-N 3.21Å; L12-K15 CarbonylContact O-C 3.5Å; L12-K15 PolarHBondContact O-N 3.16Å; L12-F16 WeakPolarHBondContact O-CB 3.46Å; L12-F16 PolarHBondContact O-N 3.41Å
13	V	59.6	Low	51.9	Low	81 Å²	81	111.1 Å²	111.1	49%	0.491	58%	0.582	S	S	.	*	H	α-helix	trans	-69.1	-35.1	176.2	172	0	0	0	0	110.9	I9 Q10 F16 T17	I9-V13 HydrophobicContact CG2-CG2 4.18Å; I9-V13 WeakPolarHBondContact O-CB 3.21Å; I9-V13 VanDerWaalsContact O-CG2 3.23Å; I9-V13 WeakPolarHBondContact O-CG2 3.45Å; I9-V13 PolarHBondContact O-N 3.47Å; Q10-V13 PolarHBondContact O-N 3.24Å; V13-F16 PolarHBondContact O-N 2.95Å; V13-T17 HydrophobicContact CG1-CG2 4.43Å; V13-T17 WeakPolarHBondContact O-CB 3.19Å; V13-T17 PolarHBondContact O-N 3.29Å; V13-T17 PolarHBondContact O-OG1 2.85Å
14	I	49.8	Very low	51.1	Low	78 Å²	78	111.6 Å²	111.6	40%	0.4	59%	0.592	S	S	.	*	H	α-helix	trans	-68.3	-37.7	171.2	-68.3	165.3	0	0	0	110.9	Q10 L18	Q10-I14 WeakPolarHBondContact O-CB 3.42Å; Q10-I14 WeakPolarHBondContact O-CD1 3.35Å; Q10-I14 WeakPolarHBondContact O-CG1 3.49Å; Q10-I14 PolarHBondContact O-N 3.35Å; I14-L18 HydrophobicContact CG2-CD1 4.11Å; I14-L18 WeakPolarHBondContact O-CB 3.38Å; I14-L18 WeakPolarHBondContact O-CD1 3.26Å; I14-L18 VanDerWaalsContact O-CG 3.29Å; I14-L18 WeakPolarHBondContact O-CG 3.23Å; I14-L18 PolarHBondContact O-N 3.25Å
15	K	41.4	Very low	49.4	Very low	161 Å²	161	112 Å²	112	70%	0.7	60%	0.598	S	S	*	*	H	α-helix	trans	-67.4	-32.6	171.7	-103.3	-180	173.4	179.1	0	113.2	N11 L12	N11-K15 WeakPolarHBondContact O-CB 3.43Å; N11-K15 PolarHBondContact O-N 2.94Å; L12-K15 CarbonylContact O-C 3.5Å; L12-K15 PolarHBondContact O-N 3.16Å
16	F	38.6	Very low	47.3	Very low	145 Å²	145	118.8 Å²	118.8	64%	0.636	62%	0.617	S	S	*	*	H	α-helix	trans	-81	-38	179	-113.4	-89.7	0	0	0	113	L12 V13 L18 N19	L12-F16 WeakPolarHBondContact O-CB 3.46Å; L12-F16 PolarHBondContact O-N 3.41Å; V13-F16 PolarHBondContact O-N 2.95Å; F16-L18 VanDerWaalsContact C-N 3.29Å; F16-L18 PolarHBondContact O-N 3.23Å; F16-N19 PolarHBondContact O-N 3.13Å; F16-N19 VanDerWaalsContact O-N 3.08Å
17	T	41.2	Very low	45.4	Very low	84 Å²	84	123.1 Å²	123.1	52%	0.515	64%	0.637	S	S	.	*	H	α-helix	trans	-72.7	-20.7	176.6	43.9	0	0	0	0	113.4	V13 N19	V13-T17 HydrophobicContact CG1-CG2 4.43Å; V13-T17 WeakPolarHBondContact O-CB 3.19Å; V13-T17 PolarHBondContact O-N 3.29Å; V13-T17 PolarHBondContact O-OG1 2.85Å; T17-N19 VanDerWaalsContact C-N 3.29Å
18	L	35.8	Very low	43.5	Very low	139 Å²	139	126.9 Å²	126.9	73%	0.728	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	-11.7	168.5	-73.7	168.2	0	0	0	113.4	I14 F16	I14-L18 HydrophobicContact CG2-CD1 4.11Å; I14-L18 WeakPolarHBondContact O-CB 3.38Å; I14-L18 WeakPolarHBondContact O-CD1 3.26Å; I14-L18 VanDerWaalsContact O-CG 3.29Å; I14-L18 WeakPolarHBondContact O-CG 3.23Å; I14-L18 PolarHBondContact O-N 3.25Å; F16-L18 VanDerWaalsContact C-N 3.29Å; F16-L18 PolarHBondContact O-N 3.23Å
19	N	35.7	Very low	41.3	Very low	129 Å²	129	129.8 Å²	129.8	69%	0.69	67%	0.672	S	S	*	*	S	Bend	trans	-105.6	4.5	-176.1	-125.1	10.5	0	0	0	114.3	F16 T17	F16-N19 PolarHBondContact O-N 3.13Å; F16-N19 VanDerWaalsContact O-N 3.08Å; T17-N19 VanDerWaalsContact C-N 3.29Å
20	T	35	Very low	39	Very low	98 Å²	98	133.5 Å²	133.5	60%	0.601	69%	0.693	S	S	*	*	S	Bend	trans	-116.6	10.3	-176.6	55.2	0	0	0	0	115.2
21	N	32.7	Very low	37.4	Very low	157 Å²	157	135.1 Å²	135.1	84%	0.84	70%	0.701	S	S	*	*			trans	-109.3	46.7	165.3	-85.1	-18.9	0	0	0	110.9
22	S	29.1	Very low	35.8	Very low	79 Å²	79	140.6 Å²	140.6	55%	0.552	72%	0.72	S	S	*	*			trans	-98.5	84.6	170.4	66.3	0	0	0	0	109.4
23	N	30.3	Very low	34.1	Very low	157 Å²	157	142.8 Å²	142.8	84%	0.84	73%	0.732	S	S	*	*	S	Bend	trans	-158.8	7.6	160.4	-96.8	-21.6	0	0	0	115.7
24	N	30.5	Very low	32.5	Very low	174 Å²	174	143.4 Å²	143.4	93%	0.93	74%	0.74	S	S	*	*	S	Bend	trans	-124.1	24.3	172.8	-85.3	-15.4	0	0	0	114
25	S	29.3	Very low	31.4	Very low	95 Å²	95	146.9 Å²	146.9	66%	0.664	76%	0.759	S	S	*	*			trans	-131	60	179.9	58.9	0	0	0	0	111.5
26	R	25.8	Very low	30.7	Very low	245 Å²	245	144.3 Å²	144.3	93%	0.925	75%	0.753	S	S	*	*			trans	-96.6	85.3	162.8	-89.3	-175.9	175.4	168.3	-0.7	108.2
27	M	28.1	Very low	30.1	Very low	185 Å²	185	142 Å²	142	91%	0.911	75%	0.753	S	S	*	*	S	Bend	trans	-177.7	18.6	158.3	-95	-117.7	156	0	0	114.6
28	I	31.1	Very low	29.6	Very low	158 Å²	158	144.6 Å²	144.6	81%	0.81	76%	0.757	S	S	*	*	S	Bend	trans	-148.9	60.5	173.1	-45.1	175.3	0	0	0	110.9
29	N	26.2	Very low	29	Very low	156 Å²	156	144 Å²	144	83%	0.834	75%	0.753	S	S	*	*			trans	-155.2	78.2	165.5	-91.1	-28.1	0	0	0	108.2
30	N	27.7	Very low	28.7	Very low	161 Å²	161	142 Å²	142	86%	0.861	75%	0.746	S	S	*	*			trans	-166.3	98.1	157.7	-92.9	-12.5	0	0	0	105.9
31	E	29.3	Very low	28.4	Very low	162 Å²	162	142.3 Å²	142.3	76%	0.757	74%	0.743	S	S	*	*			trans	159.8	68.5	154.6	-89.2	173.5	-167.4	0	0	107.9	D33	E31-D33 PolarHBondContact O-N 3.46Å
32	K	28.9	Very low	28.1	Very low	206 Å²	206	142.9 Å²	142.9	90%	0.896	74%	0.738	S	S	*	*			trans	-80.1	84.4	145.6	-80.8	-179.4	175.7	177.9	0	105.1
33	D	30.4	Very low	28.2	Very low	149 Å²	149	146.8 Å²	146.8	80%	0.797	75%	0.746	S	S	*	*			trans	-141.5	135.8	161.3	-93.2	-35.4	0	0	0	110.6	E31	E31-D33 PolarHBondContact O-N 3.46Å
34	S	26.4	Very low	28.3	Very low	93 Å²	93	141.7 Å²	141.7	65%	0.65	72%	0.716	S	S	*	*			trans	-61.8	149.4	-171.8	50.6	0	0	0	0	114.5
35	N	27.1	Very low	28.4	Very low	151 Å²	151	138.5 Å²	138.5	81%	0.807	70%	0.696	S	S	*	*	S	Bend	trans	66.7	71.7	150.1	-57.7	-21.4	0	0	0	118.3
36	N	25.6	Very low	28.6	Very low	107 Å²	107	137 Å²	137	57%	0.572	68%	0.683	S	S	*	*			trans	-176	128.2	146	-119.5	-34.7	0	0	0	112.3	K38	N36-K38 PolarHBondContact O-N 3.2Å
37	P	27	Very low	29.3	Very low	98 Å²	98	127.1 Å²	127.1	64%	0.636	65%	0.648	S	S	*	*			trans	-82.6	41.6	175.3	36.3	-33.8	0	0	0	112.1
38	K	28.9	Very low	30.1	Very low	138 Å²	138	120 Å²	120	60%	0.6	61%	0.612	S	S	*	*			trans	-99.1	6.7	-176.2	-77.3	-174.1	177	179.7	0	114.8	N36	N36-K38 PolarHBondContact O-N 3.2Å
39	I	25	Very low	30.3	Very low	125 Å²	125	117 Å²	117	64%	0.641	60%	0.598	S	S	*	*	S	Bend	trans	-98.9	2.2	-173.8	-65.9	175.5	0	0	0	114.2
40	T	28.3	Very low	31.1	Very low	89 Å²	89	111.5 Å²	111.5	55%	0.546	58%	0.578	S	S	.	*	S	Bend	trans	-123.2	22	-172.6	13.8	0	0	0	0	117.3
41	L	28.1	Very low	32.1	Very low	103 Å²	103	104.1 Å²	104.1	54%	0.539	54%	0.538	S	S	.	.	S	Bend	trans	-100.3	-35.2	168.4	-93.1	144.2	0	0	0	112.7	K43 Q44 E45	L41-K43 PolarHBondContact O-N 2.9Å; L41-K43 VanDerWaalsContact O-N 3.08Å; L41-Q44 PolarHBondContact O-N 2.94Å; L41-Q44 VanDerWaalsContact O-N 3.08Å; L41-E45 PolarHBondContact O-N 3.33Å
42	K	27.3	Very low	33	Very low	169 Å²	169	102.4 Å²	102.4	74%	0.735	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-15.5	175.9	-82.3	-174.3	172	-175.4	0	115.3
43	K	30.3	Very low	34.3	Very low	162 Å²	162	95.4 Å²	95.4	70%	0.704	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-20.2	175.7	-99.5	-178.7	176.3	177.8	0	113.8	L41 T46	L41-K43 PolarHBondContact O-N 2.9Å; L41-K43 VanDerWaalsContact O-N 3.08Å; K43-T46 WeakPolarHBondContact CA-OG1 3.3Å; K43-T46 PolarHBondContact O-OG1 3.37Å
44	Q	33.3	Very low	35.4	Very low	49 Å²	49	91.1 Å²	91.1	23%	0.229	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-31.8	171	-73.9	179.6	-41.5	0	0	110.6	L41 T46 M47	L41-Q44 PolarHBondContact O-N 2.94Å; L41-Q44 VanDerWaalsContact O-N 3.08Å; Q44-T46 PolarHBondContact O-N 2.86Å; Q44-M47 HydrophobicContact CB-CE 4.43Å; Q44-M47 HydrophobicContact CB-SD 4.45Å; Q44-M47 HydrophobicContact CG-CE 4.05Å; Q44-M47 WeakPolarHBondContact O-CB 3.48Å; Q44-M47 WeakPolarHBondContact O-CG 3.48Å; Q44-M47 PolarHBondContact O-N 3.38Å
45	E	32.5	Very low	36.6	Very low	107 Å²	107	93.4 Å²	93.4	50%	0.5	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-15.4	172.1	-67.3	171.9	165.7	0	0	113.2	L41	L41-E45 PolarHBondContact O-N 3.33Å
46	T	33.5	Very low	37.7	Very low	63 Å²	63	92.3 Å²	92.3	39%	0.387	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	28.1	176.1	56.4	0	0	0	0	113.5	K43 Q44 H48	K43-T46 WeakPolarHBondContact CA-OG1 3.3Å; K43-T46 PolarHBondContact O-OG1 3.37Å; Q44-T46 PolarHBondContact O-N 2.86Å; T46-H48 PolarHBondContact O-N 3.46Å; T46-H48 VanDerWaalsContact O-N 3.12Å
47	M	41.6	Very low	39.1	Very low	38 Å²	38	92 Å²	92	19%	0.187	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-0.7	-175.1	-90.6	175.4	165.4	0	0	115.5	Q44 L159 F191 L736	Q44-M47 HydrophobicContact CB-CE 4.43Å; Q44-M47 HydrophobicContact CB-SD 4.45Å; Q44-M47 HydrophobicContact CG-CE 4.05Å; Q44-M47 WeakPolarHBondContact O-CB 3.48Å; Q44-M47 WeakPolarHBondContact O-CG 3.48Å; Q44-M47 PolarHBondContact O-N 3.38Å; M47-L159 HydrophobicContact CE-CD1 3.95Å; M47-L159 HydrophobicContact SD-CD1 3.63Å; M47-L159 HydrophobicContact SD-CG 4.16Å; M47-F191 HydrophobicContact CE-CE1 4.28Å; M47-L736 HydrophobicContact CG-CD2 4.48Å; M47-L736 WeakPolarHBondContact O-CD1 3.44Å
48	H	44.9	Very low	40.6	Very low	35 Å²	35	90.8 Å²	90.8	16%	0.162	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	41	-178.8	-75.9	-47.9	0	0	0	113.8	T46 G50 I51 I53 L76 Y90	T46-H48 PolarHBondContact O-N 3.46Å; T46-H48 VanDerWaalsContact O-N 3.12Å; H48-G50 PolarHBondContact O-N 2.96Å; H48-I51 HydrophobicContact CB-CB 4.06Å; H48-I51 HydrophobicContact CB-CG2 4.49Å; H48-I51 PolarHBondContact O-N 3.37Å; H48-I53 HydrophobicContact CB-CD1 3.86Å; H48-I53 HydrophobicContact CB-CG1 3.87Å; H48-L76 VanDerWaalsContact NE2-CD2 3.31Å; H48-L76 WeakPolarHBondContact NE2-CD2 3.32Å; H48-Y90 PolarHBondContact NE2-OH 3.38Å
49	N	34.6	Very low	42.2	Very low	97 Å²	97	90.5 Å²	90.5	52%	0.519	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	102.6	169.2	-76.4	-17.1	0	0	0	109.4	N734	N49-N734 VanDerWaalsContact C-ND2 3.25Å; N49-N734 HydrophobicContact CB-CB 4.19Å; N49-N734 WeakPolarHBondContact CB-ND2 3.44Å; N49-N734 VanDerWaalsContact O-CB 3.31Å; N49-N734 WeakPolarHBondContact O-CB 3.38Å; N49-N734 PolarHBondContact O-ND2 3.05Å
50	G	42.7	Very low	44.3	Very low	39 Å²	39	89.7 Å²	89.7	40%	0.402	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	127.5	-19.4	-174.2	0	0	0	0	0	113.6	H48	H48-G50 PolarHBondContact O-N 2.96Å
51	I	49.5	Very low	46.6	Very low	6 Å²	6	85.8 Å²	85.8	3%	0.031	45%	0.45	C	S	.	.	S	Bend	trans	-119.4	112.3	177.4	-67.3	172.9	0	0	0	106.6	H48 I53 L76 H77 L78 I731	H48-I51 HydrophobicContact CB-CB 4.06Å; H48-I51 HydrophobicContact CB-CG2 4.49Å; H48-I51 PolarHBondContact O-N 3.37Å; I51-I53 PolarHBondContact O-N 3.24Å; I51-L76 HydrophobicContact CG2-CB 3.62Å; I51-L76 HydrophobicContact CG2-CD2 3.95Å; I51-L76 HydrophobicContact CG2-CG 4.3Å; I51-H77 VanDerWaalsContact CA-O 3.24Å; I51-H77 WeakPolarHBondContact CA-O 3.46Å; I51-H77 WeakPolarHBondContact CG2-O 3.46Å; I51-L78 HydrophobicContact CD1-CD2 4.21Å; I51-L78 HydrophobicContact CG1-CD2 4.5Å; I51-I731 HydrophobicContact CD1-CG2 4.03Å; I51-I731 HydrophobicContact CG1-CG2 4.35Å
52	N	48.1	Very low	49.1	Very low	127 Å²	127	82.5 Å²	82.5	68%	0.679	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.1	123.8	173.9	-79.1	-16.9	0	0	0	108.1	H77	N52-H77 HydrophobicContact CB-CB 4.09Å; N52-H77 PolarHBondContact N-O 3.37Å; N52-H77 WeakPolarHBondContact O-CB 3.41Å; N52-H77 PolarHBondContact O-CD2 3.43Å; N52-H77 VanDerWaalsContact O-CD2 3.31Å; N52-H77 PolarHBondContact O-N 3.39Å
53	I	54.7	Low	51.7	Low	58 Å²	58	75.4 Å²	75.4	30%	0.297	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	124.5	171.8	-56.6	175.6	0	0	0	106.9	H48 I51 I74	H48-I53 HydrophobicContact CB-CD1 3.86Å; H48-I53 HydrophobicContact CB-CG1 3.87Å; I51-I53 PolarHBondContact O-N 3.24Å; I53-I74 HydrophobicContact CG2-CG2 3.58Å
54	D	54.8	Low	54.2	Low	60 Å²	60	71.2 Å²	71.2	32%	0.321	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	110.7	162.1	-73.8	-18.1	0	0	0	107	D56 K75 H77	D54-D56 PolarHBondContact O-N 3.2Å; D54-K75 IonicContact OD2-NZ 3.68Å; D54-K75 PolarHBondContact OD2-NZ 3.31Å; D54-H77 VanDerWaalsContact CG-NE2 3.26Å; D54-H77 IonicContact OD1-CD2 2.55Å; D54-H77 IonicContact OD1-NE2 3.94Å; D54-H77 PolarHBondContact OD1-NE2 3.21Å; D54-H77 IonicContact OD2-CD2 3.12Å; D54-H77 IonicContact OD2-CE1 3.81Å; D54-H77 IonicContact OD2-NE2 2.75Å; D54-H77 PolarHBondContact OD2-NE2 3.44Å
55	D	51	Low	56.6	Low	140 Å²	140	69.5 Å²	69.5	75%	0.749	38%	0.383	S	S	*	.			trans	-77	-7.2	174.6	-75.3	-28.4	0	0	0	112.5	V57	D55-V57 PolarHBondContact O-N 3.39Å
56	D	49.7	Very low	59	Low	129 Å²	129	70 Å²	70	69%	0.69	39%	0.388	S	S	*	.	S	Bend	trans	-72.9	120.8	176.3	-76.8	-28.2	0	0	0	110.3	D54 D58	D54-D56 PolarHBondContact O-N 3.2Å; D56-D58 VanDerWaalsContact C-N 3.28Å; D56-D58 PolarHBondContact O-N 3.41Å
57	V	54.4	Low	61	Low	100 Å²	100	70.5 Å²	70.5	61%	0.606	39%	0.388	S	S	*	.			trans	-74.5	84	176.7	-175	0	0	0	0	108.6	D55 I62	D55-V57 PolarHBondContact O-N 3.39Å; V57-I62 HydrophobicContact CG1-CD1 4.21Å
58	D	60.5	Low	62.6	Low	73 Å²	73	71.1 Å²	71.1	39%	0.39	40%	0.404	S	S	.	.			trans	-65.9	133.8	165.4	-77.3	-26.9	0	0	0	109.3	D56 D60 N61	D56-D58 VanDerWaalsContact C-N 3.28Å; D56-D58 PolarHBondContact O-N 3.41Å; D58-D60 PolarHBondContact O-N 3.4Å; D58-D60 VanDerWaalsContact O-N 3.07Å; D58-N61 WeakPolarHBondContact O-CB 3.29Å; D58-N61 PolarHBondContact O-N 2.93Å
59	D	62.2	Low	64	Low	132 Å²	132	72.2 Å²	72.2	71%	0.706	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-55.1	-27.4	175.2	-84.7	-34.5	0	0	0	112.2	N61 I62	D59-N61 PolarHBondContact O-N 2.87Å; D59-I62 PolarHBondContact O-N 3.46Å
60	D	68.5	Low	66.1	Low	108 Å²	108	75 Å²	75	58%	0.578	41%	0.412	S	S	*	.	G	3₁₀ helix	trans	-62.1	-19.9	175.8	-77	-5	0	0	0	113.1	D58 I62	D58-D60 PolarHBondContact O-N 3.4Å; D58-D60 VanDerWaalsContact O-N 3.07Å; D60-I62 VanDerWaalsContact C-N 3.34Å
61	N	76.5	Confident	67.8	Low	7 Å²	7	73.8 Å²	73.8	4%	0.037	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-87.2	-3.9	-179.9	-62.6	-24.1	0	0	0	113.1	D58 D59 G73 I87 Y89	D58-N61 WeakPolarHBondContact O-CB 3.29Å; D58-N61 PolarHBondContact O-N 2.93Å; D59-N61 PolarHBondContact O-N 2.87Å; N61-G73 PolarHBondContact O-N 3.25Å; N61-I87 HydrophobicContact CB-CG2 4.48Å; N61-Y89 WeakPolarHBondContact O-CE1 3.41Å; N61-Y89 PolarHBondContact O-OH 3.3Å
62	I	80.6	Confident	69.3	Low	34 Å²	34	75.2 Å²	75.2	17%	0.174	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	116.5	-174.1	-48.8	-177.7	0	0	0	110.7	V57 D59 D60 R70 L71 T72	V57-I62 HydrophobicContact CG1-CD1 4.21Å; D59-I62 PolarHBondContact O-N 3.46Å; D60-I62 VanDerWaalsContact C-N 3.34Å; I62-R70 VanDerWaalsContact CD1-NH2 3.27Å; I62-R70 HydrophobicContact CG2-CB 4.03Å; I62-R70 HydrophobicContact CG2-CG 4.45Å; I62-L71 CarbonylContact C-O 3.57Å; I62-L71 VanDerWaalsContact CA-O 3.31Å; I62-L71 WeakPolarHBondContact CA-O 3.37Å; I62-T72 HydrophobicContact CD1-CG2 4.24Å; I62-T72 HydrophobicContact CG1-CG2 3.94Å; I62-T72 HydrophobicContact CG2-CG2 4.36Å
63	I	81.9	Confident	70.8	Confident	19 Å²	19	69.5 Å²	69.5	10%	0.097	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	138.5	176.5	-69.7	175.4	0	0	0	109.7	R70 L71 Y89 F293	I63-R70 CarbonylContact O-C 3.53Å; I63-R70 WeakPolarHBondContact O-CA 3.38Å; I63-L71 PolarHBondContact N-O 3.08Å; I63-L71 PolarHBondContact O-N 3.19Å; I63-Y89 HydrophobicContact CB-CE1 4.42Å; I63-Y89 HydrophobicContact CD1-CE1 4.09Å; I63-Y89 HydrophobicContact CD1-CE2 3.72Å; I63-Y89 WeakPolarHBondContact CD1-OH 3.49Å; I63-Y89 HydrophobicContact CG1-CE1 4.31Å; I63-Y89 WeakPolarHBondContact CG1-OH 2.96Å; I63-F293 HydrophobicContact CD1-CB 4.2Å; I63-F293 HydrophobicContact CD1-CD1 3.28Å; I63-F293 HydrophobicContact CD1-CE1 3.78Å; I63-F293 HydrophobicContact CD1-CG 3.8Å; I63-F293 HydrophobicContact CG2-CE2 4.42Å; I63-F293 HydrophobicContact CG2-CZ 4.44Å
64	T	83.6	Confident	72.2	Confident	74 Å²	74	67.8 Å²	67.8	45%	0.454	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	123.1	170.4	-51	0	0	0	0	109.6	K69 S292	T64-K69 CarbonylContact C-O 3.56Å; T64-K69 WeakPolarHBondContact CA-O 3.49Å; T64-S292 WeakPolarHBondContact O-CB 3.25Å; T64-S292 PolarHBondContact O-OG 3.17Å
65	L	83.4	Confident	73.6	Confident	13 Å²	13	66.2 Å²	66.2	7%	0.068	36%	0.358	C	S	.	.			trans	-72.6	167.7	175	-64.4	-174.1	0	0	0	111.3	D67 G68 K69 L71 W285 N289 F293	L65-D67 VanDerWaalsContact CB-OD1 3.27Å; L65-D67 WeakPolarHBondContact CB-OD1 3.45Å; L65-D67 PolarHBondContact O-N 3.08Å; L65-G68 PolarHBondContact O-N 3.19Å; L65-K69 HydrophobicContact CD1-CB 4.42Å; L65-K69 PolarHBondContact N-O 3.33Å; L65-L71 HydrophobicContact CD1-CD1 3.87Å; L65-L71 HydrophobicContact CD1-CD2 4.44Å; L65-L71 HydrophobicContact CD1-CG 4.13Å; L65-L71 HydrophobicContact CD2-CD1 3.65Å; L65-L71 HydrophobicContact CD2-CG 4.38Å; L65-L71 HydrophobicContact CG-CD1 3.8Å; L65-L71 HydrophobicContact CG-CG 4.04Å; L65-W285 HydrophobicContact CD1-CZ2 4.16Å; L65-W285 HydrophobicContact CD2-CH2 4.48Å; L65-W285 HydrophobicContact CD2-CZ2 4.25Å; L65-N289 HydrophobicContact CD2-CB 4.05Å; L65-F293 HydrophobicContact CD2-CE2 3.65Å; L65-F293 HydrophobicContact CD2-CZ 4Å
66	I	82.2	Confident	75.2	Confident	119 Å²	119	59.6 Å²	59.6	61%	0.61	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-30	179.1	-62.9	-166.3	0	0	0	112	G68 T288	I66-G68 PolarHBondContact O-N 3.24Å; I66-T288 HydrophobicContact CD1-CG2 4.22Å; I66-T288 WeakPolarHBondContact CD1-O 3.46Å
67	D	74.9	Confident	76.7	Confident	72 Å²	72	56 Å²	56	39%	0.385	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	6.7	175.8	71.4	-8.7	0	0	0	113.8	L65 K69 S149	L65-D67 VanDerWaalsContact CB-OD1 3.27Å; L65-D67 WeakPolarHBondContact CB-OD1 3.45Å; L65-D67 PolarHBondContact O-N 3.08Å; D67-K69 VanDerWaalsContact C-N 3.31Å; D67-K69 PolarHBondContact O-N 3.4Å; D67-K69 WeakPolarHBondContact OD1-CB 3.3Å; D67-K69 WeakPolarHBondContact OD1-CG 3.44Å; D67-K69 PolarHBondContact OD1-N 3.48Å; D67-K69 VanDerWaalsContact OD2-CD 3.26Å; D67-K69 WeakPolarHBondContact OD2-CD 3.44Å; D67-K69 VanDerWaalsContact OD2-CE 3.24Å; D67-K69 WeakPolarHBondContact OD2-CE 3.44Å; D67-K69 IonicContact OD2-NZ 3.49Å; D67-K69 PolarHBondContact OD2-NZ 3.15Å; D67-S149 WeakPolarHBondContact OD2-CB 3.15Å
68	G	76.2	Confident	78.1	Confident	51 Å²	51	52 Å²	52	53%	0.526	28%	0.276	S	S	.	.	S	Bend	trans	82.9	-0.4	178.7	0	0	0	0	0	114.6	L65 I66	L65-G68 PolarHBondContact O-N 3.19Å; I66-G68 PolarHBondContact O-N 3.24Å
69	K	74.6	Confident	78.6	Confident	58 Å²	58	51.7 Å²	51.7	25%	0.252	28%	0.278	S	S	.	.			trans	-75.4	139.7	179	-67.7	179.2	-173.9	164.7	0	111.8	T64 L65 D67 S149 P150	T64-K69 CarbonylContact C-O 3.56Å; T64-K69 WeakPolarHBondContact CA-O 3.49Å; L65-K69 HydrophobicContact CD1-CB 4.42Å; L65-K69 PolarHBondContact N-O 3.33Å; D67-K69 VanDerWaalsContact C-N 3.31Å; D67-K69 PolarHBondContact O-N 3.4Å; D67-K69 WeakPolarHBondContact OD1-CB 3.3Å; D67-K69 WeakPolarHBondContact OD1-CG 3.44Å; D67-K69 PolarHBondContact OD1-N 3.48Å; D67-K69 VanDerWaalsContact OD2-CD 3.26Å; D67-K69 WeakPolarHBondContact OD2-CD 3.44Å; D67-K69 VanDerWaalsContact OD2-CE 3.24Å; D67-K69 WeakPolarHBondContact OD2-CE 3.44Å; D67-K69 IonicContact OD2-NZ 3.49Å; D67-K69 PolarHBondContact OD2-NZ 3.15Å; K69-S149 PolarHBondContact NZ-O 3.08Å; K69-P150 PolarHBondContact NZ-O 3.02Å
70	R	78.5	Confident	79.2	Confident	156 Å²	156	48 Å²	48	59%	0.589	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	127.6	175.9	-63	-178.6	71.6	-169.9	2.8	110.1	I62 I63	I62-R70 VanDerWaalsContact CD1-NH2 3.27Å; I62-R70 HydrophobicContact CG2-CB 4.03Å; I62-R70 HydrophobicContact CG2-CG 4.45Å; I63-R70 CarbonylContact O-C 3.53Å; I63-R70 WeakPolarHBondContact O-CA 3.38Å
71	L	78.4	Confident	79.3	Confident	14 Å²	14	49.1 Å²	49.1	7%	0.073	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.6	171.7	-60	178.9	0	0	0	108.9	I62 I63 L65 Y89 V92 V153 F293	I62-L71 CarbonylContact C-O 3.57Å; I62-L71 VanDerWaalsContact CA-O 3.31Å; I62-L71 WeakPolarHBondContact CA-O 3.37Å; I63-L71 PolarHBondContact N-O 3.08Å; I63-L71 PolarHBondContact O-N 3.19Å; L65-L71 HydrophobicContact CD1-CD1 3.87Å; L65-L71 HydrophobicContact CD1-CD2 4.44Å; L65-L71 HydrophobicContact CD1-CG 4.13Å; L65-L71 HydrophobicContact CD2-CD1 3.65Å; L65-L71 HydrophobicContact CD2-CG 4.38Å; L65-L71 HydrophobicContact CG-CD1 3.8Å; L65-L71 HydrophobicContact CG-CG 4.04Å; L71-Y89 HydrophobicContact CB-CD1 4.04Å; L71-Y89 HydrophobicContact CB-CE1 4.27Å; L71-V92 HydrophobicContact CD1-CG1 4.16Å; L71-V92 HydrophobicContact CD1-CG2 4.25Å; L71-V153 HydrophobicContact CD2-CG2 3.35Å; L71-F293 HydrophobicContact CD1-CE1 4.25Å; L71-F293 HydrophobicContact CD1-CE2 4.46Å; L71-F293 HydrophobicContact CD1-CZ 3.54Å
72	T	81.2	Confident	79.4	Confident	35 Å²	35	52.5 Å²	52.5	22%	0.215	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	117.2	-176.1	35.6	0	0	0	0	108.9	I62 H156	I62-T72 HydrophobicContact CD1-CG2 4.24Å; I62-T72 HydrophobicContact CG1-CG2 3.94Å; I62-T72 HydrophobicContact CG2-CG2 4.36Å; T72-H156 WeakPolarHBondContact CB-CE1 3.3Å; T72-H156 PolarHBondContact OG1-CE1 3.25Å; T72-H156 PolarHBondContact OG1-ND1 3.09Å; T72-H156 PolarHBondContact OG1-NE2 3.47Å
73	G	79.7	Confident	79.5	Confident	8 Å²	8	51.8 Å²	51.8	8%	0.082	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-90	163.1	179.9	0	0	0	0	0	112.7	N61 A88	N61-G73 PolarHBondContact O-N 3.25Å; G73-A88 CarbonylContact C-O 3.53Å; G73-A88 VanDerWaalsContact CA-O 3.31Å; G73-A88 WeakPolarHBondContact CA-O 3.39Å
74	I	83	Confident	79.7	Confident	22 Å²	22	51.8 Å²	51.8	11%	0.113	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.8	168.9	-66.1	-171.3	0	0	0	109	I53 L76 I87 A88 H156	I53-I74 HydrophobicContact CG2-CG2 3.58Å; I74-L76 HydrophobicContact CG2-CD2 3.83Å; I74-I87 CarbonylContact O-C 3.54Å; I74-I87 WeakPolarHBondContact O-CA 3.41Å; I74-A88 PolarHBondContact N-O 3.49Å; I74-A88 PolarHBondContact O-N 3.19Å; I74-H156 HydrophobicContact CD1-CB 4.06Å; I74-H156 WeakPolarHBondContact CD1-O 3.47Å; I74-H156 HydrophobicContact CG1-CB 4.25Å
75	K	85.6	Confident	79.9	Confident	27 Å²	27	49.8 Å²	49.8	12%	0.117	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	122.8	174.6	-171.2	179.4	174.3	-162.7	0	110.6	D54 P85	D54-K75 IonicContact OD2-NZ 3.68Å; D54-K75 PolarHBondContact OD2-NZ 3.31Å; K75-P85 HydrophobicContact CG-CB 4.42Å
76	L	84.1	Confident	80.2	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	113.4	-178.7	-57.1	-175.8	0	0	0	109.5	H48 I51 I74 P85 V86 A88	H48-L76 VanDerWaalsContact NE2-CD2 3.31Å; H48-L76 WeakPolarHBondContact NE2-CD2 3.32Å; I51-L76 HydrophobicContact CG2-CB 3.62Å; I51-L76 HydrophobicContact CG2-CD2 3.95Å; I51-L76 HydrophobicContact CG2-CG 4.3Å; I74-L76 HydrophobicContact CG2-CD2 3.83Å; L76-P85 WeakPolarHBondContact O-CA 3.48Å; L76-V86 WeakPolarHBondContact CA-O 3.27Å; L76-V86 WeakPolarHBondContact CB-O 3.25Å; L76-V86 PolarHBondContact N-O 2.98Å; L76-V86 PolarHBondContact O-N 3.23Å; L76-A88 HydrophobicContact CD1-CB 3.61Å; L76-A88 HydrophobicContact CG-CB 4.08Å
77	H	81.7	Confident	80.6	Confident	55 Å²	55	44.2 Å²	44.2	26%	0.255	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	113.9	170.9	-70.3	-80	0	0	0	110.7	I51 N52 D54	I51-H77 VanDerWaalsContact CA-O 3.24Å; I51-H77 WeakPolarHBondContact CA-O 3.46Å; I51-H77 WeakPolarHBondContact CG2-O 3.46Å; N52-H77 HydrophobicContact CB-CB 4.09Å; N52-H77 PolarHBondContact N-O 3.37Å; N52-H77 WeakPolarHBondContact O-CB 3.41Å; N52-H77 PolarHBondContact O-CD2 3.43Å; N52-H77 VanDerWaalsContact O-CD2 3.31Å; N52-H77 PolarHBondContact O-N 3.39Å; D54-H77 VanDerWaalsContact CG-NE2 3.26Å; D54-H77 IonicContact OD1-CD2 2.55Å; D54-H77 IonicContact OD1-NE2 3.94Å; D54-H77 PolarHBondContact OD1-NE2 3.21Å; D54-H77 IonicContact OD2-CD2 3.12Å; D54-H77 IonicContact OD2-CE1 3.81Å; D54-H77 IonicContact OD2-NE2 2.75Å; D54-H77 PolarHBondContact OD2-NE2 3.44Å
78	L	82.3	Confident	81.3	Confident	16 Å²	16	40.9 Å²	40.9	8%	0.084	24%	0.237	C	C	.	.			trans	-73.7	145	-179.8	-62.8	177.3	0	0	0	111.1	I51 L80 L83 V86 S240 V241	I51-L78 HydrophobicContact CD1-CD2 4.21Å; I51-L78 HydrophobicContact CG1-CD2 4.5Å; L78-L80 PolarHBondContact O-N 3.36Å; L78-L83 HydrophobicContact CB-CB 4.3Å; L78-L83 HydrophobicContact CD1-CB 3.78Å; L78-L83 HydrophobicContact CD1-CD1 3.83Å; L78-L83 HydrophobicContact CD1-CG 4.47Å; L78-V86 HydrophobicContact CD1-CG2 4.16Å; L78-S240 WeakPolarHBondContact CD2-OG 3.5Å; L78-V241 HydrophobicContact CD1-CG2 4.3Å; L78-V241 HydrophobicContact CD2-CG2 4.09Å
79	P	72.1	Confident	81.9	Confident	66 Å²	66	38.6 Å²	38.6	43%	0.429	21%	0.213	S	C	.	.	S	Bend	trans	-63.5	-15.3	-178.5	23.8	-34.2	0	0	0	113.8	F730	P79-F730 WeakPolarHBondContact CG-O 3.44Å
80	L	74.1	Confident	82.4	Confident	53 Å²	53	37 Å²	37	28%	0.277	21%	0.205	S	C	.	.			trans	-93.6	110.1	172.3	-72.1	166.7	0	0	0	109.9	L78 S82 L83 F730	L78-L80 PolarHBondContact O-N 3.36Å; L80-S82 PolarHBondContact O-N 3.43Å; L80-L83 HydrophobicContact CB-CB 4.33Å; L80-L83 HydrophobicContact CB-CD1 3.98Å; L80-L83 HydrophobicContact CB-CG 3.89Å; L80-L83 HydrophobicContact CD1-CD1 3.51Å; L80-L83 HydrophobicContact CD1-CG 3.99Å; L80-L83 HydrophobicContact CG-CD1 4.41Å; L80-L83 PolarHBondContact O-N 3.26Å; L80-F730 HydrophobicContact CD1-CB 3.66Å; L80-F730 HydrophobicContact CD1-CD1 3.46Å; L80-F730 VanDerWaalsContact CD1-CD1 3.46Å; L80-F730 HydrophobicContact CD1-CE1 4.21Å; L80-F730 HydrophobicContact CD1-CG 3.62Å; L80-F730 HydrophobicContact CD2-CD1 4.13Å; L80-F730 HydrophobicContact CG-CB 4.36Å; L80-F730 HydrophobicContact CG-CD1 4.16Å
81	S	71.2	Confident	82.7	Confident	133 Å²	133	29.6 Å²	29.6	93%	0.93	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-14	176.8	63.1	0	0	0	0	114.4
82	S	78.1	Confident	83.1	Confident	77 Å²	77	29.2 Å²	29.2	54%	0.538	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-15.4	174.9	60.3	0	0	0	0	113.6	L80	L80-S82 PolarHBondContact O-N 3.43Å
83	L	82.5	Confident	83.2	Confident	19 Å²	19	28.9 Å²	28.9	10%	0.099	17%	0.17	C	C	.	.	S	Bend	trans	-93.7	141.7	178.8	-66.3	-176	0	0	0	109.8	L78 L80 V241 Y245	L78-L83 HydrophobicContact CB-CB 4.3Å; L78-L83 HydrophobicContact CD1-CB 3.78Å; L78-L83 HydrophobicContact CD1-CD1 3.83Å; L78-L83 HydrophobicContact CD1-CG 4.47Å; L80-L83 HydrophobicContact CB-CB 4.33Å; L80-L83 HydrophobicContact CB-CD1 3.98Å; L80-L83 HydrophobicContact CB-CG 3.89Å; L80-L83 HydrophobicContact CD1-CD1 3.51Å; L80-L83 HydrophobicContact CD1-CG 3.99Å; L80-L83 HydrophobicContact CG-CD1 4.41Å; L80-L83 PolarHBondContact O-N 3.26Å; L83-V241 HydrophobicContact CD1-CG1 4.14Å; L83-V241 HydrophobicContact CD1-CG2 4.15Å; L83-Y245 HydrophobicContact CD2-CD2 4.05Å
84	N	85.6	Confident	83.6	Confident	20 Å²	20	28.6 Å²	28.6	11%	0.107	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-68.4	143.4	174.9	-69.4	3.7	0	0	0	109.3	Q208 S244 H774	N84-Q208 PolarHBondContact ND2-O 3.25Å; N84-S244 PolarHBondContact N-OG 3.15Å; N84-S244 WeakPolarHBondContact O-CB 3.42Å; N84-S244 PolarHBondContact O-OG 2.77Å; N84-H774 PolarHBondContact OD1-NE2 3.46Å
85	P	89	Confident	83.7	Confident	31 Å²	31	27.6 Å²	27.6	20%	0.201	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-54.8	154.5	169.9	-24	33.9	0	0	0	111.4	K75 L76 Q208	K75-P85 HydrophobicContact CG-CB 4.42Å; L76-P85 WeakPolarHBondContact O-CA 3.48Å; P85-Q208 HydrophobicContact CB-CB 4.49Å; P85-Q208 WeakPolarHBondContact O-CB 3.25Å; P85-Q208 PolarHBondContact O-N 3.48Å
86	V	89.9	Confident	83.4	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	135.1	180	174.8	0	0	0	0	109.4	L76 L78 Y205 V206 P207 S240	L76-V86 WeakPolarHBondContact CA-O 3.27Å; L76-V86 WeakPolarHBondContact CB-O 3.25Å; L76-V86 PolarHBondContact N-O 2.98Å; L76-V86 PolarHBondContact O-N 3.23Å; L78-V86 HydrophobicContact CD1-CG2 4.16Å; V86-Y205 HydrophobicContact CG1-CD1 4.26Å; V86-V206 CarbonylContact C-O 3.56Å; V86-V206 WeakPolarHBondContact CA-O 3.5Å; V86-P207 HydrophobicContact CG2-CB 4.42Å; V86-S240 WeakPolarHBondContact CG2-O 3.49Å
87	I	90	Very high	83.1	Confident	16 Å²	16	27 Å²	27	8%	0.082	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	115.9	170.4	-52.5	170.9	0	0	0	107.6	N61 I74 Y89 V206	N61-I87 HydrophobicContact CB-CG2 4.48Å; I74-I87 CarbonylContact O-C 3.54Å; I74-I87 WeakPolarHBondContact O-CA 3.41Å; I87-Y89 HydrophobicContact CB-CE2 4.19Å; I87-Y89 HydrophobicContact CG2-CD2 4.39Å; I87-Y89 HydrophobicContact CG2-CE2 3.58Å; I87-Y89 WeakPolarHBondContact CG2-OH 3.37Å; I87-V206 PolarHBondContact N-O 3.36Å; I87-V206 PolarHBondContact O-N 3.42Å
88	A	89.2	Confident	82.5	Confident	1 Å²	1	24.9 Å²	24.9	1%	0.008	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.4	179.6	0	0	0	0	0	111.3	G73 I74 L76 Y90 I204 Y205	G73-A88 CarbonylContact C-O 3.53Å; G73-A88 VanDerWaalsContact CA-O 3.31Å; G73-A88 WeakPolarHBondContact CA-O 3.39Å; I74-A88 PolarHBondContact N-O 3.49Å; I74-A88 PolarHBondContact O-N 3.19Å; L76-A88 HydrophobicContact CD1-CB 3.61Å; L76-A88 HydrophobicContact CG-CB 4.08Å; A88-Y90 HydrophobicContact CB-CD2 4.43Å; A88-Y90 HydrophobicContact CB-CE1 4.21Å; A88-Y90 HydrophobicContact CB-CE2 3.78Å; A88-I204 CarbonylContact C-O 3.45Å; A88-I204 WeakPolarHBondContact CA-O 3.45Å; A88-Y205 HydrophobicContact CB-CD1 4.08Å; A88-Y205 HydrophobicContact CB-CE1 4.23Å
89	Y	88.3	Confident	81.7	Confident	4 Å²	4	25.5 Å²	25.5	2%	0.016	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	102.5	173.9	-59	-95.2	0	0	0	108.3	N61 I63 L71 I87 N203 I204 V206 F293	N61-Y89 WeakPolarHBondContact O-CE1 3.41Å; N61-Y89 PolarHBondContact O-OH 3.3Å; I63-Y89 HydrophobicContact CB-CE1 4.42Å; I63-Y89 HydrophobicContact CD1-CE1 4.09Å; I63-Y89 HydrophobicContact CD1-CE2 3.72Å; I63-Y89 WeakPolarHBondContact CD1-OH 3.49Å; I63-Y89 HydrophobicContact CG1-CE1 4.31Å; I63-Y89 WeakPolarHBondContact CG1-OH 2.96Å; L71-Y89 HydrophobicContact CB-CD1 4.04Å; L71-Y89 HydrophobicContact CB-CE1 4.27Å; I87-Y89 HydrophobicContact CB-CE2 4.19Å; I87-Y89 HydrophobicContact CG2-CD2 4.39Å; I87-Y89 HydrophobicContact CG2-CE2 3.58Å; I87-Y89 WeakPolarHBondContact CG2-OH 3.37Å; Y89-N203 CarbonylContact O-C 3.42Å; Y89-N203 WeakPolarHBondContact O-CA 3.35Å; Y89-I204 PolarHBondContact N-O 3.09Å; Y89-I204 PolarHBondContact O-N 3.47Å; Y89-V206 HydrophobicContact CD2-CG2 4.29Å; Y89-V206 HydrophobicContact CE2-CG2 4.05Å; Y89-F293 HydrophobicContact CD1-CE1 4.18Å; Y89-F293 AromaticContact CD2-CD1 3.95Å; Y89-F293 HydrophobicContact CD2-CD1 3.95Å; Y89-F293 AromaticContact CD2-CE1 3.73Å; Y89-F293 HydrophobicContact CD2-CE1 3.73Å; Y89-F293 HydrophobicContact CE1-CE1 4.43Å; Y89-F293 AromaticContact CE2-CD1 3.94Å; Y89-F293 HydrophobicContact CE2-CD1 3.94Å; Y89-F293 HydrophobicContact CE2-CE1 4.02Å; Y89-F293 AromaticContact CG-CE1 3.84Å; Y89-F293 HydrophobicContact CG-CE1 3.84Å
90	Y	86.6	Confident	80.7	Confident	25 Å²	25	28.4 Å²	28.4	10%	0.098	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	144.1	-178.1	-62.6	-62.8	0	0	0	111.8	H48 A88 V92 V153 L159 N203 Y205	H48-Y90 PolarHBondContact NE2-OH 3.38Å; A88-Y90 HydrophobicContact CB-CD2 4.43Å; A88-Y90 HydrophobicContact CB-CE1 4.21Å; A88-Y90 HydrophobicContact CB-CE2 3.78Å; Y90-V92 PolarHBondContact O-N 3.27Å; Y90-V153 WeakPolarHBondContact O-CG1 3.34Å; Y90-L159 HydrophobicContact CD1-CD2 3.6Å; Y90-L159 HydrophobicContact CE1-CD2 3.89Å; Y90-L159 HydrophobicContact CG-CD2 4.13Å; Y90-N203 WeakPolarHBondContact CA-OD1 3.41Å; Y90-N203 HydrophobicContact CD1-CB 3.96Å; Y90-Y205 HydrophobicContact CE1-CE1 4.1Å; Y90-Y205 AromaticContact CE1-CZ 3.99Å
91	G	83.8	Confident	79.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	69.3	28.3	170.3	0	0	0	0	0	115.5	R93 L202 N203	G91-R93 PolarHBondContact O-N 3.2Å; G91-L202 PolarHBondContact N-O 3.27Å; G91-N203 PolarHBondContact N-OD1 3.24Å
92	V	86.1	Confident	77.7	Confident	6 Å²	6	29.4 Å²	29.4	4%	0.036	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	103.7	175.9	-176.4	0	0	0	0	109.1	L71 Y90 Y94 T201 L202 I204 W285	L71-V92 HydrophobicContact CD1-CG1 4.16Å; L71-V92 HydrophobicContact CD1-CG2 4.25Å; Y90-V92 PolarHBondContact O-N 3.27Å; V92-Y94 PolarHBondContact O-N 2.9Å; V92-T201 CarbonylContact O-C 3.54Å; V92-T201 WeakPolarHBondContact O-CA 3.31Å; V92-L202 HydrophobicContact CB-CB 4.37Å; V92-L202 PolarHBondContact N-O 3.38Å; V92-L202 PolarHBondContact O-N 3Å; V92-I204 HydrophobicContact CB-CD1 4.39Å; V92-I204 HydrophobicContact CG1-CD1 4.47Å; V92-I204 HydrophobicContact CG2-CD1 4.16Å; V92-W285 HydrophobicContact CG1-CH2 3.5Å; V92-W285 HydrophobicContact CG1-CZ2 3.35Å; V92-W285 HydrophobicContact CG1-CZ3 4.4Å
93	R	84.8	Confident	75.5	Confident	28 Å²	28	31.3 Å²	31.3	11%	0.106	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	129.6	179.5	-67.6	168.2	177.5	-135.4	-0.1	110.1	G91 H101 P150 Y154 D198 L200 T201	G91-R93 PolarHBondContact O-N 3.2Å; R93-H101 PolarHBondContact NH2-NE2 3.41Å; R93-H101 VanDerWaalsContact NH2-NE2 3.14Å; R93-P150 HydrophobicContact CB-CB 3.2Å; R93-P150 HydrophobicContact CB-CG 3.28Å; R93-P150 HydrophobicContact CG-CB 4Å; R93-P150 WeakPolarHBondContact O-CG 3.47Å; R93-Y154 HydrophobicContact CG-CE2 4.34Å; R93-Y154 VanDerWaalsContact NH2-CZ 3.34Å; R93-Y154 PolarHBondContact NH2-OH 3.21Å; R93-D198 IonicContact CZ-OD1 2.93Å; R93-D198 IonicContact CZ-OD2 2.96Å; R93-D198 VanDerWaalsContact NH1-CG 3.32Å; R93-D198 IonicContact NH1-OD1 3.65Å; R93-D198 PolarHBondContact NH1-OD1 3.49Å; R93-D198 IonicContact NH1-OD2 2.64Å; R93-D198 PolarHBondContact NH1-OD2 3.17Å; R93-D198 IonicContact NH2-OD2 2.71Å; R93-D198 PolarHBondContact NH2-OD2 2.74Å; R93-L200 WeakPolarHBondContact CA-O 3.25Å; R93-T201 HydrophobicContact CG-CG2 3.91Å
94	Y	87.5	Confident	73.2	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.008	18%	0.175	C	C	.	.	S	Bend	trans	-107.9	-15.9	177.6	65.9	-95.4	0	0	0	113.1	V92 L200 L202 N254 D278 A281 A282	V92-Y94 PolarHBondContact O-N 2.9Å; Y94-L200 VanDerWaalsContact CD1-C 3.42Å; Y94-L200 WeakPolarHBondContact CD1-O 3.29Å; Y94-L200 HydrophobicContact CE1-CB 4.01Å; Y94-L200 WeakPolarHBondContact CE1-O 3.33Å; Y94-L200 HydrophobicContact CE2-CB 4.12Å; Y94-L200 PolarHBondContact N-O 2.94Å; Y94-L200 WeakPolarHBondContact OH-CD2 3.48Å; Y94-L202 HydrophobicContact CD1-CD1 4.5Å; Y94-L202 HydrophobicContact CD1-CD2 3.54Å; Y94-L202 HydrophobicContact CD1-CG 3.66Å; Y94-L202 HydrophobicContact CE1-CD2 3.94Å; Y94-L202 HydrophobicContact CE1-CG 4.48Å; Y94-L202 HydrophobicContact CG-CD2 4.26Å; Y94-L202 HydrophobicContact CG-CG 4.26Å; Y94-N254 WeakPolarHBondContact CE1-O 3.26Å; Y94-N254 PolarHBondContact OH-O 3.28Å; Y94-D278 VanDerWaalsContact CE2-O 3.3Å; Y94-D278 WeakPolarHBondContact CE2-O 3.28Å; Y94-A281 HydrophobicContact CD2-CB 4.14Å; Y94-A281 HydrophobicContact CE2-CB 4.21Å; Y94-A282 HydrophobicContact CD1-CB 4.35Å; Y94-A282 HydrophobicContact CD2-CB 3.86Å; Y94-A282 HydrophobicContact CE1-CB 4.32Å; Y94-A282 HydrophobicContact CE2-CB 3.87Å; Y94-A282 HydrophobicContact CG-CB 4.1Å
95	A	85.2	Confident	70.7	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.008	21%	0.209	C	C	.	.			trans	-151.3	157.3	177.4	0	0	0	0	0	109.5	S144 L200	A95-S144 WeakPolarHBondContact CA-OG 3.27Å; A95-S144 WeakPolarHBondContact CB-OG 3.42Å; A95-L200 HydrophobicContact CB-CB 4.08Å; A95-L200 HydrophobicContact CB-CD1 3.63Å
96	S	78.4	Confident	67.9	Low	10 Å²	10	45 Å²	45	7%	0.07	22%	0.224	C	C	.	.			trans	-121.1	140.5	176.5	175.3	0	0	0	0	110	G98 S144 E148	S96-G98 PolarHBondContact OG-N 2.92Å; S96-S144 PolarHBondContact N-OG 2.98Å; S96-S144 WeakPolarHBondContact O-CB 3.16Å; S96-S144 PolarHBondContact O-OG 3.46Å; S96-E148 VanDerWaalsContact CB-OE2 3.31Å; S96-E148 WeakPolarHBondContact CB-OE2 3.23Å; S96-E148 PolarHBondContact OG-OE2 3.28Å
97	L	79	Confident	65.1	Low	4 Å²	4	50.4 Å²	50.4	2%	0.021	25%	0.25	C	C	.	.			trans	-95.8	9.9	169	-60.9	-179.7	0	0	0	112.6	A134 L135 H136 E197 L200	L97-A134 HydrophobicContact CB-CB 3.57Å; L97-A134 HydrophobicContact CD1-CB 4.43Å; L97-L135 PolarHBondContact O-N 3.27Å; L97-L135 VanDerWaalsContact O-N 3.13Å; L97-H136 HydrophobicContact CD2-CB 4.49Å; L97-H136 WeakPolarHBondContact O-CB 3.33Å; L97-H136 PolarHBondContact O-N 2.92Å; L97-E197 WeakPolarHBondContact CD1-O 3.39Å; L97-L200 HydrophobicContact CD1-CD1 4.5Å; L97-L200 HydrophobicContact CD2-CD1 3.92Å; L97-L200 HydrophobicContact CG-CD1 3.98Å
98	G	69.1	Low	62.2	Low	11 Å²	11	55 Å²	55	11%	0.113	27%	0.274	C	S	.	.			trans	71.1	38.4	179.5	0	0	0	0	0	112.9	S96 Q100 E148	S96-G98 PolarHBondContact OG-N 2.92Å; G98-Q100 PolarHBondContact O-N 3.42Å; G98-E148 WeakPolarHBondContact CA-OE2 3.45Å
99	V	64.4	Low	59.4	Low	29 Å²	29	57.8 Å²	57.8	18%	0.176	29%	0.294	C	S	.	.			trans	-74.8	116.1	176.2	-179.2	0	0	0	0	108.3	H101 A134 D198	V99-H101 PolarHBondContact O-N 3.05Å; V99-A134 HydrophobicContact CG2-CB 3.58Å; V99-D198 HydrophobicContact CB-CB 4.3Å; V99-D198 HydrophobicContact CG2-CB 4.01Å
100	Q	51.4	Low	56.6	Low	127 Å²	127	66.2 Å²	66.2	59%	0.593	33%	0.325	S	S	*	.			trans	-72.1	100.9	172.3	-71.5	-176.2	-17.5	0	0	108.6	G98 N102	G98-Q100 PolarHBondContact O-N 3.42Å; Q100-N102 PolarHBondContact O-N 3.38Å; Q100-N102 VanDerWaalsContact O-N 3.15Å
101	H	49.4	Very low	53.9	Low	99 Å²	99	70.6 Å²	70.6	46%	0.458	35%	0.348	S	S	.	.			trans	-67.8	108.2	158.6	-72.6	-59.2	0	0	0	106.8	R93 V99 N103 D198	R93-H101 PolarHBondContact NH2-NE2 3.41Å; R93-H101 VanDerWaalsContact NH2-NE2 3.14Å; V99-H101 PolarHBondContact O-N 3.05Å; H101-N103 VanDerWaalsContact C-N 3.3Å; H101-N103 PolarHBondContact O-N 3.23Å; H101-D198 IonicContact NE2-OD2 2.81Å; H101-D198 PolarHBondContact NE2-OD2 3.33Å
102	N	34.2	Very low	51.5	Low	108 Å²	108	74.5 Å²	74.5	58%	0.578	38%	0.38	S	S	*	.			trans	-56.7	104.7	161.6	-77.4	-11.9	0	0	0	106	Q100 D104	Q100-N102 PolarHBondContact O-N 3.38Å; Q100-N102 VanDerWaalsContact O-N 3.15Å; N102-D104 PolarHBondContact O-N 3.45Å
103	N	32.2	Very low	49	Very low	116 Å²	116	79.5 Å²	79.5	62%	0.62	41%	0.411	S	S	*	.			trans	-66.9	76	168.7	-84	-18.4	0	0	0	107.6	H101 K105 D106	H101-N103 VanDerWaalsContact C-N 3.3Å; H101-N103 PolarHBondContact O-N 3.23Å; N103-K105 PolarHBondContact O-N 2.77Å; N103-D106 PolarHBondContact O-N 3.31Å
104	D	33.9	Very low	46.5	Very low	71 Å²	71	83.1 Å²	83.1	38%	0.38	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	8.2	175.6	-80.6	-18.5	0	0	0	112.1	N102 L108	N102-D104 PolarHBondContact O-N 3.45Å; D104-L108 HydrophobicContact CB-CD1 3.93Å; D104-L108 WeakPolarHBondContact O-CB 3.39Å; D104-L108 WeakPolarHBondContact O-CD1 3.3Å
105	K	31.8	Very low	43.8	Very low	190 Å²	190	88.7 Å²	88.7	83%	0.826	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-23.5	164.5	-73.1	-173	176.6	179.3	0	113.5	N103 S109	N103-K105 PolarHBondContact O-N 2.77Å; K105-S109 PolarHBondContact O-OG 2.66Å
106	D	31.1	Very low	41	Very low	96 Å²	96	96.3 Å²	96.3	51%	0.513	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-20.4	-179.6	-86.7	-11.3	0	0	0	114	N103 S109 R110	N103-D106 PolarHBondContact O-N 3.31Å; D106-S109 WeakPolarHBondContact CA-OG 3.31Å; D106-S109 PolarHBondContact O-OG 3.45Å; D106-R110 WeakPolarHBondContact O-CD 3.35Å; D106-R110 WeakPolarHBondContact O-CG 3.24Å
107	Q	31.5	Very low	38.9	Very low	115 Å²	115	104.3 Å²	104.3	54%	0.537	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-35.4	173	-71.4	-156.2	12.5	0	0	113.4	S109 R110 M111	Q107-S109 VanDerWaalsContact C-N 3.33Å; Q107-S109 PolarHBondContact O-N 3.44Å; Q107-R110 PolarHBondContact O-N 3.31Å; Q107-M111 HydrophobicContact CB-CE 4.35Å; Q107-M111 WeakPolarHBondContact O-CG 3.36Å; Q107-M111 PolarHBondContact O-N 2.85Å
108	L	29.4	Very low	36.4	Very low	111 Å²	111	109 Å²	109	58%	0.581	58%	0.58	S	S	*	*	H	α-helix	trans	-68.3	-30	175.6	-92.1	136.4	0	0	0	113	D104 A112	D104-L108 HydrophobicContact CB-CD1 3.93Å; D104-L108 WeakPolarHBondContact O-CB 3.39Å; D104-L108 WeakPolarHBondContact O-CD1 3.3Å; L108-A112 WeakPolarHBondContact O-CB 3.49Å; L108-A112 PolarHBondContact O-N 3.26Å
109	S	30.2	Very low	34.7	Very low	61 Å²	61	115.4 Å²	115.4	43%	0.427	61%	0.612	S	S	.	*	H	α-helix	trans	-73.8	-26.4	173.3	47.3	0	0	0	0	113.1	K105 D106 Q107 T113	K105-S109 PolarHBondContact O-OG 2.66Å; D106-S109 WeakPolarHBondContact CA-OG 3.31Å; D106-S109 PolarHBondContact O-OG 3.45Å; Q107-S109 VanDerWaalsContact C-N 3.33Å; Q107-S109 PolarHBondContact O-N 3.44Å; S109-T113 PolarHBondContact O-OG1 2.92Å
110	R	29.4	Very low	32.8	Very low	180 Å²	180	119.7 Å²	119.7	68%	0.679	64%	0.643	S	S	*	*	H	α-helix	trans	-86.4	-26	174.8	-68.1	-179.9	-167.5	-173.3	4.8	113.6	D106 Q107 T113 T114	D106-R110 WeakPolarHBondContact O-CD 3.35Å; D106-R110 WeakPolarHBondContact O-CG 3.24Å; Q107-R110 PolarHBondContact O-N 3.31Å; R110-T113 PolarHBondContact O-OG1 3.47Å; R110-T114 PolarHBondContact O-OG1 2.7Å
111	M	29.5	Very low	31.6	Very low	118 Å²	118	122.2 Å²	122.2	58%	0.581	65%	0.652	S	S	*	*	H	α-helix	trans	-83.6	-31	172.8	-68.8	-177	-154.8	0	0	112.8	Q107 T113 T114	Q107-M111 HydrophobicContact CB-CE 4.35Å; Q107-M111 WeakPolarHBondContact O-CG 3.36Å; Q107-M111 PolarHBondContact O-N 2.85Å; M111-T113 PolarHBondContact O-N 2.87Å; M111-T114 PolarHBondContact O-N 2.98Å; M111-T114 PolarHBondContact O-OG1 2.93Å
112	A	33.1	Very low	30.5	Very low	82 Å²	82	127.5 Å²	127.5	68%	0.678	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	-12.6	176.5	0	0	0	0	0	114.2	L108	L108-A112 WeakPolarHBondContact O-CB 3.49Å; L108-A112 PolarHBondContact O-N 3.26Å
113	T	33.2	Very low	30.1	Very low	111 Å²	111	129.8 Å²	129.8	68%	0.681	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	0.5	177.8	43.4	0	0	0	0	113.4	S109 R110 M111	S109-T113 PolarHBondContact O-OG1 2.92Å; R110-T113 PolarHBondContact O-OG1 3.47Å; M111-T113 PolarHBondContact O-N 2.87Å
114	T	32.2	Very low	29.7	Very low	103 Å²	103	131 Å²	131	63%	0.632	69%	0.686	S	S	*	*	S	Bend	trans	-135.5	32.1	-172.4	50.9	0	0	0	0	114	R110 M111	R110-T114 PolarHBondContact O-OG1 2.7Å; M111-T114 PolarHBondContact O-N 2.98Å; M111-T114 PolarHBondContact O-OG1 2.93Å
115	T	30.5	Very low	29.4	Very low	120 Å²	120	133.2 Å²	133.2	74%	0.736	70%	0.698	S	S	*	*			trans	-153.7	85.2	163.4	31.5	0	0	0	0	111.2	H117	T115-H117 PolarHBondContact O-N 3.17Å
116	N	28.4	Very low	29.1	Very low	160 Å²	160	129.6 Å²	129.6	86%	0.856	69%	0.687	S	S	*	*			trans	-65.5	102.3	149.8	-78.1	-26.4	0	0	0	106.3
117	H	32.6	Very low	29	Very low	179 Å²	179	131.4 Å²	131.4	83%	0.829	69%	0.692	S	S	*	*			trans	-175.1	125.4	140	-93.8	-59.9	0	0	0	109.3	T115 D119	T115-H117 PolarHBondContact O-N 3.17Å; H117-D119 PolarHBondContact O-N 2.92Å
118	S	27.5	Very low	29	Very low	102 Å²	102	133.7 Å²	133.7	71%	0.713	71%	0.708	S	S	*	*			trans	-35.6	116.9	166.2	48.8	0	0	0	0	113.2
119	D	32	Very low	29.5	Very low	145 Å²	145	133.7 Å²	133.7	78%	0.775	71%	0.708	S	S	*	*			trans	-161.1	128.1	137.1	-92.3	-27.5	0	0	0	110.6	H117 F121	H117-D119 PolarHBondContact O-N 2.92Å; D119-F121 PolarHBondContact O-N 3.37Å
120	S	25.8	Very low	30	Very low	119 Å²	119	136.9 Å²	136.9	83%	0.832	72%	0.717	S	S	*	*			trans	-68.5	102.4	-175.4	52.4	0	0	0	0	112.1
121	F	26.4	Very low	31.5	Very low	180 Å²	180	132.4 Å²	132.4	79%	0.789	70%	0.703	S	S	*	*			trans	-115	109.9	164.6	-88.1	-85.5	0	0	0	110.9	D119 F123	D119-F121 PolarHBondContact O-N 3.37Å; F121-F123 PolarHBondContact O-N 3.44Å; F121-F123 VanDerWaalsContact O-N 3.11Å
122	K	25.2	Very low	33.4	Very low	210 Å²	210	129.1 Å²	129.1	91%	0.913	69%	0.69	S	S	*	*			trans	-63.7	103.8	167.2	-76.2	177.9	175.3	176.8	0	108.9	N124	K122-N124 PolarHBondContact O-N 2.96Å
123	F	26	Very low	35.6	Very low	157 Å²	157	126.6 Å²	126.6	69%	0.689	67%	0.666	S	S	*	*			trans	-73.3	112.2	168.7	-100.5	-93	0	0	0	109.9	F121 H127	F121-F123 PolarHBondContact O-N 3.44Å; F121-F123 VanDerWaalsContact O-N 3.11Å; F123-H127 AromaticContact CE1-NE2 3.71Å
124	N	24.9	Very low	37.8	Very low	142 Å²	142	121.5 Å²	121.5	76%	0.759	64%	0.635	S	S	*	*			trans	-75.2	119.8	164.9	-94.7	-16.7	0	0	0	108.7	K122 N126	K122-N124 PolarHBondContact O-N 2.96Å; N124-N126 PolarHBondContact O-N 2.99Å
125	N	27.5	Very low	40	Very low	116 Å²	116	121.4 Å²	121.4	62%	0.62	63%	0.63	S	S	*	*	S	Bend	trans	-73.7	55	178.9	-72.7	-2.9	0	0	0	113.6
126	N	25.4	Very low	42.4	Very low	114 Å²	114	118.9 Å²	118.9	61%	0.61	61%	0.61	S	S	*	*			trans	-116.8	71.8	165.8	-74.2	-8.6	0	0	0	108	N124 D128	N124-N126 PolarHBondContact O-N 2.99Å; N126-D128 PolarHBondContact O-N 2.94Å
127	H	28.9	Very low	45.1	Very low	134 Å²	134	111.3 Å²	111.3	62%	0.62	57%	0.569	S	S	*	*			trans	-92.5	89.2	172.2	-89.3	-41.6	0	0	0	109.8	F123 I129	F123-H127 AromaticContact CE1-NE2 3.71Å; H127-I129 HydrophobicContact CB-CG1 4Å; H127-I129 PolarHBondContact O-N 3.25Å
128	D	32	Very low	47.6	Very low	163 Å²	163	103.4 Å²	103.4	87%	0.872	53%	0.532	S	S	*	.			trans	-63.3	81.8	146.1	-74	-34	0	0	0	106.9	N126 M130	N126-D128 PolarHBondContact O-N 2.94Å; D128-M130 PolarHBondContact O-N 3.48Å
129	I	39.4	Very low	50.2	Low	112 Å²	112	100.8 Å²	100.8	57%	0.574	52%	0.515	S	S	*	.			trans	-61.8	108	167.8	-57.5	178.1	0	0	0	104.7	H127 K131	H127-I129 HydrophobicContact CB-CG1 4Å; H127-I129 PolarHBondContact O-N 3.25Å; I129-K131 PolarHBondContact O-N 3.07Å
130	M	39.9	Very low	52.6	Low	127 Å²	127	97 Å²	97	63%	0.626	49%	0.492	S	S	*	.			trans	-50.2	106	173.9	-94.7	179.1	74.6	0	0	108	D128 V132 T438	D128-M130 PolarHBondContact O-N 3.48Å; M130-V132 PolarHBondContact O-N 3.2Å; M130-V132 VanDerWaalsContact O-N 3.09Å; M130-T438 HydrophobicContact CE-CG2 4.13Å
131	K	62.3	Low	54.7	Low	87 Å²	87	91.3 Å²	91.3	38%	0.378	45%	0.452	S	S	.	.			trans	-64	115.2	178.9	-65.7	-170.2	-178	-165.4	0	108.1	I129 Q195 D196 I439	I129-K131 PolarHBondContact O-N 3.07Å; K131-Q195 PolarHBondContact NZ-O 2.95Å; K131-D196 WeakPolarHBondContact CD-OD2 3.39Å; K131-D196 WeakPolarHBondContact CE-OD2 3.46Å; K131-D196 IonicContact NZ-OD2 3.72Å; K131-D196 PolarHBondContact NZ-OD2 2.84Å; K131-I439 HydrophobicContact CB-CD1 3.99Å; K131-I439 HydrophobicContact CD-CD1 4.09Å
132	V	68.8	Low	56.3	Low	49 Å²	49	84.7 Å²	84.7	30%	0.297	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-64.9	135.2	179	174.4	0	0	0	0	108.8	M130 A134 Y386	M130-V132 PolarHBondContact O-N 3.2Å; M130-V132 VanDerWaalsContact O-N 3.09Å; V132-A134 PolarHBondContact O-N 3.28Å; V132-Y386 HydrophobicContact CG1-CE1 4.12Å; V132-Y386 WeakPolarHBondContact CG1-OH 3.5Å; V132-Y386 HydrophobicContact CG2-CE1 4.36Å
133	P	78	Confident	57.5	Low	29 Å²	29	77.2 Å²	77.2	19%	0.188	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-51	134.8	173	-31.4	39.1	0	0	0	113.2	L135 R137 S437	P133-L135 PolarHBondContact O-N 3.01Å; P133-R137 VanDerWaalsContact CA-NH2 3.27Å; P133-S437 WeakPolarHBondContact CG-O 3.49Å
134	A	80.8	Confident	58.9	Low	3 Å²	3	70.2 Å²	70.2	3%	0.025	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-64.5	134.8	177.6	0	0	0	0	0	111.2	L97 V99 V132 H136 R137 E197	L97-A134 HydrophobicContact CB-CB 3.57Å; L97-A134 HydrophobicContact CD1-CB 4.43Å; V99-A134 HydrophobicContact CG2-CB 3.58Å; V132-A134 PolarHBondContact O-N 3.28Å; A134-H136 PolarHBondContact O-N 3.41Å; A134-H136 VanDerWaalsContact O-N 3.16Å; A134-R137 HydrophobicContact CB-CB 4.5Å; A134-R137 WeakPolarHBondContact O-CB 3.49Å; A134-R137 PolarHBondContact O-N 3.29Å; A134-E197 HydrophobicContact CB-CB 4.18Å; A134-E197 WeakPolarHBondContact CB-OE2 3.19Å; A134-E197 PolarHBondContact N-OE2 3.24Å
135	L	78	Confident	60.1	Low	102 Å²	102	65.7 Å²	65.7	53%	0.534	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-36.2	-177.1	-176.4	63	0	0	0	112.4	L97 P133 K435	L97-L135 PolarHBondContact O-N 3.27Å; L97-L135 VanDerWaalsContact O-N 3.13Å; P133-L135 PolarHBondContact O-N 3.01Å; L135-K435 WeakPolarHBondContact O-CE 3.34Å
136	H	80.7	Confident	61.1	Low	67 Å²	67	67.2 Å²	67.2	31%	0.31	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	22.7	-175.3	-59.1	-55.6	0	0	0	113.9	L97 A134 F138 S139	L97-H136 HydrophobicContact CD2-CB 4.49Å; L97-H136 WeakPolarHBondContact O-CB 3.33Å; L97-H136 PolarHBondContact O-N 2.92Å; A134-H136 PolarHBondContact O-N 3.41Å; A134-H136 VanDerWaalsContact O-N 3.16Å; H136-F138 PolarHBondContact O-N 3.41Å; H136-S139 WeakPolarHBondContact O-CB 3.47Å; H136-S139 PolarHBondContact O-N 3.21Å
137	R	85.6	Confident	61.9	Low	1 Å²	1	71.3 Å²	71.3	0%	0.004	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-41	-45	-176.9	-175.6	-179.5	-74.7	177	-10.2	115.3	P133 A134 E197 R256 L260 L434 K435 S437	P133-R137 VanDerWaalsContact CA-NH2 3.27Å; A134-R137 HydrophobicContact CB-CB 4.5Å; A134-R137 WeakPolarHBondContact O-CB 3.49Å; A134-R137 PolarHBondContact O-N 3.29Å; R137-E197 IonicContact CZ-OE1 3.68Å; R137-E197 IonicContact CZ-OE2 3.83Å; R137-E197 VanDerWaalsContact NE-CD 3.3Å; R137-E197 IonicContact NE-OE1 3.03Å; R137-E197 PolarHBondContact NE-OE1 3.16Å; R137-E197 IonicContact NE-OE2 3.55Å; R137-E197 PolarHBondContact NE-OE2 2.75Å; R137-E197 VanDerWaalsContact NH2-CD 3.34Å; R137-E197 IonicContact NH2-OE1 2.87Å; R137-E197 PolarHBondContact NH2-OE1 2.83Å; R137-E197 IonicContact NH2-OE2 2.97Å; R137-E197 PolarHBondContact NH2-OE2 2.97Å; R137-R256 PolarHBondContact O-NH1 3.35Å; R137-L260 HydrophobicContact CG-CD2 3.48Å; R137-L260 VanDerWaalsContact CG-CD2 3.48Å; R137-L434 PolarHBondContact NH1-O 2.85Å; R137-K435 PolarHBondContact NH1-O 3.11Å; R137-K435 VanDerWaalsContact NH1-O 3.09Å; R137-S437 VanDerWaalsContact CZ-O 3.31Å; R137-S437 PolarHBondContact NH1-O 3.25Å; R137-S437 PolarHBondContact NH2-O 3.43Å
138	F	84.8	Confident	62.7	Low	12 Å²	12	68.8 Å²	68.8	5%	0.053	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	33.5	-178	-60.8	-59.5	0	0	0	113	H136 L260 L263 Y274 F431 L434 K435	H136-F138 PolarHBondContact O-N 3.41Å; F138-L260 HydrophobicContact CE1-CD2 4.11Å; F138-L260 HydrophobicContact CZ-CD2 4.27Å; F138-L263 HydrophobicContact CD1-CD2 4.41Å; F138-L263 HydrophobicContact CE1-CB 4.36Å; F138-L263 HydrophobicContact CE1-CD2 3.96Å; F138-L263 HydrophobicContact CZ-CD2 4.04Å; F138-Y274 HydrophobicContact CB-CE2 4.33Å; F138-Y274 AromaticContact CD1-CE2 3.98Å; F138-Y274 HydrophobicContact CD1-CE2 3.98Å; F138-Y274 WeakPolarHBondContact O-CE1 3.38Å; F138-Y274 VanDerWaalsContact O-CZ 3.25Å; F138-Y274 PolarHBondContact O-OH 3.1Å; F138-F431 HydrophobicContact CB-CE2 3.44Å; F138-F431 VanDerWaalsContact CB-CE2 3.44Å; F138-F431 HydrophobicContact CB-CZ 3.77Å; F138-F431 HydrophobicContact CD2-CD2 4Å; F138-F431 AromaticContact CD2-CE2 3.35Å; F138-F431 HydrophobicContact CD2-CE2 3.35Å; F138-F431 AromaticContact CD2-CZ 3.96Å; F138-F431 HydrophobicContact CD2-CZ 3.96Å; F138-F431 HydrophobicContact CE2-CE2 4.28Å; F138-F431 AromaticContact CG-CE2 3.63Å; F138-F431 HydrophobicContact CG-CE2 3.63Å; F138-F431 HydrophobicContact CG-CZ 4.29Å; F138-L434 HydrophobicContact CE2-CB 3.99Å; F138-L434 HydrophobicContact CZ-CB 4.25Å; F138-K435 HydrophobicContact CD2-CB 4.38Å; F138-K435 HydrophobicContact CE2-CB 4.48Å
139	S	82.2	Confident	63.2	Low	48 Å²	48	63.9 Å²	63.9	34%	0.336	32%	0.324	S	S	.	.	S	Bend	trans	-109.8	159.3	174.8	-60.3	0	0	0	0	111	H136 S141 R256	H136-S139 WeakPolarHBondContact O-CB 3.47Å; H136-S139 PolarHBondContact O-N 3.21Å; S139-S141 PolarHBondContact O-N 2.56Å; S139-R256 PolarHBondContact O-NH1 3.39Å; S139-R256 PolarHBondContact O-NH2 2.99Å
140	H	81.5	Confident	63.7	Low	64 Å²	64	59.8 Å²	59.8	30%	0.296	31%	0.305	S	S	.	.			trans	-64.3	129.3	170.6	-62	163.6	0	0	0	109.9	V142 A143 S271 Y277	H140-V142 PolarHBondContact O-N 2.86Å; H140-A143 PolarHBondContact O-N 2.94Å; H140-S271 PolarHBondContact NE2-OG 3.43Å; H140-Y277 HydrophobicContact CB-CD1 4.2Å; H140-Y277 HydrophobicContact CB-CG 4.28Å; H140-Y277 AromaticContact CD2-CD1 3.92Å; H140-Y277 AromaticContact CD2-CD2 3.4Å; H140-Y277 VanDerWaalsContact CD2-CD2 3.4Å; H140-Y277 WeakPolarHBondContact CD2-CD2 3.44Å; H140-Y277 AromaticContact CD2-CE1 3.95Å; H140-Y277 AromaticContact CD2-CE2 3.46Å; H140-Y277 VanDerWaalsContact CD2-CE2 3.46Å; H140-Y277 WeakPolarHBondContact CD2-CE2 3.45Å; H140-Y277 AromaticContact CD2-CG 3.65Å; H140-Y277 AromaticContact CD2-CZ 3.73Å; H140-Y277 AromaticContact CE1-CE1 3.62Å; H140-Y277 AromaticContact CE1-CE2 3.8Å; H140-Y277 AromaticContact CE1-CZ 3.34Å; H140-Y277 PolarHBondContact CE1-OH 2.95Å; H140-Y277 AromaticContact CG-CD1 3.86Å; H140-Y277 AromaticContact CG-CE1 3.95Å; H140-Y277 AromaticContact CG-CG 3.98Å; H140-Y277 AromaticContact ND1-CE1 3.78Å; H140-Y277 AromaticContact ND1-CZ 3.97Å; H140-Y277 AromaticContact NE2-CD2 3.6Å; H140-Y277 AromaticContact NE2-CE1 3.73Å; H140-Y277 AromaticContact NE2-CE2 3.1Å; H140-Y277 WeakPolarHBondContact NE2-CE2 3.41Å; H140-Y277 AromaticContact NE2-CZ 3.16Å; H140-Y277 PolarHBondContact NE2-OH 3.12Å
141	S	70.4	Confident	63.8	Low	1 Å²	1	61 Å²	61	1%	0.007	31%	0.313	C	S	.	.	H	α-helix	trans	-65.3	-22.9	177.7	37.4	0	0	0	0	112.7	S139 A143 S144 Y277 D278	S139-S141 PolarHBondContact O-N 2.56Å; S141-A143 PolarHBondContact O-N 2.94Å; S141-S144 WeakPolarHBondContact O-CB 3.03Å; S141-S144 PolarHBondContact O-N 3.48Å; S141-S144 PolarHBondContact O-OG 3.35Å; S141-Y277 PolarHBondContact OG-O 2.87Å; S141-Y277 VanDerWaalsContact OG-O 3.11Å; S141-D278 WeakPolarHBondContact CB-OD1 3.38Å; S141-D278 WeakPolarHBondContact OG-CA 3.27Å; S141-D278 PolarHBondContact OG-N 3.37Å; S141-D278 PolarHBondContact OG-OD1 3.28Å
142	V	59.1	Low	63.1	Low	41 Å²	41	59.2 Å²	59.2	25%	0.248	32%	0.319	C	S	.	.	H	α-helix	trans	-58.2	-30.3	177	-174.5	0	0	0	0	112.5	H140 S144 F145 Y277 A281	H140-V142 PolarHBondContact O-N 2.86Å; V142-S144 VanDerWaalsContact C-N 3.35Å; V142-F145 WeakPolarHBondContact O-CB 3.3Å; V142-F145 PolarHBondContact O-N 3Å; V142-Y277 HydrophobicContact CG2-CD1 4.34Å; V142-A281 HydrophobicContact CG2-CB 4.49Å
143	A	51.8	Low	62.2	Low	52 Å²	52	58.9 Å²	58.9	43%	0.43	32%	0.317	S	S	.	.	H	α-helix	trans	-66.5	-38.7	175.3	0	0	0	0	0	111.5	H140 S141 F145 F146 Y147	H140-A143 PolarHBondContact O-N 2.94Å; S141-A143 PolarHBondContact O-N 2.94Å; A143-F145 PolarHBondContact O-N 2.88Å; A143-F146 PolarHBondContact O-N 3.31Å; A143-Y147 WeakPolarHBondContact O-CD2 3.37Å
144	S	53.8	Low	61	Low	10 Å²	10	59.6 Å²	59.6	7%	0.07	32%	0.316	C	S	.	.	H	α-helix	trans	-65.3	-27	-178.9	73.4	0	0	0	0	113.5	A95 S96 S141 V142 F146 Y147 E148	A95-S144 WeakPolarHBondContact CA-OG 3.27Å; A95-S144 WeakPolarHBondContact CB-OG 3.42Å; S96-S144 PolarHBondContact N-OG 2.98Å; S96-S144 WeakPolarHBondContact O-CB 3.16Å; S96-S144 PolarHBondContact O-OG 3.46Å; S141-S144 WeakPolarHBondContact O-CB 3.03Å; S141-S144 PolarHBondContact O-N 3.48Å; S141-S144 PolarHBondContact O-OG 3.35Å; V142-S144 VanDerWaalsContact C-N 3.35Å; S144-F146 PolarHBondContact O-N 3.3Å; S144-F146 VanDerWaalsContact O-N 3.07Å; S144-Y147 PolarHBondContact O-N 3.28Å; S144-E148 PolarHBondContact O-N 2.94Å; S144-E148 VanDerWaalsContact O-N 3.08Å
145	F	50.6	Low	59.3	Low	48 Å²	48	63 Å²	63	21%	0.211	34%	0.339	C	S	.	.	H	α-helix	trans	-54.3	-28.9	175.5	-172.6	-100	0	0	0	112.8	V142 A143 W285	V142-F145 WeakPolarHBondContact O-CB 3.3Å; V142-F145 PolarHBondContact O-N 3Å; A143-F145 PolarHBondContact O-N 2.88Å; F145-W285 HydrophobicContact CE2-CB 4.02Å; F145-W285 HydrophobicContact CE2-CG 4.5Å
146	F	48.7	Very low	58.1	Low	148 Å²	148	62.1 Å²	62.1	65%	0.649	33%	0.333	S	S	*	.	H	α-helix	trans	-98.4	-20.7	-177.8	-66.4	-75.6	0	0	0	114.7	A143 S144	A143-F146 PolarHBondContact O-N 3.31Å; S144-F146 PolarHBondContact O-N 3.3Å; S144-F146 VanDerWaalsContact O-N 3.07Å
147	Y	41.8	Very low	56.7	Low	200 Å²	200	62 Å²	62	78%	0.784	34%	0.339	S	S	*	.	H	α-helix	trans	-112.4	-24.5	-168.7	-65.1	-68.1	0	0	0	114	A143 S144	A143-Y147 WeakPolarHBondContact O-CD2 3.37Å; S144-Y147 PolarHBondContact O-N 3.28Å
148	E	47.3	Very low	55.8	Low	80 Å²	80	64 Å²	64	37%	0.374	35%	0.35	S	S	.	.			trans	-142.2	83.7	-179.6	-70.4	-179.2	178.9	0	0	109.2	S96 G98 S144 P150	S96-E148 VanDerWaalsContact CB-OE2 3.31Å; S96-E148 WeakPolarHBondContact CB-OE2 3.23Å; S96-E148 PolarHBondContact OG-OE2 3.28Å; G98-E148 WeakPolarHBondContact CA-OE2 3.45Å; S144-E148 PolarHBondContact O-N 2.94Å; S144-E148 VanDerWaalsContact O-N 3.08Å; E148-P150 WeakPolarHBondContact O-CD 3.37Å
149	S	42.5	Very low	55.5	Low	60 Å²	60	64.8 Å²	64.8	42%	0.42	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-60.9	122.6	164.1	-66.3	0	0	0	0	106.8	D67 K69 I151	D67-S149 WeakPolarHBondContact OD2-CB 3.15Å; K69-S149 PolarHBondContact NZ-O 3.08Å; S149-I151 PolarHBondContact O-N 3.48Å
150	P	47.9	Very low	55.6	Low	27 Å²	27	62.7 Å²	62.7	18%	0.175	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-64.9	130.1	-166.9	16.2	-24.8	0	0	0	112.2	K69 R93 E148	K69-P150 PolarHBondContact NZ-O 3.02Å; R93-P150 HydrophobicContact CB-CB 3.2Å; R93-P150 HydrophobicContact CB-CG 3.28Å; R93-P150 HydrophobicContact CG-CB 4Å; R93-P150 WeakPolarHBondContact O-CG 3.47Å; E148-P150 WeakPolarHBondContact O-CD 3.37Å
151	I	42.6	Very low	56	Low	153 Å²	153	60 Å²	60	79%	0.785	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-85.6	120.2	176.4	-59.2	167.8	0	0	0	107	S149	S149-I151 PolarHBondContact O-N 3.48Å
152	G	47.5	Very low	57	Low	49 Å²	49	60 Å²	60	51%	0.505	33%	0.327	S	S	.	.			trans	99.8	134.6	169.5	0	0	0	0	0	115.3
153	V	50.1	Low	58.7	Low	41 Å²	41	58.1 Å²	58.1	25%	0.248	32%	0.316	C	S	.	.			trans	-79.9	140.9	156.9	-164.3	0	0	0	0	106.4	L71 Y90	L71-V153 HydrophobicContact CD2-CG2 3.35Å; Y90-V153 WeakPolarHBondContact O-CG1 3.34Å
154	Y	52.2	Low	60.6	Low	45 Å²	45	56 Å²	56	18%	0.176	30%	0.298	C	S	.	.			trans	-57.2	146.5	164	-75	-80.7	0	0	0	108.6	R93 H156 P160 P161 D198 T201	R93-Y154 HydrophobicContact CG-CE2 4.34Å; R93-Y154 VanDerWaalsContact NH2-CZ 3.34Å; R93-Y154 PolarHBondContact NH2-OH 3.21Å; Y154-H156 PolarHBondContact O-N 3.05Å; Y154-P160 HydrophobicContact CD2-CB 3.73Å; Y154-P160 HydrophobicContact CE2-CB 3.98Å; Y154-P160 HydrophobicContact CG-CB 4.31Å; Y154-P161 VanDerWaalsContact CE1-CD 3.46Å; Y154-P161 HydrophobicContact CE1-CG 3.94Å; Y154-P161 HydrophobicContact CE2-CG 4.43Å; Y154-P161 WeakPolarHBondContact OH-CG 3.49Å; Y154-D198 PolarHBondContact OH-O 3.42Å; Y154-T201 HydrophobicContact CD2-CG2 4.31Å; Y154-T201 HydrophobicContact CE2-CG2 3.81Å
155	S	46.1	Very low	62.4	Low	73 Å²	73	55.6 Å²	55.6	51%	0.51	30%	0.295	S	S	.	.			trans	-45.1	132	-176.9	-178.3	0	0	0	0	110.8	S157 I158	S155-S157 PolarHBondContact O-N 3.49Å; S155-I158 PolarHBondContact O-N 3.4Å
156	H	52.3	Low	64.1	Low	85 Å²	85	54.2 Å²	54.2	39%	0.394	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.8	-38.4	-168.6	-58.8	-113.5	0	0	0	113.5	T72 I74 Y154	T72-H156 WeakPolarHBondContact CB-CE1 3.3Å; T72-H156 PolarHBondContact OG1-CE1 3.25Å; T72-H156 PolarHBondContact OG1-ND1 3.09Å; T72-H156 PolarHBondContact OG1-NE2 3.47Å; I74-H156 HydrophobicContact CD1-CB 4.06Å; I74-H156 WeakPolarHBondContact CD1-O 3.47Å; I74-H156 HydrophobicContact CG1-CB 4.25Å; Y154-H156 PolarHBondContact O-N 3.05Å
157	S	52.1	Low	65.3	Low	63 Å²	63	51 Å²	51	44%	0.441	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-4.8	-172.8	52.5	0	0	0	0	116.1	S155	S155-S157 PolarHBondContact O-N 3.49Å
158	I	65.8	Low	66.6	Low	45 Å²	45	43.1 Å²	43.1	23%	0.231	26%	0.257	C	S	.	.	S	Bend	trans	-128.6	125.2	-170.1	-54.2	174.4	0	0	0	111	S155	S155-I158 PolarHBondContact O-N 3.4Å
159	L	79.7	Confident	67.1	Low	28 Å²	28	46.1 Å²	46.1	15%	0.147	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-54.6	142.6	172	-72.1	169.9	0	0	0	111.3	M47 Y90 F191 N235	M47-L159 HydrophobicContact CE-CD1 3.95Å; M47-L159 HydrophobicContact SD-CD1 3.63Å; M47-L159 HydrophobicContact SD-CG 4.16Å; Y90-L159 HydrophobicContact CD1-CD2 3.6Å; Y90-L159 HydrophobicContact CE1-CD2 3.89Å; Y90-L159 HydrophobicContact CG-CD2 4.13Å; L159-F191 HydrophobicContact CD1-CD1 3.79Å; L159-F191 HydrophobicContact CD1-CE1 3.69Å; L159-N235 HydrophobicContact CD1-CB 4.32Å; L159-N235 HydrophobicContact CD2-CB 4.47Å
160	P	83.8	Confident	67.8	Low	3 Å²	3	44.4 Å²	44.4	2%	0.019	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-61.5	155.9	-178.4	28.5	-37.1	0	0	0	111.4	Y154 T201 N235	Y154-P160 HydrophobicContact CD2-CB 3.73Å; Y154-P160 HydrophobicContact CE2-CB 3.98Å; Y154-P160 HydrophobicContact CG-CB 4.31Å; P160-T201 HydrophobicContact CB-CG2 3.91Å; P160-T201 HydrophobicContact CG-CG2 4.48Å; P160-T201 WeakPolarHBondContact CG-OG1 3.35Å; P160-N235 PolarHBondContact O-ND2 3.17Å
161	P	88.9	Confident	68.2	Low	7 Å²	7	49 Å²	49	5%	0.045	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-59.5	145.7	169.5	28	-34	0	0	0	110.8	Y154 N194 D196	Y154-P161 VanDerWaalsContact CE1-CD 3.46Å; Y154-P161 HydrophobicContact CE1-CG 3.94Å; Y154-P161 HydrophobicContact CE2-CG 4.43Å; Y154-P161 WeakPolarHBondContact OH-CG 3.49Å; P161-N194 CarbonylContact C-O 3.57Å; P161-N194 VanDerWaalsContact CA-O 3.25Å; P161-N194 WeakPolarHBondContact CA-O 3.47Å; P161-D196 HydrophobicContact CB-CB 3.6Å; P161-D196 HydrophobicContact CG-CB 3.76Å
162	V	92.2	Very high	69.1	Low	1 Å²	1	44 Å²	44	1%	0.006	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-88.2	163.7	175.8	-53.4	0	0	0	0	110.6	F191 N194 Q195 D196 S233	V162-F191 WeakPolarHBondContact CG1-O 3.34Å; V162-N194 WeakPolarHBondContact CG2-O 3.23Å; V162-N194 PolarHBondContact N-O 3.03Å; V162-Q195 HydrophobicContact CG2-CB 4.47Å; V162-Q195 HydrophobicContact CG2-CG 3.83Å; V162-Q195 CarbonylContact O-C 3.58Å; V162-Q195 VanDerWaalsContact O-CA 3.29Å; V162-Q195 WeakPolarHBondContact O-CA 3.32Å; V162-D196 PolarHBondContact O-N 3.02Å; V162-S233 WeakPolarHBondContact CG1-OG 3.47Å
163	C	93.9	Very high	69.8	Low	3 Å²	3	50.4 Å²	50.4	2%	0.02	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-65.6	150.8	177	-60.3	0	0	0	0	111.6	Q165 C199 Y255	C163-Q165 PolarHBondContact O-N 3.39Å; C163-Q165 PolarHBondContact O-NE2 3.44Å; C163-C199 VanDerWaalsContact CA-CB 3.4Å; C163-C199 WeakPolarHBondContact CA-SG 3.36Å; C163-C199 HydrophobicContact CB-CB 3.79Å; C163-C199 WeakPolarHBondContact CB-SG 3.46Å; C163-C199 VanDerWaalsContact N-CB 3.3Å; C163-C199 WeakPolarHBondContact SG-CB 3.39Å; C163-C199 CovalentContact SG-SG 2.03Å; C163-C199 PolarHBondContact SG-SG 3.3Å; C163-Y255 PolarHBondContact SG-O 3Å
164	P	93.3	Very high	70.6	Confident	7 Å²	7	49.4 Å²	49.4	5%	0.045	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-62.1	133.4	-178.1	-21.7	35.8	0	0	0	111.6	D196 E197 L260 I439 I443	P164-D196 VanDerWaalsContact CD-O 3.24Å; P164-D196 WeakPolarHBondContact CD-O 3.38Å; P164-E197 HydrophobicContact CG-CG 3.81Å; P164-L260 HydrophobicContact CB-CD1 3.95Å; P164-L260 HydrophobicContact CG-CD1 3.7Å; P164-I439 HydrophobicContact CB-CG2 3.51Å; P164-I439 HydrophobicContact CG-CD1 4.49Å; P164-I439 HydrophobicContact CG-CG2 3.77Å; P164-I443 HydrophobicContact CB-CD1 4.13Å; P164-I443 HydrophobicContact CB-CG1 4.33Å
165	Q	91.3	Very high	71.3	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.009	29%	0.291	C	S	.	.			trans	-156.6	148.4	-172.9	58.5	-165.2	-82	0	0	111.2	C163 Q195 E230 Y231 G232	C163-Q165 PolarHBondContact O-N 3.39Å; C163-Q165 PolarHBondContact O-NE2 3.44Å; Q165-Q195 PolarHBondContact O-NE2 2.73Å; Q165-Q195 PolarHBondContact O-OE1 2.95Å; Q165-E230 WeakPolarHBondContact CB-O 3.04Å; Q165-Y231 VanDerWaalsContact OE1-CA 3.22Å; Q165-Y231 VanDerWaalsContact OE1-CB 3.25Å; Q165-G232 PolarHBondContact NE2-O 2.95Å
166	P	85.6	Confident	72.3	Confident	18 Å²	18	54.7 Å²	54.7	12%	0.117	28%	0.278	C	S	.	.			trans	-51.9	150.2	173.2	-29	37.6	0	0	0	113.7	M168 I443 Q446 E447	P166-M168 PolarHBondContact O-N 3.45Å; P166-I443 HydrophobicContact CB-CG2 4.45Å; P166-I443 HydrophobicContact CG-CG2 4.45Å; P166-Q446 HydrophobicContact CG-CG 4.17Å; P166-Q446 VanDerWaalsContact CG-NE2 3.3Å; P166-E447 HydrophobicContact CB-CG 3.74Å; P166-E447 HydrophobicContact CG-CG 4.08Å
167	S	74.9	Confident	73.1	Confident	80 Å²	80	51.3 Å²	51.3	56%	0.559	26%	0.263	S	S	*	.			trans	-65.2	129.1	169.9	-73.5	0	0	0	0	108.7	H169 E447	S167-H169 PolarHBondContact O-N 3.31Å; S167-H169 PolarHBondContact O-ND1 3.49Å; S167-E447 PolarHBondContact N-OE1 2.88Å
168	M	69	Low	73.9	Confident	35 Å²	35	48.9 Å²	48.9	17%	0.172	25%	0.246	C	C	.	.			trans	-70.9	98.6	179	-161.5	-179.3	55.3	0	0	109.2	P166 V170 L185 L189 Y231	P166-M168 PolarHBondContact O-N 3.45Å; M168-V170 HydrophobicContact CE-CG2 3.6Å; M168-V170 HydrophobicContact CG-CG2 3.66Å; M168-V170 PolarHBondContact O-N 3.01Å; M168-V170 HydrophobicContact SD-CG2 3.89Å; M168-L185 HydrophobicContact CE-CB 3.86Å; M168-L185 HydrophobicContact CE-CD2 3.65Å; M168-L185 HydrophobicContact CE-CG 4.34Å; M168-L185 HydrophobicContact SD-CD2 3.52Å; M168-L185 VanDerWaalsContact SD-CD2 3.52Å; M168-L189 HydrophobicContact CB-CD2 4.05Å; M168-L189 HydrophobicContact CE-CD2 3.67Å; M168-L189 HydrophobicContact CE-CG 3.84Å; M168-Y231 HydrophobicContact CG-CE2 4.47Å; M168-Y231 HydrophobicContact SD-CD2 4.23Å; M168-Y231 HydrophobicContact SD-CE2 3.63Å
169	H	56.8	Low	74.2	Confident	143 Å²	143	51.6 Å²	51.6	66%	0.662	26%	0.256	S	S	*	.			trans	-77.8	71.4	178.5	-68.1	83.8	0	0	0	110.4	S167 E447	S167-H169 PolarHBondContact O-N 3.31Å; S167-H169 PolarHBondContact O-ND1 3.49Å; H169-E447 IonicContact CE1-OE1 3.7Å
170	V	57.5	Low	73.6	Confident	24 Å²	24	52.5 Å²	52.5	15%	0.145	26%	0.259	C	S	.	.			trans	-85.1	121.3	171.5	-171.2	0	0	0	0	108.1	M168 L172 I177 L185	M168-V170 HydrophobicContact CE-CG2 3.6Å; M168-V170 HydrophobicContact CG-CG2 3.66Å; M168-V170 PolarHBondContact O-N 3.01Å; M168-V170 HydrophobicContact SD-CG2 3.89Å; V170-L172 HydrophobicContact CB-CD2 3.97Å; V170-L172 HydrophobicContact CB-CG 3.98Å; V170-L172 HydrophobicContact CG1-CD2 3.57Å; V170-L172 HydrophobicContact CG1-CG 3.95Å; V170-L172 PolarHBondContact O-N 2.87Å; V170-I177 HydrophobicContact CG1-CD1 4.38Å; V170-L185 HydrophobicContact CG1-CD1 3.73Å; V170-L185 HydrophobicContact CG2-CB 4.29Å; V170-L185 HydrophobicContact CG2-CD1 3.95Å; V170-L185 HydrophobicContact CG2-CD2 4.29Å; V170-L185 HydrophobicContact CG2-CG 4.4Å
171	H	57.3	Low	73	Confident	125 Å²	125	52.7 Å²	52.7	58%	0.579	26%	0.261	S	S	*	.			trans	-70.1	72.8	165.3	-66.2	-63	0	0	0	109.3	E173 D174	H171-E173 PolarHBondContact O-N 3.4Å; H171-D174 VanDerWaalsContact O-CB 3.29Å; H171-D174 WeakPolarHBondContact O-CB 3.33Å; H171-D174 PolarHBondContact O-N 2.96Å
172	L	61.9	Low	72.3	Confident	48 Å²	48	55.5 Å²	55.5	25%	0.251	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-16.9	-177.3	-69.5	171.8	0	0	0	113	V170 D174 K182 I186 L189	V170-L172 HydrophobicContact CB-CD2 3.97Å; V170-L172 HydrophobicContact CB-CG 3.98Å; V170-L172 HydrophobicContact CG1-CD2 3.57Å; V170-L172 HydrophobicContact CG1-CG 3.95Å; V170-L172 PolarHBondContact O-N 2.87Å; L172-D174 VanDerWaalsContact C-N 3.28Å; L172-K182 HydrophobicContact CD2-CG 4.13Å; L172-K182 WeakPolarHBondContact O-CE 3.41Å; L172-K182 PolarHBondContact O-NZ 3.34Å; L172-I186 HydrophobicContact CD1-CG1 3.96Å; L172-I186 HydrophobicContact CD2-CD1 4.14Å; L172-I186 HydrophobicContact CD2-CG1 3.6Å; L172-I186 HydrophobicContact CG-CG1 4.4Å; L172-L189 HydrophobicContact CD1-CD1 4.17Å
173	E	61	Low	71.3	Confident	183 Å²	183	57.1 Å²	57.1	86%	0.855	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-12.6	176.1	-61.5	-175.6	176.5	0	0	113.5	H171 K175	H171-E173 PolarHBondContact O-N 3.4Å; E173-K175 PolarHBondContact O-N 2.93Å
174	D	67.3	Low	70.4	Confident	20 Å²	20	57.6 Å²	57.6	11%	0.107	28%	0.282	C	S	.	.			trans	-69.5	115.3	-177.8	-164.9	-17.7	0	0	0	111.6	H171 L172 D176 I177 H551 K552	H171-D174 VanDerWaalsContact O-CB 3.29Å; H171-D174 WeakPolarHBondContact O-CB 3.33Å; H171-D174 PolarHBondContact O-N 2.96Å; L172-D174 VanDerWaalsContact C-N 3.28Å; D174-D176 PolarHBondContact O-N 3.24Å; D174-D176 WeakPolarHBondContact OD1-CB 3.23Å; D174-D176 PolarHBondContact OD1-N 3.47Å; D174-I177 HydrophobicContact CB-CD1 3.88Å; D174-I177 HydrophobicContact CB-CG1 4.01Å; D174-I177 PolarHBondContact O-N 2.97Å; D174-H551 IonicContact OD2-CD2 3.66Å; D174-H551 IonicContact OD2-CE1 3.37Å; D174-H551 PolarHBondContact OD2-CE1 3.2Å; D174-H551 IonicContact OD2-NE2 3.71Å; D174-H551 PolarHBondContact OD2-NE2 2.86Å; D174-K552 WeakPolarHBondContact OD2-CE 3.36Å; D174-K552 IonicContact OD2-NZ 2.7Å; D174-K552 PolarHBondContact OD2-NZ 3.43Å
175	K	66.5	Low	69.5	Low	181 Å²	181	57.6 Å²	57.6	79%	0.787	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-15	179.8	-64.7	-175.9	-178.8	179.3	0	113	E173	E173-K175 PolarHBondContact O-N 2.93Å
176	D	67.5	Low	68.9	Low	47 Å²	47	60.7 Å²	60.7	25%	0.251	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-9.1	180	-72.4	-30.8	0	0	0	113.4	D174 K709 M713	D174-D176 PolarHBondContact O-N 3.24Å; D174-D176 WeakPolarHBondContact OD1-CB 3.23Å; D174-D176 PolarHBondContact OD1-N 3.47Å; D176-K709 WeakPolarHBondContact OD1-CE 3.5Å; D176-K709 IonicContact OD1-NZ 2.66Å; D176-K709 PolarHBondContact OD1-NZ 2.77Å; D176-M713 HydrophobicContact CB-CE 4.14Å; D176-M713 WeakPolarHBondContact O-CE 3.49Å
177	I	69.7	Low	68.5	Low	15 Å²	15	60.9 Å²	60.9	8%	0.077	30%	0.297	C	S	.	.	S	Bend	trans	-77.3	128.5	175	-60.5	174.4	0	0	0	109.1	V170 D174 K179 V181 K182	V170-I177 HydrophobicContact CG1-CD1 4.38Å; D174-I177 HydrophobicContact CB-CD1 3.88Å; D174-I177 HydrophobicContact CB-CG1 4.01Å; D174-I177 PolarHBondContact O-N 2.97Å; I177-K179 PolarHBondContact O-N 2.72Å; I177-V181 HydrophobicContact CG2-CB 4.03Å; I177-V181 HydrophobicContact CG2-CG1 4.07Å; I177-K182 HydrophobicContact CG2-CB 4.02Å
178	P	69.2	Low	68.8	Low	11 Å²	11	57.3 Å²	57.3	7%	0.071	27%	0.271	C	S	.	.			trans	-55.8	140.3	174.6	-25.1	33.9	0	0	0	111.9	Q180 V181 K182 Y545 M713	P178-Q180 PolarHBondContact O-N 3.41Å; P178-V181 HydrophobicContact CB-CG2 4.13Å; P178-V181 HydrophobicContact CG-CG2 4.28Å; P178-V181 PolarHBondContact O-N 3.3Å; P178-V181 VanDerWaalsContact O-N 3.1Å; P178-K182 PolarHBondContact O-N 3.39Å; P178-Y545 VanDerWaalsContact CD-CD2 3.49Å; P178-Y545 HydrophobicContact CG-CD2 3.77Å; P178-Y545 HydrophobicContact CG-CE1 4.32Å; P178-Y545 HydrophobicContact CG-CE2 3.42Å; P178-Y545 VanDerWaalsContact CG-CE2 3.42Å; P178-Y545 HydrophobicContact CG-CG 4.39Å; P178-M713 WeakPolarHBondContact CB-O 3.19Å; P178-M713 HydrophobicContact CG-CB 4.27Å
179	K	70.9	Confident	69.5	Low	102 Å²	102	57.8 Å²	57.8	44%	0.443	27%	0.274	S	S	.	.	H	α-helix	trans	-51.8	-43.4	-178	-176.3	-174.3	172.8	-167.1	0	111.4	I177 V181 K182 D183 E742	I177-K179 PolarHBondContact O-N 2.72Å; K179-V181 PolarHBondContact O-N 3.26Å; K179-K182 PolarHBondContact O-N 3.49Å; K179-D183 WeakPolarHBondContact CE-OD2 3.46Å; K179-D183 WeakPolarHBondContact CG-OD2 3.25Å; K179-D183 WeakPolarHBondContact O-CB 2.98Å; K179-D183 PolarHBondContact O-N 3.4Å; K179-E742 IonicContact NZ-OE1 2.77Å; K179-E742 PolarHBondContact NZ-OE1 3.1Å; K179-E742 VanDerWaalsContact NZ-OE1 3.1Å
180	Q	68.2	Low	70.8	Confident	47 Å²	47	53.1 Å²	53.1	22%	0.22	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-46.5	-178.8	-57.4	87.9	-20.3	0	0	112.2	P178 K182 D183 R184 Q699	P178-Q180 PolarHBondContact O-N 3.41Å; Q180-K182 VanDerWaalsContact C-N 3.34Å; Q180-D183 PolarHBondContact O-N 2.84Å; Q180-R184 WeakPolarHBondContact O-CB 3.38Å; Q180-R184 PolarHBondContact O-N 3.16Å; Q180-Q699 VanDerWaalsContact NE2-CD 3.3Å
181	V	70	Confident	72.2	Confident	8 Å²	8	53.1 Å²	53.1	5%	0.048	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-44.3	178.3	-179.9	0	0	0	0	110	I177 P178 K179 R184 L185 N542	I177-V181 HydrophobicContact CG2-CB 4.03Å; I177-V181 HydrophobicContact CG2-CG1 4.07Å; P178-V181 HydrophobicContact CB-CG2 4.13Å; P178-V181 HydrophobicContact CG-CG2 4.28Å; P178-V181 PolarHBondContact O-N 3.3Å; P178-V181 VanDerWaalsContact O-N 3.1Å; K179-V181 PolarHBondContact O-N 3.26Å; V181-R184 PolarHBondContact O-N 3.31Å; V181-L185 HydrophobicContact CG1-CD1 3.91Å; V181-L185 WeakPolarHBondContact O-CD1 3.38Å; V181-L185 WeakPolarHBondContact O-CG 3.26Å; V181-L185 PolarHBondContact O-N 3.29Å; V181-N542 WeakPolarHBondContact CG2-OD1 3.3Å
182	K	73.6	Confident	73.6	Confident	66 Å²	66	47.8 Å²	47.8	29%	0.287	23%	0.231	S	C	.	.	H	α-helix	trans	-62.3	-49.7	178	178.1	173.3	171.2	169.1	0	112	L172 I177 P178 K179 Q180 R184 L185 I186	L172-K182 HydrophobicContact CD2-CG 4.13Å; L172-K182 WeakPolarHBondContact O-CE 3.41Å; L172-K182 PolarHBondContact O-NZ 3.34Å; I177-K182 HydrophobicContact CG2-CB 4.02Å; P178-K182 PolarHBondContact O-N 3.39Å; K179-K182 PolarHBondContact O-N 3.49Å; Q180-K182 VanDerWaalsContact C-N 3.34Å; K182-R184 VanDerWaalsContact C-N 3.33Å; K182-R184 PolarHBondContact O-N 3.4Å; K182-L185 PolarHBondContact O-N 3.4Å; K182-I186 HydrophobicContact CD-CD1 4.47Å; K182-I186 HydrophobicContact CG-CD1 3.77Å; K182-I186 HydrophobicContact CG-CG1 4.46Å; K182-I186 VanDerWaalsContact O-CG1 3.3Å; K182-I186 WeakPolarHBondContact O-CG1 3.5Å; K182-I186 PolarHBondContact O-N 3.38Å
183	D	72.1	Confident	74.8	Confident	34 Å²	34	53.8 Å²	53.8	18%	0.182	25%	0.25	C	C	.	.	H	α-helix	trans	-58.9	-47.6	179.5	-68.7	-8.7	0	0	0	109.6	K179 Q180 L185 I186 H187	K179-D183 WeakPolarHBondContact CE-OD2 3.46Å; K179-D183 WeakPolarHBondContact CG-OD2 3.25Å; K179-D183 WeakPolarHBondContact O-CB 2.98Å; K179-D183 PolarHBondContact O-N 3.4Å; Q180-D183 PolarHBondContact O-N 2.84Å; D183-L185 VanDerWaalsContact C-N 3.35Å; D183-L185 PolarHBondContact O-N 3.4Å; D183-I186 PolarHBondContact O-N 2.88Å; D183-H187 WeakPolarHBondContact O-CB 3.47Å; D183-H187 PolarHBondContact O-CD2 3.37Å; D183-H187 PolarHBondContact O-N 3.38Å
184	R	74.6	Confident	76	Confident	14 Å²	14	48.3 Å²	48.3	5%	0.053	23%	0.226	C	C	.	.	H	α-helix	trans	-54	-48.6	175.4	176.2	168.2	-171.9	-151.8	2.4	112.7	Q180 V181 K182 H187 L188 Y237 N542 F718 P738	Q180-R184 WeakPolarHBondContact O-CB 3.38Å; Q180-R184 PolarHBondContact O-N 3.16Å; V181-R184 PolarHBondContact O-N 3.31Å; K182-R184 VanDerWaalsContact C-N 3.33Å; K182-R184 PolarHBondContact O-N 3.4Å; R184-H187 PolarHBondContact O-N 3.16Å; R184-L188 HydrophobicContact CG-CD1 4.12Å; R184-L188 WeakPolarHBondContact O-CG 3.3Å; R184-L188 PolarHBondContact O-N 3.17Å; R184-Y237 PolarHBondContact NH2-OH 3Å; R184-N542 PolarHBondContact NH1-ND2 3.01Å; R184-F718 PolarHBondContact NH1-O 3.31Å; R184-P738 WeakPolarHBondContact CA-O 3.36Å; R184-P738 VanDerWaalsContact CB-O 3.25Å; R184-P738 WeakPolarHBondContact CB-O 3.26Å; R184-P738 HydrophobicContact CG-CB 4.17Å; R184-P738 VanDerWaalsContact CG-O 3.27Å; R184-P738 WeakPolarHBondContact CG-O 3.49Å
185	L	75.6	Confident	77.1	Confident	6 Å²	6	49.1 Å²	49.1	3%	0.031	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-41.3	-179.8	-67.3	167.6	0	0	0	111.6	M168 V170 V181 K182 D183 H187 L188 L189	M168-L185 HydrophobicContact CE-CB 3.86Å; M168-L185 HydrophobicContact CE-CD2 3.65Å; M168-L185 HydrophobicContact CE-CG 4.34Å; M168-L185 HydrophobicContact SD-CD2 3.52Å; M168-L185 VanDerWaalsContact SD-CD2 3.52Å; V170-L185 HydrophobicContact CG1-CD1 3.73Å; V170-L185 HydrophobicContact CG2-CB 4.29Å; V170-L185 HydrophobicContact CG2-CD1 3.95Å; V170-L185 HydrophobicContact CG2-CD2 4.29Å; V170-L185 HydrophobicContact CG2-CG 4.4Å; V181-L185 HydrophobicContact CG1-CD1 3.91Å; V181-L185 WeakPolarHBondContact O-CD1 3.38Å; V181-L185 WeakPolarHBondContact O-CG 3.26Å; V181-L185 PolarHBondContact O-N 3.29Å; K182-L185 PolarHBondContact O-N 3.4Å; D183-L185 VanDerWaalsContact C-N 3.35Å; D183-L185 PolarHBondContact O-N 3.4Å; L185-H187 VanDerWaalsContact C-N 3.33Å; L185-H187 PolarHBondContact O-N 3.45Å; L185-L188 PolarHBondContact O-N 3.21Å; L185-L189 WeakPolarHBondContact O-CG 3.38Å; L185-L189 PolarHBondContact O-N 3.49Å
186	I	78.1	Confident	78.1	Confident	67 Å²	67	41.4 Å²	41.4	34%	0.344	20%	0.197	S	C	.	.	H	α-helix	trans	-61.4	-43.4	176.9	-70.2	169.7	0	0	0	111	L172 K182 D183 L189 P190	L172-I186 HydrophobicContact CD1-CG1 3.96Å; L172-I186 HydrophobicContact CD2-CD1 4.14Å; L172-I186 HydrophobicContact CD2-CG1 3.6Å; L172-I186 HydrophobicContact CG-CG1 4.4Å; K182-I186 HydrophobicContact CD-CD1 4.47Å; K182-I186 HydrophobicContact CG-CD1 3.77Å; K182-I186 HydrophobicContact CG-CG1 4.46Å; K182-I186 VanDerWaalsContact O-CG1 3.3Å; K182-I186 WeakPolarHBondContact O-CG1 3.5Å; K182-I186 PolarHBondContact O-N 3.38Å; D183-I186 PolarHBondContact O-N 2.88Å; I186-L189 PolarHBondContact O-N 3.3Å; I186-P190 WeakPolarHBondContact O-CD 3.47Å
187	H	77.8	Confident	79.1	Confident	22 Å²	22	39.3 Å²	39.3	10%	0.102	19%	0.186	C	C	.	.	H	α-helix	trans	-72.8	-26.2	-178.9	-71.7	-57.1	0	0	0	113.3	D183 R184 L185 P190 F191 Q735 E737	D183-H187 WeakPolarHBondContact O-CB 3.47Å; D183-H187 PolarHBondContact O-CD2 3.37Å; D183-H187 PolarHBondContact O-N 3.38Å; R184-H187 PolarHBondContact O-N 3.16Å; L185-H187 VanDerWaalsContact C-N 3.33Å; L185-H187 PolarHBondContact O-N 3.45Å; H187-P190 WeakPolarHBondContact O-CD 3.42Å; H187-F191 WeakPolarHBondContact O-CD2 3.41Å; H187-F191 WeakPolarHBondContact O-CE2 3.49Å; H187-Q735 PolarHBondContact CE1-O 2.91Å; H187-Q735 PolarHBondContact ND1-O 2.98Å; H187-E737 VanDerWaalsContact CB-O 3.25Å; H187-E737 WeakPolarHBondContact CB-O 3.42Å
188	L	81.1	Confident	79.8	Confident	5 Å²	5	38.7 Å²	38.7	3%	0.026	18%	0.183	C	C	.	.	H	α-helix	trans	-72	-36.7	173.3	-76	170.7	0	0	0	113	R184 L185 P190 F191 E227 A236 P738	R184-L188 HydrophobicContact CG-CD1 4.12Å; R184-L188 WeakPolarHBondContact O-CG 3.3Å; R184-L188 PolarHBondContact O-N 3.17Å; L185-L188 PolarHBondContact O-N 3.21Å; L188-P190 VanDerWaalsContact C-CD 3.45Å; L188-F191 PolarHBondContact O-N 2.88Å; L188-E227 HydrophobicContact CD1-CG 4.25Å; L188-A236 HydrophobicContact CD2-CB 3.68Å; L188-P738 HydrophobicContact CD2-CB 3.65Å; L188-P738 HydrophobicContact CD2-CG 4.16Å; L188-P738 HydrophobicContact CG-CB 3.72Å
189	L	82.7	Confident	80.8	Confident	46 Å²	46	38.2 Å²	38.2	24%	0.241	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-51.9	-42.7	-171.1	-77.2	169.7	0	0	0	115.2	M168 L172 L185 I186 F191 L192 R193	M168-L189 HydrophobicContact CB-CD2 4.05Å; M168-L189 HydrophobicContact CE-CD2 3.67Å; M168-L189 HydrophobicContact CE-CG 3.84Å; L172-L189 HydrophobicContact CD1-CD1 4.17Å; L185-L189 WeakPolarHBondContact O-CG 3.38Å; L185-L189 PolarHBondContact O-N 3.49Å; I186-L189 PolarHBondContact O-N 3.3Å; L189-F191 VanDerWaalsContact C-N 3.28Å; L189-F191 PolarHBondContact O-N 3.5Å; L189-L192 PolarHBondContact O-N 3.29Å; L189-R193 WeakPolarHBondContact O-CG 3.3Å
190	P	84.6	Confident	81.8	Confident	45 Å²	45	33.4 Å²	33.4	29%	0.292	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-59.5	-34.3	178.9	-25.3	35.7	0	0	0	114.1	I186 H187 L188 L192	I186-P190 WeakPolarHBondContact O-CD 3.47Å; H187-P190 WeakPolarHBondContact O-CD 3.42Å; L188-P190 VanDerWaalsContact C-CD 3.45Å; P190-L192 VanDerWaalsContact C-N 3.29Å; P190-L192 PolarHBondContact O-N 3.35Å
191	F	86	Confident	82.8	Confident	23 Å²	23	31.2 Å²	31.2	10%	0.101	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-72.5	-23.2	-179.6	-62.7	-85.4	0	0	0	112.8	M47 L159 V162 H187 L188 L189 N235 A236 L736	M47-F191 HydrophobicContact CE-CE1 4.28Å; L159-F191 HydrophobicContact CD1-CD1 3.79Å; L159-F191 HydrophobicContact CD1-CE1 3.69Å; V162-F191 WeakPolarHBondContact CG1-O 3.34Å; H187-F191 WeakPolarHBondContact O-CD2 3.41Å; H187-F191 WeakPolarHBondContact O-CE2 3.49Å; L188-F191 PolarHBondContact O-N 2.88Å; L189-F191 VanDerWaalsContact C-N 3.28Å; L189-F191 PolarHBondContact O-N 3.5Å; F191-N235 HydrophobicContact CD1-CB 4.33Å; F191-N235 WeakPolarHBondContact CD1-O 3.26Å; F191-N235 WeakPolarHBondContact CE1-O 3.21Å; F191-A236 HydrophobicContact CB-CB 4.23Å; F191-A236 HydrophobicContact CD1-CB 4.41Å; F191-A236 HydrophobicContact CD2-CB 4.02Å; F191-A236 HydrophobicContact CG-CB 3.96Å; F191-L736 WeakPolarHBondContact CE2-O 3.47Å; F191-L736 WeakPolarHBondContact CZ-O 3.35Å
192	L	88.3	Confident	83.9	Confident	14 Å²	14	30.8 Å²	30.8	7%	0.073	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-93.2	-0.8	-173.3	-52.8	-177.6	0	0	0	114	L189 P190 Q195 Y231	L189-L192 PolarHBondContact O-N 3.29Å; P190-L192 VanDerWaalsContact C-N 3.29Å; P190-L192 PolarHBondContact O-N 3.35Å; L192-Q195 WeakPolarHBondContact O-CG 3.02Å; L192-Q195 PolarHBondContact O-NE2 3.44Å; L192-Y231 HydrophobicContact CD1-CD2 4.18Å
193	R	85.4	Confident	84.8	Confident	173 Å²	173	27.7 Å²	27.7	65%	0.653	13%	0.132	S	C	*	.	S	Bend	trans	-77.5	-42.6	-173.2	-67.5	-177.5	-176.4	175.5	0.1	113.9	L189 Q195	L189-R193 WeakPolarHBondContact O-CG 3.3Å; R193-Q195 PolarHBondContact O-N 3.37Å
194	N	87.6	Confident	85.8	Confident	68 Å²	68	26.1 Å²	26.1	36%	0.364	12%	0.124	S	C	.	.	S	Bend	trans	-85.3	98.4	-176.4	-177.4	21.1	0	0	0	109.4	P161 V162	P161-N194 CarbonylContact C-O 3.57Å; P161-N194 VanDerWaalsContact CA-O 3.25Å; P161-N194 WeakPolarHBondContact CA-O 3.47Å; V162-N194 WeakPolarHBondContact CG2-O 3.23Å; V162-N194 PolarHBondContact N-O 3.03Å
195	Q	89.3	Confident	86.7	Confident	37 Å²	37	25.6 Å²	25.6	17%	0.173	12%	0.122	C	C	.	.	B	Isolated β-bridge	trans	-112.4	138.3	-173.3	-53.7	-173	11.8	0	0	112.6	K131 V162 Q165 L192 R193	K131-Q195 PolarHBondContact NZ-O 2.95Å; V162-Q195 HydrophobicContact CG2-CB 4.47Å; V162-Q195 HydrophobicContact CG2-CG 3.83Å; V162-Q195 CarbonylContact O-C 3.58Å; V162-Q195 VanDerWaalsContact O-CA 3.29Å; V162-Q195 WeakPolarHBondContact O-CA 3.32Å; Q165-Q195 PolarHBondContact O-NE2 2.73Å; Q165-Q195 PolarHBondContact O-OE1 2.95Å; L192-Q195 WeakPolarHBondContact O-CG 3.02Å; L192-Q195 PolarHBondContact O-NE2 3.44Å; R193-Q195 PolarHBondContact O-N 3.37Å
196	D	87.7	Confident	87.6	Confident	20 Å²	20	26 Å²	26	11%	0.107	13%	0.125	C	C	.	.			trans	-148.9	152.9	175.1	-152.7	-57.7	0	0	0	110.8	K131 P161 V162 P164 D198 C199	K131-D196 WeakPolarHBondContact CD-OD2 3.39Å; K131-D196 WeakPolarHBondContact CE-OD2 3.46Å; K131-D196 IonicContact NZ-OD2 3.72Å; K131-D196 PolarHBondContact NZ-OD2 2.84Å; P161-D196 HydrophobicContact CB-CB 3.6Å; P161-D196 HydrophobicContact CG-CB 3.76Å; V162-D196 PolarHBondContact O-N 3.02Å; P164-D196 VanDerWaalsContact CD-O 3.24Å; P164-D196 WeakPolarHBondContact CD-O 3.38Å; D196-D198 PolarHBondContact O-N 3.35Å; D196-D198 PolarHBondContact OD1-N 3.09Å; D196-C199 WeakPolarHBondContact O-CB 3.39Å
197	E	87.8	Confident	88.2	Confident	3 Å²	3	23 Å²	23	1%	0.014	11%	0.109	C	C	.	.	S	Bend	trans	-68.6	-26.4	169.2	-85	-177.8	-162.6	0	0	111.8	L97 A134 R137 P164 C199 L260 I439	L97-E197 WeakPolarHBondContact CD1-O 3.39Å; A134-E197 HydrophobicContact CB-CB 4.18Å; A134-E197 WeakPolarHBondContact CB-OE2 3.19Å; A134-E197 PolarHBondContact N-OE2 3.24Å; R137-E197 IonicContact CZ-OE1 3.68Å; R137-E197 IonicContact CZ-OE2 3.83Å; R137-E197 VanDerWaalsContact NE-CD 3.3Å; R137-E197 IonicContact NE-OE1 3.03Å; R137-E197 PolarHBondContact NE-OE1 3.16Å; R137-E197 IonicContact NE-OE2 3.55Å; R137-E197 PolarHBondContact NE-OE2 2.75Å; R137-E197 VanDerWaalsContact NH2-CD 3.34Å; R137-E197 IonicContact NH2-OE1 2.87Å; R137-E197 PolarHBondContact NH2-OE1 2.83Å; R137-E197 IonicContact NH2-OE2 2.97Å; R137-E197 PolarHBondContact NH2-OE2 2.97Å; P164-E197 HydrophobicContact CG-CG 3.81Å; E197-C199 PolarHBondContact O-N 2.96Å; E197-L260 HydrophobicContact CG-CD1 4.14Å; E197-I439 HydrophobicContact CB-CD1 4.22Å; E197-I439 HydrophobicContact CG-CD1 3.76Å; E197-I439 HydrophobicContact CG-CG1 3.84Å; E197-I439 WeakPolarHBondContact OE1-CG1 3.44Å
198	D	84.5	Confident	88.6	Confident	2 Å²	2	24.5 Å²	24.5	1%	0.011	12%	0.117	C	C	.	.			trans	-79.7	57.9	173.4	-160.2	-3	0	0	0	112.4	R93 V99 H101 Y154 D196	R93-D198 IonicContact CZ-OD1 2.93Å; R93-D198 IonicContact CZ-OD2 2.96Å; R93-D198 VanDerWaalsContact NH1-CG 3.32Å; R93-D198 IonicContact NH1-OD1 3.65Å; R93-D198 PolarHBondContact NH1-OD1 3.49Å; R93-D198 IonicContact NH1-OD2 2.64Å; R93-D198 PolarHBondContact NH1-OD2 3.17Å; R93-D198 IonicContact NH2-OD2 2.71Å; R93-D198 PolarHBondContact NH2-OD2 2.74Å; V99-D198 HydrophobicContact CB-CB 4.3Å; V99-D198 HydrophobicContact CG2-CB 4.01Å; H101-D198 IonicContact NE2-OD2 2.81Å; H101-D198 PolarHBondContact NE2-OD2 3.33Å; Y154-D198 PolarHBondContact OH-O 3.42Å; D196-D198 PolarHBondContact O-N 3.35Å; D196-D198 PolarHBondContact OD1-N 3.09Å
199	C	90.3	Very high	88.4	Confident	1 Å²	1	27.2 Å²	27.2	1%	0.007	13%	0.129	C	C	.	.			trans	-106	0.3	-171.6	64	0	0	0	0	114.5	C163 D196 E197 T201 N254	C163-C199 VanDerWaalsContact CA-CB 3.4Å; C163-C199 WeakPolarHBondContact CA-SG 3.36Å; C163-C199 HydrophobicContact CB-CB 3.79Å; C163-C199 WeakPolarHBondContact CB-SG 3.46Å; C163-C199 VanDerWaalsContact N-CB 3.3Å; C163-C199 WeakPolarHBondContact SG-CB 3.39Å; C163-C199 CovalentContact SG-SG 2.03Å; C163-C199 PolarHBondContact SG-SG 3.3Å; D196-C199 WeakPolarHBondContact O-CB 3.39Å; E197-C199 PolarHBondContact O-N 2.96Å; C199-T201 PolarHBondContact O-N 3.29Å; C199-T201 PolarHBondContact O-OG1 3.3Å; C199-N254 WeakPolarHBondContact O-CB 3.18Å
200	L	91.8	Very high	87.7	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.005	13%	0.131	C	C	.	.			trans	-77.8	73	-173.9	-59.9	-176.2	0	0	0	111.2	R93 Y94 A95 L97 R256 D278	R93-L200 WeakPolarHBondContact CA-O 3.25Å; Y94-L200 VanDerWaalsContact CD1-C 3.42Å; Y94-L200 WeakPolarHBondContact CD1-O 3.29Å; Y94-L200 HydrophobicContact CE1-CB 4.01Å; Y94-L200 WeakPolarHBondContact CE1-O 3.33Å; Y94-L200 HydrophobicContact CE2-CB 4.12Å; Y94-L200 PolarHBondContact N-O 2.94Å; Y94-L200 WeakPolarHBondContact OH-CD2 3.48Å; A95-L200 HydrophobicContact CB-CB 4.08Å; A95-L200 HydrophobicContact CB-CD1 3.63Å; L97-L200 HydrophobicContact CD1-CD1 4.5Å; L97-L200 HydrophobicContact CD2-CD1 3.92Å; L97-L200 HydrophobicContact CG-CD1 3.98Å; L200-R256 HydrophobicContact CD2-CG 4.21Å; L200-D278 HydrophobicContact CD2-CB 4.25Å
201	T	90.6	Very high	86.8	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	154.6	-173.2	59.8	0	0	0	0	113.3	V92 R93 Y154 P160 C199 L253 N254	V92-T201 CarbonylContact O-C 3.54Å; V92-T201 WeakPolarHBondContact O-CA 3.31Å; R93-T201 HydrophobicContact CG-CG2 3.91Å; Y154-T201 HydrophobicContact CD2-CG2 4.31Å; Y154-T201 HydrophobicContact CE2-CG2 3.81Å; P160-T201 HydrophobicContact CB-CG2 3.91Å; P160-T201 HydrophobicContact CG-CG2 4.48Å; P160-T201 WeakPolarHBondContact CG-OG1 3.35Å; C199-T201 PolarHBondContact O-N 3.29Å; C199-T201 PolarHBondContact O-OG1 3.3Å; T201-L253 WeakPolarHBondContact O-CA 3.38Å; T201-N254 PolarHBondContact O-N 2.9Å; T201-N254 PolarHBondContact OG1-ND2 3.45Å
202	L	92.7	Very high	85.7	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	150.1	169.6	-51.6	177.5	0	0	0	110.3	G91 V92 Y94 I204 I251 T252 L253 A282 W285 I286	G91-L202 PolarHBondContact N-O 3.27Å; V92-L202 HydrophobicContact CB-CB 4.37Å; V92-L202 PolarHBondContact N-O 3.38Å; V92-L202 PolarHBondContact O-N 3Å; Y94-L202 HydrophobicContact CD1-CD1 4.5Å; Y94-L202 HydrophobicContact CD1-CD2 3.54Å; Y94-L202 HydrophobicContact CD1-CG 3.66Å; Y94-L202 HydrophobicContact CE1-CD2 3.94Å; Y94-L202 HydrophobicContact CE1-CG 4.48Å; Y94-L202 HydrophobicContact CG-CD2 4.26Å; Y94-L202 HydrophobicContact CG-CG 4.26Å; L202-I204 HydrophobicContact CB-CG1 4.31Å; L202-I251 HydrophobicContact CB-CG2 4.08Å; L202-I251 HydrophobicContact CD1-CG2 4.33Å; L202-I251 HydrophobicContact CD2-CG2 4.23Å; L202-I251 HydrophobicContact CG-CG2 4.44Å; L202-T252 CarbonylContact C-O 3.5Å; L202-T252 WeakPolarHBondContact CA-O 3.26Å; L202-L253 HydrophobicContact CD2-CB 3.47Å; L202-L253 VanDerWaalsContact CD2-CB 3.47Å; L202-A282 HydrophobicContact CD2-CB 4.09Å; L202-W285 HydrophobicContact CD1-CD2 4.08Å; L202-W285 HydrophobicContact CD1-CE3 3.34Å; L202-W285 HydrophobicContact CD1-CZ3 3.62Å; L202-I286 HydrophobicContact CD1-CG1 4.07Å
203	N	92	Very high	84.7	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.1	161.9	-51.5	-57	0	0	0	107.9	Y89 Y90 G91 Y205 N235 I251 T252	Y89-N203 CarbonylContact O-C 3.42Å; Y89-N203 WeakPolarHBondContact O-CA 3.35Å; Y90-N203 WeakPolarHBondContact CA-OD1 3.41Å; Y90-N203 HydrophobicContact CD1-CB 3.96Å; G91-N203 PolarHBondContact N-OD1 3.24Å; N203-Y205 HydrophobicContact CB-CE2 4.08Å; N203-N235 PolarHBondContact ND2-OD1 3.12Å; N203-I251 CarbonylContact O-C 3.53Å; N203-I251 VanDerWaalsContact O-CA 3.27Å; N203-I251 WeakPolarHBondContact O-CA 3.35Å; N203-T252 WeakPolarHBondContact CB-OG1 3.31Å; N203-T252 PolarHBondContact N-O 3.49Å; N203-T252 PolarHBondContact ND2-OG1 3.46Å; N203-T252 VanDerWaalsContact ND2-OG1 3.08Å; N203-T252 PolarHBondContact O-N 3.5Å
204	I	93.6	Very high	83.9	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	128.3	-172	-53.1	172.6	0	0	0	109.3	A88 Y89 V92 L202 V206 V249 I251 W285 I290 F293	A88-I204 CarbonylContact C-O 3.45Å; A88-I204 WeakPolarHBondContact CA-O 3.45Å; Y89-I204 PolarHBondContact N-O 3.09Å; Y89-I204 PolarHBondContact O-N 3.47Å; V92-I204 HydrophobicContact CB-CD1 4.39Å; V92-I204 HydrophobicContact CG1-CD1 4.47Å; V92-I204 HydrophobicContact CG2-CD1 4.16Å; L202-I204 HydrophobicContact CB-CG1 4.31Å; I204-V206 HydrophobicContact CG2-CG2 3.9Å; I204-V249 HydrophobicContact CG2-CG1 3.78Å; I204-I251 HydrophobicContact CG1-CG1 4.35Å; I204-I251 HydrophobicContact CG1-CG2 4.3Å; I204-I251 HydrophobicContact CG2-CG1 4.26Å; I204-W285 HydrophobicContact CD1-CH2 3.77Å; I204-W285 HydrophobicContact CD1-CZ3 3.75Å; I204-I290 HydrophobicContact CG2-CD1 4.43Å; I204-F293 HydrophobicContact CD1-CD1 4.36Å; I204-F293 HydrophobicContact CD1-CE1 3.79Å; I204-F293 HydrophobicContact CD1-CE2 4.16Å; I204-F293 HydrophobicContact CD1-CZ 3.64Å; I204-F293 HydrophobicContact CG2-CD1 3.96Å; I204-F293 HydrophobicContact CG2-CE1 4.28Å; I204-F293 HydrophobicContact CG2-CG 4.46Å
205	Y	94	Very high	83.2	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.016	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	111.2	-177.8	-60.5	-93.2	0	0	0	109.3	V86 A88 Y90 N203 D238 L239 V249 G250 T252	V86-Y205 HydrophobicContact CG1-CD1 4.26Å; A88-Y205 HydrophobicContact CB-CD1 4.08Å; A88-Y205 HydrophobicContact CB-CE1 4.23Å; Y90-Y205 HydrophobicContact CE1-CE1 4.1Å; Y90-Y205 AromaticContact CE1-CZ 3.99Å; N203-Y205 HydrophobicContact CB-CE2 4.08Å; Y205-D238 WeakPolarHBondContact CE1-OD1 3.33Å; Y205-L239 HydrophobicContact CD2-CB 3.71Å; Y205-L239 HydrophobicContact CD2-CD1 4.19Å; Y205-L239 HydrophobicContact CD2-CG 4.2Å; Y205-L239 HydrophobicContact CE2-CB 4.01Å; Y205-L239 HydrophobicContact CE2-CD1 4.36Å; Y205-L239 HydrophobicContact CE2-CG 4.16Å; Y205-L239 HydrophobicContact CG-CB 4.09Å; Y205-V249 WeakPolarHBondContact O-CA 3.36Å; Y205-G250 PolarHBondContact N-O 3.41Å; Y205-G250 PolarHBondContact O-N 2.86Å; Y205-T252 HydrophobicContact CE2-CG2 4.48Å
206	V	93.5	Very high	82.9	Confident	15 Å²	15	47.4 Å²	47.4	9%	0.091	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	114.9	-175.3	-173.9	0	0	0	0	109.6	V86 I87 Y89 I204 V249 F293	V86-V206 CarbonylContact C-O 3.56Å; V86-V206 WeakPolarHBondContact CA-O 3.5Å; I87-V206 PolarHBondContact N-O 3.36Å; I87-V206 PolarHBondContact O-N 3.42Å; Y89-V206 HydrophobicContact CD2-CG2 4.29Å; Y89-V206 HydrophobicContact CE2-CG2 4.05Å; I204-V206 HydrophobicContact CG2-CG2 3.9Å; V206-V249 HydrophobicContact CG2-CG1 4.29Å; V206-F293 HydrophobicContact CG2-CB 4.03Å; V206-F293 HydrophobicContact CG2-CD1 3.97Å; V206-F293 HydrophobicContact CG2-CG 4.49Å
207	P	91.9	Very high	83	Confident	2 Å²	2	50.7 Å²	50.7	1%	0.013	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	137.2	178.7	-1.1	14.2	0	0	0	110.7	V86 Q209 R218 A243 T248	V86-P207 HydrophobicContact CG2-CB 4.42Å; P207-Q209 PolarHBondContact O-N 2.99Å; P207-R218 VanDerWaalsContact CD-NH1 3.3Å; P207-R218 PolarHBondContact O-NH1 2.92Å; P207-R218 PolarHBondContact O-NH2 3.41Å; P207-A243 HydrophobicContact CG-CB 4.27Å; P207-A243 WeakPolarHBondContact CG-O 2.97Å; P207-T248 WeakPolarHBondContact CD-O 3.44Å; P207-T248 WeakPolarHBondContact CG-O 3.5Å
208	Q	86.2	Confident	83.3	Confident	55 Å²	55	50.8 Å²	50.8	26%	0.257	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-60.7	136.1	178.6	-167.4	170.5	10.2	0	0	110.3	N84 P85	N84-Q208 PolarHBondContact ND2-O 3.25Å; P85-Q208 HydrophobicContact CB-CB 4.49Å; P85-Q208 WeakPolarHBondContact O-CB 3.25Å; P85-Q208 PolarHBondContact O-N 3.48Å
209	Q	75	Confident	83.8	Confident	61 Å²	61	50.8 Å²	50.8	29%	0.285	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-81.1	132.7	178.8	-168.1	179.4	-22.1	0	0	110.5	P207 K211 R213 S215 R218	P207-Q209 PolarHBondContact O-N 2.99Å; Q209-K211 PolarHBondContact O-N 2.81Å; Q209-K211 VanDerWaalsContact O-N 3.17Å; Q209-R213 PolarHBondContact NE2-O 2.9Å; Q209-R213 VanDerWaalsContact NE2-O 3.12Å; Q209-S215 VanDerWaalsContact NE2-CA 3.32Å; Q209-R218 VanDerWaalsContact CA-NH2 3.27Å
210	D	69.4	Low	84.1	Confident	54 Å²	54	50.8 Å²	50.8	29%	0.289	25%	0.245	S	C	.	.	P	Polyproline II helix	trans	-62.3	117	165.1	-74.2	-27	0	0	0	109	T212 R213	D210-T212 PolarHBondContact O-N 3.06Å; D210-R213 HydrophobicContact CB-CG 4.18Å; D210-R213 PolarHBondContact O-N 2.85Å; D210-R213 IonicContact OD2-NE 2.71Å
211	K	65.9	Low	84.4	Confident	184 Å²	184	50.7 Å²	50.7	80%	0.8	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-16.7	178.6	-64.5	-174.5	178.4	-175.8	0	113.1	Q209	Q209-K211 PolarHBondContact O-N 2.81Å; Q209-K211 VanDerWaalsContact O-N 3.17Å
212	T	62.5	Low	84.8	Confident	133 Å²	133	50.7 Å²	50.7	82%	0.816	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-18.6	178.6	59.1	0	0	0	0	113.9	D210	D210-T212 PolarHBondContact O-N 3.06Å
213	R	66.8	Low	85	Confident	92 Å²	92	50.9 Å²	50.9	35%	0.347	25%	0.246	S	C	.	.	S	Bend	trans	-94.7	140.5	-179.2	-67.6	-174.2	-177.1	-177.3	3.5	110.8	Q209 D210 S215	Q209-R213 PolarHBondContact NE2-O 2.9Å; Q209-R213 VanDerWaalsContact NE2-O 3.12Å; D210-R213 HydrophobicContact CB-CG 4.18Å; D210-R213 PolarHBondContact O-N 2.85Å; D210-R213 IonicContact OD2-NE 2.71Å; R213-S215 PolarHBondContact O-N 3.36Å
214	K	68.8	Low	85.3	Confident	195 Å²	195	50.9 Å²	50.9	85%	0.848	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-53.2	135.8	172.7	-72.1	-175.5	179.3	-179.8	0	109.8	Y216	K214-Y216 PolarHBondContact O-N 3.47Å
215	S	73	Confident	85.4	Confident	92 Å²	92	50.9 Å²	50.9	64%	0.643	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-59.9	124	173.2	-174.4	0	0	0	0	110.2	Q209 R213	Q209-S215 VanDerWaalsContact NE2-CA 3.32Å; R213-S215 PolarHBondContact O-N 3.36Å
216	Y	84	Confident	85.1	Confident	80 Å²	80	50.7 Å²	50.7	31%	0.314	25%	0.245	S	C	.	.			trans	-136.3	151.2	173.6	79.1	-84.9	0	0	0	108.6	K214 R218 D247 N294	K214-Y216 PolarHBondContact O-N 3.47Å; Y216-R218 HydrophobicContact CD2-CG 4.41Å; Y216-R218 HydrophobicContact CE2-CB 4.39Å; Y216-R218 HydrophobicContact CE2-CG 3.76Å; Y216-D247 PolarHBondContact OH-OD2 2.87Å; Y216-N294 PolarHBondContact O-ND2 3.45Å
217	K	89.5	Confident	84.7	Confident	89 Å²	89	50.6 Å²	50.6	39%	0.387	24%	0.244	S	C	.	.	P	Polyproline II helix	trans	-81.2	126.8	175.2	-63.8	-62.3	-174.5	-171.5	0	109.2	E291 N294 N296	K217-E291 PolarHBondContact NZ-O 3.34Å; K217-N294 WeakPolarHBondContact CA-O 3.45Å; K217-N294 WeakPolarHBondContact CD-OD1 3.49Å; K217-N294 PolarHBondContact NZ-OD1 2.94Å; K217-N296 HydrophobicContact CB-CB 3.79Å
218	R	92.5	Very high	84.5	Confident	5 Å²	5	51 Å²	51	2%	0.019	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	146.5	-173.3	-62	-178.8	-171.9	-173.6	14.3	112.1	P207 Q209 Y216 D247 V249 N294 G295 N296	P207-R218 VanDerWaalsContact CD-NH1 3.3Å; P207-R218 PolarHBondContact O-NH1 2.92Å; P207-R218 PolarHBondContact O-NH2 3.41Å; Q209-R218 VanDerWaalsContact CA-NH2 3.27Å; Y216-R218 HydrophobicContact CD2-CG 4.41Å; Y216-R218 HydrophobicContact CE2-CB 4.39Å; Y216-R218 HydrophobicContact CE2-CG 3.76Å; R218-D247 IonicContact CZ-OD1 3.69Å; R218-D247 IonicContact NE-OD1 3.28Å; R218-D247 PolarHBondContact NE-OD1 3.34Å; R218-D247 IonicContact NH1-OD1 2.83Å; R218-D247 PolarHBondContact NH1-OD1 3.29Å; R218-D247 IonicContact NH2-OD1 3.78Å; R218-V249 HydrophobicContact CB-CG2 4.4Å; R218-N294 PolarHBondContact N-O 3.09Å; R218-G295 CarbonylContact O-C 3.53Å; R218-G295 WeakPolarHBondContact O-CA 3.32Å; R218-N296 WeakPolarHBondContact O-CB 3.01Å; R218-N296 PolarHBondContact O-N 3.47Å
219	P	95.7	Very high	84.7	Confident	3 Å²	3	48.4 Å²	48.4	2%	0.019	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	155.7	167	-22.8	33.3	0	0	0	111.8	T248 V249 E299 I762 H763	P219-T248 HydrophobicContact CB-CG2 4.07Å; P219-T248 HydrophobicContact CG-CG2 4.36Å; P219-T248 WeakPolarHBondContact O-CB 3.44Å; P219-V249 PolarHBondContact O-N 3.35Å; P219-E299 HydrophobicContact CB-CB 4.32Å; P219-I762 HydrophobicContact CB-CG2 4.02Å; P219-H763 WeakPolarHBondContact CG-ND1 3.2Å
220	I	97.3	Very high	85.3	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.4	-179.3	-59.2	146.4	0	0	0	108.9	V249 I251 I286 I290 N296 E299 I300 T301	I220-V249 WeakPolarHBondContact CA-O 3.24Å; I220-V249 HydrophobicContact CG1-CB 4.08Å; I220-I251 HydrophobicContact CG2-CD1 3.61Å; I220-I251 HydrophobicContact CG2-CG1 4.15Å; I220-I286 HydrophobicContact CD1-CG2 4.45Å; I220-I286 HydrophobicContact CG2-CG2 4.45Å; I220-I290 HydrophobicContact CD1-CB 3.95Å; I220-I290 HydrophobicContact CD1-CG1 3.43Å; I220-I290 VanDerWaalsContact CD1-CG1 3.43Å; I220-I290 HydrophobicContact CD1-CG2 3.37Å; I220-I290 HydrophobicContact CG1-CG1 3.85Å; I220-N296 VanDerWaalsContact CD1-O 3.31Å; I220-N296 WeakPolarHBondContact CD1-O 3.43Å; I220-E299 PolarHBondContact N-O 2.99Å; I220-I300 HydrophobicContact CD1-CG1 4.35Å; I220-T301 PolarHBondContact O-N 3.29Å
221	F	97.7	Very high	86.2	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.7	165.8	68.8	-86.5	0	0	0	111.5	L239 L242 T248 V249 G250 I251 T301 I303 I762	F221-L239 HydrophobicContact CD2-CD1 4.42Å; F221-L239 HydrophobicContact CE2-CB 4.29Å; F221-L239 HydrophobicContact CE2-CD1 3.61Å; F221-L239 HydrophobicContact CE2-CD2 4.02Å; F221-L239 HydrophobicContact CE2-CG 4.19Å; F221-L239 HydrophobicContact CZ-CB 4.14Å; F221-L239 HydrophobicContact CZ-CD1 4.16Å; F221-L242 HydrophobicContact CE1-CD2 4.48Å; F221-L242 HydrophobicContact CE1-CG 4.42Å; F221-L242 HydrophobicContact CE2-CD2 3.93Å; F221-L242 HydrophobicContact CZ-CB 4.44Å; F221-L242 HydrophobicContact CZ-CD2 3.8Å; F221-L242 HydrophobicContact CZ-CG 3.98Å; F221-T248 VanDerWaalsContact CD1-OG1 3.26Å; F221-T248 WeakPolarHBondContact CD1-OG1 3.31Å; F221-T248 WeakPolarHBondContact CE1-OG1 2.97Å; F221-V249 PolarHBondContact N-O 2.69Å; F221-G250 VanDerWaalsContact CE1-CA 3.42Å; F221-I251 PolarHBondContact O-N 2.87Å; F221-T301 CarbonylContact C-O 3.56Å; F221-T301 VanDerWaalsContact CA-O 3.26Å; F221-T301 WeakPolarHBondContact CA-O 3.46Å; F221-I303 HydrophobicContact CB-CD1 3.88Å; F221-I303 HydrophobicContact CB-CG1 4.3Å; F221-I303 HydrophobicContact CD2-CD1 3.79Å; F221-I303 HydrophobicContact CG-CD1 4.11Å; F221-I762 HydrophobicContact CB-CD1 4.24Å; F221-I762 HydrophobicContact CD1-CD1 4.11Å; F221-I762 HydrophobicContact CG-CD1 4.22Å
222	L	98.2	Very high	87.3	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	115.1	175.6	177.6	63	0	0	0	109.2	V224 I251 L253 L279 I283 I286 T301 L302 I303	L222-V224 HydrophobicContact CG-CG2 4.47Å; L222-I251 CarbonylContact C-O 3.52Å; L222-I251 WeakPolarHBondContact CA-O 3.28Å; L222-I251 HydrophobicContact CD1-CB 3.88Å; L222-I251 HydrophobicContact CD1-CG2 3.64Å; L222-L253 HydrophobicContact CD1-CB 4.39Å; L222-L253 HydrophobicContact CD1-CD2 4Å; L222-L253 HydrophobicContact CG-CD2 4.3Å; L222-L279 HydrophobicContact CD2-CD1 4.03Å; L222-I283 HydrophobicContact CD2-CG1 4Å; L222-I286 HydrophobicContact CD1-CD1 3.92Å; L222-I286 HydrophobicContact CD2-CD1 3.91Å; L222-I286 HydrophobicContact CG-CD1 4.33Å; L222-T301 PolarHBondContact N-O 3.14Å; L222-L302 HydrophobicContact CB-CD2 4.05Å; L222-L302 HydrophobicContact CD2-CD2 3.98Å; L222-L302 HydrophobicContact CG-CD2 4.5Å; L222-I303 PolarHBondContact O-N 2.9Å
223	F	97.7	Very high	88.8	Confident	3 Å²	3	31.3 Å²	31.3	1%	0.013	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	114.6	178.7	-172.1	-93.6	0	0	0	111.4	Y237 L239 I251 T252 L253 I303 L722 L726	F223-Y237 HydrophobicContact CD1-CD2 4.33Å; F223-Y237 HydrophobicContact CD1-CG 4.24Å; F223-Y237 AromaticContact CE1-CD1 3.89Å; F223-Y237 HydrophobicContact CE1-CD1 3.89Å; F223-Y237 AromaticContact CE1-CD2 3.7Å; F223-Y237 HydrophobicContact CE1-CD2 3.7Å; F223-Y237 HydrophobicContact CE1-CE1 4.22Å; F223-Y237 HydrophobicContact CE1-CE2 4.05Å; F223-Y237 AromaticContact CE1-CG 3.6Å; F223-Y237 HydrophobicContact CE1-CG 3.6Å; F223-Y237 HydrophobicContact CZ-CD1 4.19Å; F223-Y237 HydrophobicContact CZ-CE1 4.34Å; F223-Y237 HydrophobicContact CZ-CG 4.35Å; F223-L239 HydrophobicContact CB-CD1 4.11Å; F223-L239 HydrophobicContact CB-CD2 4.43Å; F223-L239 HydrophobicContact CG-CD2 4.49Å; F223-I251 PolarHBondContact N-O 3.11Å; F223-T252 HydrophobicContact CB-CG2 4.31Å; F223-T252 HydrophobicContact CD1-CG2 4.39Å; F223-L253 WeakPolarHBondContact O-CD2 3.22Å; F223-I303 CarbonylContact C-O 3.57Å; F223-I303 WeakPolarHBondContact CA-O 3.48Å; F223-I303 HydrophobicContact CD2-CB 4.17Å; F223-I303 HydrophobicContact CD2-CG2 3.78Å; F223-I303 HydrophobicContact CE2-CG2 4.12Å; F223-L722 HydrophobicContact CE2-CD2 4.36Å; F223-L722 HydrophobicContact CZ-CD1 4.32Å; F223-L722 HydrophobicContact CZ-CD2 4.37Å; F223-L726 HydrophobicContact CE2-CD2 4.49Å
224	V	97.8	Very high	90	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	107.7	179.1	-171.2	0	0	0	0	109.3	L222 L253 Y255 L279 I303 Y305 L311 V312	L222-V224 HydrophobicContact CG-CG2 4.47Å; V224-L253 HydrophobicContact CB-CD2 4.1Å; V224-L253 HydrophobicContact CG1-CD2 4.21Å; V224-L253 HydrophobicContact CG2-CD2 3.79Å; V224-Y255 HydrophobicContact CG1-CD1 4.47Å; V224-Y255 HydrophobicContact CG1-CE1 3.9Å; V224-L279 HydrophobicContact CG2-CD1 3.97Å; V224-I303 PolarHBondContact N-O 3.41Å; V224-Y305 PolarHBondContact O-N 2.95Å; V224-L311 HydrophobicContact CG1-CD2 4.29Å; V224-V312 HydrophobicContact CB-CG2 3.94Å; V224-V312 HydrophobicContact CG1-CG2 4.39Å; V224-V312 HydrophobicContact CG2-CG2 3.52Å
225	H	95.1	Very high	91.1	Very high	1 Å²	1	18 Å²	18	1%	0.005	9%	0.091	C	C	.	.			trans	-64.6	157.9	177.5	76.6	91.2	0	0	0	111.8	E227 S233 G234 Y237 L253 Y255 G308	H225-E227 IonicContact CE1-OE2 3.06Å; H225-E227 IonicContact CG-OE2 3.98Å; H225-E227 IonicContact ND1-OE2 3.1Å; H225-E227 PolarHBondContact ND1-OE2 2.88Å; H225-S233 VanDerWaalsContact CD2-C 3.49Å; H225-S233 PolarHBondContact CE1-N 3.31Å; H225-S233 VanDerWaalsContact CE1-N 3.34Å; H225-S233 VanDerWaalsContact CG-C 3.48Å; H225-S233 PolarHBondContact ND1-N 2.88Å; H225-G234 PolarHBondContact CD2-N 2.81Å; H225-Y237 HydrophobicContact CB-CD2 4.23Å; H225-Y237 HydrophobicContact CB-CE2 3.79Å; H225-L253 PolarHBondContact CD2-O 2.66Å; H225-L253 VanDerWaalsContact CD2-O 3.28Å; H225-Y255 AromaticContact CD2-CE1 3.57Å; H225-Y255 AromaticContact CE1-CE1 3.69Å; H225-Y255 AromaticContact CE1-CZ 3.8Å; H225-Y255 AromaticContact NE2-CD1 3.63Å; H225-Y255 AromaticContact NE2-CE1 3.22Å; H225-Y255 WeakPolarHBondContact NE2-CE1 3.32Å; H225-Y255 AromaticContact NE2-CZ 3.8Å; H225-Y255 PolarHBondContact O-OH 3.43Å; H225-G308 VanDerWaalsContact O-CA 3.3Å; H225-G308 WeakPolarHBondContact O-CA 3.11Å
226	G	88.6	Confident	91.8	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	6%	0.061	C	C	.	.			trans	-166.8	49.5	-170.6	0	0	0	0	0	116.3	Y305 H307 G308	G226-Y305 VanDerWaalsContact CA-O 3.26Å; G226-Y305 WeakPolarHBondContact CA-O 3.36Å; G226-H307 PolarHBondContact O-N 2.85Å; G226-G308 VanDerWaalsContact CA-N 3.28Å
227	E	85.6	Confident	92	Very high	13 Å²	13	10 Å²	10	6%	0.061	5%	0.046	C	C	.	.	S	Bend	trans	-58.7	-56.9	167.4	-59.5	68.3	-149.9	0	0	109.8	L188 H225 Y231 G232 Y237 H307	L188-E227 HydrophobicContact CD1-CG 4.25Å; H225-E227 IonicContact CE1-OE2 3.06Å; H225-E227 IonicContact CG-OE2 3.98Å; H225-E227 IonicContact ND1-OE2 3.1Å; H225-E227 PolarHBondContact ND1-OE2 2.88Å; E227-Y231 HydrophobicContact CB-CD2 4.13Å; E227-Y231 HydrophobicContact CB-CE2 3.59Å; E227-Y231 HydrophobicContact CG-CE2 4.17Å; E227-G232 VanDerWaalsContact OE2-CA 3.24Å; E227-G232 WeakPolarHBondContact OE2-CA 3.42Å; E227-Y237 VanDerWaalsContact OE1-CE2 3.25Å; E227-Y237 WeakPolarHBondContact OE1-CE2 3.4Å; E227-Y237 VanDerWaalsContact OE1-CZ 3.28Å; E227-Y237 PolarHBondContact OE1-OH 3.23Å; E227-H307 PolarHBondContact O-ND1 3.44Å
228	S	87	Confident	92	Very high	11 Å²	11	6.8 Å²	6.8	8%	0.077	3%	0.033	C	C	.	.			trans	-154.9	167.4	177.9	179.5	0	0	0	0	109.7	E230 Y231 H307	S228-E230 PolarHBondContact OG-N 3.42Å; S228-Y231 PolarHBondContact N-O 2.98Å; S228-Y231 VanDerWaalsContact O-O 3.07Å; S228-H307 WeakPolarHBondContact CA-ND1 3.44Å
229	Y	90.8	Very high	92	Very high	0 Å²	0	6.5 Å²	6.5	0%	0	3%	0.032	C	C	.	.	S	Bend	trans	-76.3	-10.5	163.4	-69.7	-39.8	0	0	0	113.1	L257 G258 F262 H307 A310 L311 T456 L458 P460	Y229-L257 CarbonylContact O-C 3.55Å; Y229-L257 WeakPolarHBondContact O-CA 3.27Å; Y229-L257 WeakPolarHBondContact O-CB 3.27Å; Y229-G258 PolarHBondContact O-N 3.21Å; Y229-F262 HydrophobicContact CD1-CE1 4.45Å; Y229-F262 AromaticContact CD1-CE2 3.86Å; Y229-F262 HydrophobicContact CD1-CE2 3.86Å; Y229-F262 AromaticContact CD1-CZ 3.51Å; Y229-F262 HydrophobicContact CD1-CZ 3.51Å; Y229-F262 HydrophobicContact CE1-CZ 4.11Å; Y229-F262 AromaticContact CG-CE2 3.81Å; Y229-F262 HydrophobicContact CG-CE2 3.81Å; Y229-F262 AromaticContact CG-CZ 3.79Å; Y229-F262 HydrophobicContact CG-CZ 3.79Å; Y229-H307 HydrophobicContact CD1-CB 3.99Å; Y229-H307 AromaticContact CD2-CD2 3.65Å; Y229-H307 HydrophobicContact CE1-CB 3.74Å; Y229-H307 WeakPolarHBondContact CE1-O 3.35Å; Y229-H307 AromaticContact CE2-CD2 3.66Å; Y229-H307 HydrophobicContact CG-CB 4.46Å; Y229-H307 AromaticContact CG-CD2 3.98Å; Y229-H307 PolarHBondContact OH-O 3.48Å; Y229-A310 WeakPolarHBondContact OH-CB 3.47Å; Y229-L311 HydrophobicContact CE1-CB 4.33Å; Y229-L311 HydrophobicContact CE1-CD1 4.28Å; Y229-T456 HydrophobicContact CD2-CG2 3.89Å; Y229-T456 HydrophobicContact CE2-CG2 4.47Å; Y229-L458 VanDerWaalsContact CB-O 3.27Å; Y229-L458 WeakPolarHBondContact CB-O 3.5Å; Y229-P460 HydrophobicContact CE1-CG 4.46Å; Y229-P460 HydrophobicContact CE2-CG 4.09Å
230	E	87.5	Confident	91.8	Very high	33 Å²	33	6.4 Å²	6.4	15%	0.154	3%	0.032	C	C	.	.	S	Bend	trans	-97.3	-25.6	-178.6	-64	-172.8	177.3	0	0	114.1	Q165 S228	Q165-E230 WeakPolarHBondContact CB-O 3.04Å; S228-E230 PolarHBondContact OG-N 3.42Å
231	Y	88.2	Confident	91.5	Very high	38 Å²	38	6.4 Å²	6.4	15%	0.149	3%	0.032	C	C	.	.	S	Bend	trans	-152.6	156	-177.7	78	-91.7	0	0	0	110.4	Q165 M168 L192 E227 S228	Q165-Y231 VanDerWaalsContact OE1-CA 3.22Å; Q165-Y231 VanDerWaalsContact OE1-CB 3.25Å; M168-Y231 HydrophobicContact CG-CE2 4.47Å; M168-Y231 HydrophobicContact SD-CD2 4.23Å; M168-Y231 HydrophobicContact SD-CE2 3.63Å; L192-Y231 HydrophobicContact CD1-CD2 4.18Å; E227-Y231 HydrophobicContact CB-CD2 4.13Å; E227-Y231 HydrophobicContact CB-CE2 3.59Å; E227-Y231 HydrophobicContact CG-CE2 4.17Å; S228-Y231 PolarHBondContact N-O 2.98Å; S228-Y231 VanDerWaalsContact O-O 3.07Å
232	G	90	Very high	91.2	Very high	2 Å²	2	6.5 Å²	6.5	2%	0.021	3%	0.032	C	C	.	.			trans	143.8	170.7	-177.9	0	0	0	0	0	112.9	Q165 E227	Q165-G232 PolarHBondContact NE2-O 2.95Å; E227-G232 VanDerWaalsContact OE2-CA 3.24Å; E227-G232 WeakPolarHBondContact OE2-CA 3.42Å
233	S	93.2	Very high	91	Very high	1 Å²	1	6.5 Å²	6.5	1%	0.007	3%	0.032	C	C	.	.			trans	-163.6	145.6	170.8	178	0	0	0	0	112.2	V162 H225 N235 N254	V162-S233 WeakPolarHBondContact CG1-OG 3.47Å; H225-S233 VanDerWaalsContact CD2-C 3.49Å; H225-S233 PolarHBondContact CE1-N 3.31Å; H225-S233 VanDerWaalsContact CE1-N 3.34Å; H225-S233 VanDerWaalsContact CG-C 3.48Å; H225-S233 PolarHBondContact ND1-N 2.88Å; S233-N235 PolarHBondContact O-N 3.49Å; S233-N235 VanDerWaalsContact OG-CB 3.29Å; S233-N235 WeakPolarHBondContact OG-CB 3.37Å; S233-N235 PolarHBondContact OG-N 2.91Å; S233-N254 WeakPolarHBondContact CA-OD1 3.41Å; S233-N254 PolarHBondContact OG-OD1 3.27Å
234	G	92.9	Very high	90.7	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.032	C	C	.	.	G	3₁₀ helix	trans	-68.5	-18	168.4	0	0	0	0	0	113.7	H225 A236 Y237 T252 N254	H225-G234 PolarHBondContact CD2-N 2.81Å; G234-A236 PolarHBondContact O-N 3.46Å; G234-Y237 PolarHBondContact O-N 2.87Å; G234-T252 WeakPolarHBondContact O-CB 3.35Å; G234-T252 PolarHBondContact O-OG1 3.18Å; G234-N254 PolarHBondContact N-OD1 3.32Å
235	N	90.7	Very high	90.4	Very high	8 Å²	8	8 Å²	8	4%	0.043	4%	0.038	C	C	.	.	G	3₁₀ helix	trans	-66.8	-20.8	-179.4	-64	-4	0	0	0	113.3	L159 P160 F191 N203 S233 Y237 N254	L159-N235 HydrophobicContact CD1-CB 4.32Å; L159-N235 HydrophobicContact CD2-CB 4.47Å; P160-N235 PolarHBondContact O-ND2 3.17Å; F191-N235 HydrophobicContact CD1-CB 4.33Å; F191-N235 WeakPolarHBondContact CD1-O 3.26Å; F191-N235 WeakPolarHBondContact CE1-O 3.21Å; N203-N235 PolarHBondContact ND2-OD1 3.12Å; S233-N235 PolarHBondContact O-N 3.49Å; S233-N235 VanDerWaalsContact OG-CB 3.29Å; S233-N235 WeakPolarHBondContact OG-CB 3.37Å; S233-N235 PolarHBondContact OG-N 2.91Å; N235-Y237 VanDerWaalsContact C-N 3.26Å; N235-Y237 PolarHBondContact O-N 3.21Å; N235-N254 PolarHBondContact OD1-ND2 3.06Å; N235-N254 VanDerWaalsContact OD1-ND2 3.09Å
236	A	87.4	Confident	90.1	Very high	2 Å²	2	8 Å²	8	2%	0.017	4%	0.038	C	C	.	.	G	3₁₀ helix	trans	-79.2	-6.3	-177.3	0	0	0	0	0	113.9	L188 F191 G234 P738	L188-A236 HydrophobicContact CD2-CB 3.68Å; F191-A236 HydrophobicContact CB-CB 4.23Å; F191-A236 HydrophobicContact CD1-CB 4.41Å; F191-A236 HydrophobicContact CD2-CB 4.02Å; F191-A236 HydrophobicContact CG-CB 3.96Å; G234-A236 PolarHBondContact O-N 3.46Å; A236-P738 WeakPolarHBondContact O-CD 3.38Å
237	Y	89.5	Confident	90.3	Very high	1 Å²	1	8.5 Å²	8.5	0%	0.004	4%	0.041	C	C	.	.			trans	-117.9	107.5	-172.8	-61.8	-80.8	0	0	0	110.1	R184 F223 H225 E227 G234 N235 L722 L726 P738 F739	R184-Y237 PolarHBondContact NH2-OH 3Å; F223-Y237 HydrophobicContact CD1-CD2 4.33Å; F223-Y237 HydrophobicContact CD1-CG 4.24Å; F223-Y237 AromaticContact CE1-CD1 3.89Å; F223-Y237 HydrophobicContact CE1-CD1 3.89Å; F223-Y237 AromaticContact CE1-CD2 3.7Å; F223-Y237 HydrophobicContact CE1-CD2 3.7Å; F223-Y237 HydrophobicContact CE1-CE1 4.22Å; F223-Y237 HydrophobicContact CE1-CE2 4.05Å; F223-Y237 AromaticContact CE1-CG 3.6Å; F223-Y237 HydrophobicContact CE1-CG 3.6Å; F223-Y237 HydrophobicContact CZ-CD1 4.19Å; F223-Y237 HydrophobicContact CZ-CE1 4.34Å; F223-Y237 HydrophobicContact CZ-CG 4.35Å; H225-Y237 HydrophobicContact CB-CD2 4.23Å; H225-Y237 HydrophobicContact CB-CE2 3.79Å; E227-Y237 VanDerWaalsContact OE1-CE2 3.25Å; E227-Y237 WeakPolarHBondContact OE1-CE2 3.4Å; E227-Y237 VanDerWaalsContact OE1-CZ 3.28Å; E227-Y237 PolarHBondContact OE1-OH 3.23Å; G234-Y237 PolarHBondContact O-N 2.87Å; N235-Y237 VanDerWaalsContact C-N 3.26Å; N235-Y237 PolarHBondContact O-N 3.21Å; Y237-L722 HydrophobicContact CE1-CD1 3.84Å; Y237-L726 HydrophobicContact CD1-CD1 3.93Å; Y237-P738 HydrophobicContact CD1-CG 4.47Å; Y237-P738 HydrophobicContact CE1-CG 4.1Å; Y237-F739 HydrophobicContact CD1-CZ 4.4Å; Y237-F739 HydrophobicContact CE1-CZ 4.28Å
238	D	88.1	Confident	90.6	Very high	21 Å²	21	7.9 Å²	7.9	11%	0.112	4%	0.038	C	C	.	.			trans	-79.5	127	170.6	-173	5.3	0	0	0	109.7	Y205 S240	Y205-D238 WeakPolarHBondContact CE1-OD1 3.33Å; D238-S240 WeakPolarHBondContact OD1-CB 3.38Å; D238-S240 PolarHBondContact OD1-N 3.46Å; D238-S240 PolarHBondContact OD1-OG 3.13Å; D238-S240 PolarHBondContact OD2-OG 2.99Å
239	L	92.9	Very high	91.1	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	3%	0.034	C	C	.	.			trans	-104.7	2.9	179.1	-56.9	-179.5	0	0	0	112.3	Y205 F221 F223 V241 L242 A243 T252 L726	Y205-L239 HydrophobicContact CD2-CB 3.71Å; Y205-L239 HydrophobicContact CD2-CD1 4.19Å; Y205-L239 HydrophobicContact CD2-CG 4.2Å; Y205-L239 HydrophobicContact CE2-CB 4.01Å; Y205-L239 HydrophobicContact CE2-CD1 4.36Å; Y205-L239 HydrophobicContact CE2-CG 4.16Å; Y205-L239 HydrophobicContact CG-CB 4.09Å; F221-L239 HydrophobicContact CD2-CD1 4.42Å; F221-L239 HydrophobicContact CE2-CB 4.29Å; F221-L239 HydrophobicContact CE2-CD1 3.61Å; F221-L239 HydrophobicContact CE2-CD2 4.02Å; F221-L239 HydrophobicContact CE2-CG 4.19Å; F221-L239 HydrophobicContact CZ-CB 4.14Å; F221-L239 HydrophobicContact CZ-CD1 4.16Å; F223-L239 HydrophobicContact CB-CD1 4.11Å; F223-L239 HydrophobicContact CB-CD2 4.43Å; F223-L239 HydrophobicContact CG-CD2 4.49Å; L239-V241 PolarHBondContact O-N 3.37Å; L239-L242 PolarHBondContact O-N 3.41Å; L239-A243 WeakPolarHBondContact O-CB 3.25Å; L239-A243 PolarHBondContact O-N 2.68Å; L239-T252 HydrophobicContact CD1-CG2 3.47Å; L239-T252 VanDerWaalsContact CD1-CG2 3.47Å; L239-T252 HydrophobicContact CD2-CG2 4.39Å; L239-T252 HydrophobicContact CG-CG2 3.77Å; L239-L726 HydrophobicContact CD2-CD2 3.74Å
240	S	91	Very high	91.4	Very high	0 Å²	0	7.3 Å²	7.3	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-56.2	-48.3	-172	64.7	0	0	0	0	113.1	L78 V86 D238 S244	L78-S240 WeakPolarHBondContact CD2-OG 3.5Å; V86-S240 WeakPolarHBondContact CG2-O 3.49Å; D238-S240 WeakPolarHBondContact OD1-CB 3.38Å; D238-S240 PolarHBondContact OD1-N 3.46Å; D238-S240 PolarHBondContact OD1-OG 3.13Å; D238-S240 PolarHBondContact OD2-OG 2.99Å; S240-S244 VanDerWaalsContact O-CB 3.32Å; S240-S244 WeakPolarHBondContact O-CB 3.2Å; S240-S244 PolarHBondContact O-N 3.29Å
241	V	91.2	Very high	91.9	Very high	1 Å²	1	5.8 Å²	5.8	1%	0.006	3%	0.027	C	C	.	.	H	α-helix	trans	-65.4	-48.3	178.7	164.7	0	0	0	0	111.9	L78 L83 L239 S244 Y245 F730 I731 M755	L78-V241 HydrophobicContact CD1-CG2 4.3Å; L78-V241 HydrophobicContact CD2-CG2 4.09Å; L83-V241 HydrophobicContact CD1-CG1 4.14Å; L83-V241 HydrophobicContact CD1-CG2 4.15Å; L239-V241 PolarHBondContact O-N 3.37Å; V241-S244 PolarHBondContact O-N 3.48Å; V241-Y245 WeakPolarHBondContact O-CB 3.4Å; V241-Y245 PolarHBondContact O-N 2.84Å; V241-F730 HydrophobicContact CG1-CD2 4.36Å; V241-I731 HydrophobicContact CB-CD1 3.99Å; V241-I731 HydrophobicContact CB-CG1 4.29Å; V241-I731 HydrophobicContact CG2-CD1 3.35Å; V241-I731 HydrophobicContact CG2-CG1 3.31Å; V241-M755 HydrophobicContact CG1-CE 4.44Å; V241-M755 HydrophobicContact CG1-SD 4.08Å
242	L	92.3	Very high	92.3	Very high	1 Å²	1	4 Å²	4	1%	0.005	2%	0.02	C	C	.	.	H	α-helix	trans	-63.6	-43.5	179.1	178.1	61	0	0	0	111.7	F221 L239 S244 Y245 S246 L726 M755 L758	F221-L242 HydrophobicContact CE1-CD2 4.48Å; F221-L242 HydrophobicContact CE1-CG 4.42Å; F221-L242 HydrophobicContact CE2-CD2 3.93Å; F221-L242 HydrophobicContact CZ-CB 4.44Å; F221-L242 HydrophobicContact CZ-CD2 3.8Å; F221-L242 HydrophobicContact CZ-CG 3.98Å; L239-L242 PolarHBondContact O-N 3.41Å; L242-S244 PolarHBondContact O-N 2.94Å; L242-Y245 PolarHBondContact O-N 3.38Å; L242-S246 VanDerWaalsContact O-CB 3.28Å; L242-S246 WeakPolarHBondContact O-CB 3.44Å; L242-S246 PolarHBondContact O-N 2.88Å; L242-S246 PolarHBondContact O-OG 2.67Å; L242-L726 HydrophobicContact CD2-CD2 4.06Å; L242-M755 HydrophobicContact CD1-CB 4.38Å; L242-M755 HydrophobicContact CD1-CG 4.11Å; L242-M755 HydrophobicContact CD1-SD 4.43Å; L242-L758 HydrophobicContact CD1-CD2 3.94Å; L242-L758 HydrophobicContact CD1-CG 4.49Å; L242-L758 HydrophobicContact CD2-CD2 3.61Å; L242-L758 HydrophobicContact CG-CD2 4.44Å
243	A	93.3	Very high	92.5	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-58.6	-47.9	177.2	0	0	0	0	0	110.9	P207 L239 D247 T248	P207-A243 HydrophobicContact CG-CB 4.27Å; P207-A243 WeakPolarHBondContact CG-O 2.97Å; L239-A243 WeakPolarHBondContact O-CB 3.25Å; L239-A243 PolarHBondContact O-N 2.68Å; A243-D247 WeakPolarHBondContact O-CA 3.34Å; A243-D247 PolarHBondContact O-N 3.03Å; A243-T248 WeakPolarHBondContact CA-O 3.35Å; A243-T248 WeakPolarHBondContact CB-O 3.46Å; A243-T248 PolarHBondContact O-N 3.29Å
244	S	91.7	Very high	92.6	Very high	2 Å²	2	3.9 Å²	3.9	1%	0.014	2%	0.019	C	C	.	.	H	α-helix	trans	-65.7	-45.7	177.6	-173.2	0	0	0	0	113	N84 S240 V241 L242 D247	N84-S244 PolarHBondContact N-OG 3.15Å; N84-S244 WeakPolarHBondContact O-CB 3.42Å; N84-S244 PolarHBondContact O-OG 2.77Å; S240-S244 VanDerWaalsContact O-CB 3.32Å; S240-S244 WeakPolarHBondContact O-CB 3.2Å; S240-S244 PolarHBondContact O-N 3.29Å; V241-S244 PolarHBondContact O-N 3.48Å; L242-S244 PolarHBondContact O-N 2.94Å; S244-D247 PolarHBondContact O-N 3.33Å
245	Y	90.4	Very high	92.8	Very high	34 Å²	34	3.9 Å²	3.9	13%	0.133	2%	0.019	C	C	.	.	H	α-helix	trans	-63.5	-44.3	-179.1	-173.1	-87.3	0	0	0	112.3	L83 V241 L242 D247 V752 M755 N756	L83-Y245 HydrophobicContact CD2-CD2 4.05Å; V241-Y245 WeakPolarHBondContact O-CB 3.4Å; V241-Y245 PolarHBondContact O-N 2.84Å; L242-Y245 PolarHBondContact O-N 3.38Å; Y245-D247 VanDerWaalsContact C-N 3.35Å; Y245-V752 WeakPolarHBondContact OH-CG1 3.41Å; Y245-M755 HydrophobicContact CD1-CB 3.87Å; Y245-M755 HydrophobicContact CD2-CE 4.31Å; Y245-M755 HydrophobicContact CE1-CB 3.96Å; Y245-M755 HydrophobicContact CG-CE 4.39Å; Y245-M755 HydrophobicContact CG-SD 4.5Å; Y245-N756 VanDerWaalsContact CE1-OD1 3.23Å; Y245-N756 WeakPolarHBondContact CE1-OD1 3.44Å; Y245-N756 VanDerWaalsContact CZ-OD1 3.29Å; Y245-N756 VanDerWaalsContact OH-CG 3.23Å; Y245-N756 PolarHBondContact OH-ND2 2.86Å; Y245-N756 PolarHBondContact OH-OD1 3.42Å
246	S	90.3	Very high	93	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-85.1	-6.8	-178.5	64.1	0	0	0	0	113.8	L242 T248 A759 H763 F771	L242-S246 VanDerWaalsContact O-CB 3.28Å; L242-S246 WeakPolarHBondContact O-CB 3.44Å; L242-S246 PolarHBondContact O-N 2.88Å; L242-S246 PolarHBondContact O-OG 2.67Å; S246-T248 VanDerWaalsContact C-N 3.32Å; S246-T248 WeakPolarHBondContact O-CG2 3.49Å; S246-T248 PolarHBondContact O-N 2.92Å; S246-T248 PolarHBondContact OG-OG1 2.83Å; S246-A759 VanDerWaalsContact CB-CB 3.48Å; S246-H763 PolarHBondContact O-NE2 3.3Å; S246-F771 WeakPolarHBondContact O-CE2 3.49Å
247	D	91.3	Very high	93.3	Very high	10 Å²	10	3.6 Å²	3.6	5%	0.053	2%	0.017	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	47.4	-171.6	-160.5	16	0	0	0	112.5	Y216 R218 A243 S244 Y245 F771	Y216-D247 PolarHBondContact OH-OD2 2.87Å; R218-D247 IonicContact CZ-OD1 3.69Å; R218-D247 IonicContact NE-OD1 3.28Å; R218-D247 PolarHBondContact NE-OD1 3.34Å; R218-D247 IonicContact NH1-OD1 2.83Å; R218-D247 PolarHBondContact NH1-OD1 3.29Å; R218-D247 IonicContact NH2-OD1 3.78Å; A243-D247 WeakPolarHBondContact O-CA 3.34Å; A243-D247 PolarHBondContact O-N 3.03Å; S244-D247 PolarHBondContact O-N 3.33Å; Y245-D247 VanDerWaalsContact C-N 3.35Å; D247-F771 HydrophobicContact CB-CE2 4.42Å
248	T	93.8	Very high	93.4	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.017	C	C	.	.	S	Bend	trans	-131	160.3	-178.3	65	0	0	0	0	112.1	P207 P219 F221 A243 S246 I762 H763	P207-T248 WeakPolarHBondContact CD-O 3.44Å; P207-T248 WeakPolarHBondContact CG-O 3.5Å; P219-T248 HydrophobicContact CB-CG2 4.07Å; P219-T248 HydrophobicContact CG-CG2 4.36Å; P219-T248 WeakPolarHBondContact O-CB 3.44Å; F221-T248 VanDerWaalsContact CD1-OG1 3.26Å; F221-T248 WeakPolarHBondContact CD1-OG1 3.31Å; F221-T248 WeakPolarHBondContact CE1-OG1 2.97Å; A243-T248 WeakPolarHBondContact CA-O 3.35Å; A243-T248 WeakPolarHBondContact CB-O 3.46Å; A243-T248 PolarHBondContact O-N 3.29Å; S246-T248 VanDerWaalsContact C-N 3.32Å; S246-T248 WeakPolarHBondContact O-CG2 3.49Å; S246-T248 PolarHBondContact O-N 2.92Å; S246-T248 PolarHBondContact OG-OG1 2.83Å; T248-I762 HydrophobicContact CG2-CG2 3.86Å; T248-H763 WeakPolarHBondContact CG2-NE2 3.46Å
249	V	96.2	Very high	93.5	Very high	0 Å²	0	2.7 Å²	2.7	0%	0	1%	0.012	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.4	174.8	-178.7	0	0	0	0	109.3	I204 Y205 V206 R218 P219 I220 F221 I251 I290	I204-V249 HydrophobicContact CG2-CG1 3.78Å; Y205-V249 WeakPolarHBondContact O-CA 3.36Å; V206-V249 HydrophobicContact CG2-CG1 4.29Å; R218-V249 HydrophobicContact CB-CG2 4.4Å; P219-V249 PolarHBondContact O-N 3.35Å; I220-V249 WeakPolarHBondContact CA-O 3.24Å; I220-V249 HydrophobicContact CG1-CB 4.08Å; F221-V249 PolarHBondContact N-O 2.69Å; V249-I251 HydrophobicContact CG1-CG1 4.2Å; V249-I290 HydrophobicContact CG1-CD1 4.05Å
250	G	97.2	Very high	93.4	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	2%	0.015	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	135.5	176.4	0	0	0	0	0	111.5	Y205 F221	Y205-G250 PolarHBondContact N-O 3.41Å; Y205-G250 PolarHBondContact O-N 2.86Å; F221-G250 VanDerWaalsContact CE1-CA 3.42Å
251	I	97.5	Very high	93.5	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	2%	0.015	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	131.5	179.3	-52.5	178.3	0	0	0	110	L202 N203 I204 I220 F221 L222 F223 V249 I286 I290	L202-I251 HydrophobicContact CB-CG2 4.08Å; L202-I251 HydrophobicContact CD1-CG2 4.33Å; L202-I251 HydrophobicContact CD2-CG2 4.23Å; L202-I251 HydrophobicContact CG-CG2 4.44Å; N203-I251 CarbonylContact O-C 3.53Å; N203-I251 VanDerWaalsContact O-CA 3.27Å; N203-I251 WeakPolarHBondContact O-CA 3.35Å; I204-I251 HydrophobicContact CG1-CG1 4.35Å; I204-I251 HydrophobicContact CG1-CG2 4.3Å; I204-I251 HydrophobicContact CG2-CG1 4.26Å; I220-I251 HydrophobicContact CG2-CD1 3.61Å; I220-I251 HydrophobicContact CG2-CG1 4.15Å; F221-I251 PolarHBondContact O-N 2.87Å; L222-I251 CarbonylContact C-O 3.52Å; L222-I251 WeakPolarHBondContact CA-O 3.28Å; L222-I251 HydrophobicContact CD1-CB 3.88Å; L222-I251 HydrophobicContact CD1-CG2 3.64Å; F223-I251 PolarHBondContact N-O 3.11Å; V249-I251 HydrophobicContact CG1-CG1 4.2Å; I251-I286 HydrophobicContact CD1-CD1 3.88Å; I251-I286 HydrophobicContact CD1-CG1 3.87Å; I251-I286 HydrophobicContact CD1-CG2 4.16Å; I251-I286 HydrophobicContact CG2-CD1 4.36Å; I251-I290 HydrophobicContact CD1-CD1 3.72Å; I251-I290 HydrophobicContact CD1-CG1 4.46Å
252	T	96.8	Very high	93.5	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.016	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	154.2	163.8	69.2	0	0	0	0	110.2	L202 N203 Y205 F223 G234 L239	L202-T252 CarbonylContact C-O 3.5Å; L202-T252 WeakPolarHBondContact CA-O 3.26Å; N203-T252 WeakPolarHBondContact CB-OG1 3.31Å; N203-T252 PolarHBondContact N-O 3.49Å; N203-T252 PolarHBondContact ND2-OG1 3.46Å; N203-T252 VanDerWaalsContact ND2-OG1 3.08Å; N203-T252 PolarHBondContact O-N 3.5Å; Y205-T252 HydrophobicContact CE2-CG2 4.48Å; F223-T252 HydrophobicContact CB-CG2 4.31Å; F223-T252 HydrophobicContact CD1-CG2 4.39Å; G234-T252 WeakPolarHBondContact O-CB 3.35Å; G234-T252 PolarHBondContact O-OG1 3.18Å; L239-T252 HydrophobicContact CD1-CG2 3.47Å; L239-T252 VanDerWaalsContact CD1-CG2 3.47Å; L239-T252 HydrophobicContact CD2-CG2 4.39Å; L239-T252 HydrophobicContact CG-CG2 3.77Å
253	L	95.7	Very high	93.4	Very high	0 Å²	0	3.7 Å²	3.7	0%	0	2%	0.017	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	153.8	175.9	80.9	164.6	0	0	0	112.3	T201 L202 L222 F223 V224 H225 Y255 L279 A282	T201-L253 WeakPolarHBondContact O-CA 3.38Å; L202-L253 HydrophobicContact CD2-CB 3.47Å; L202-L253 VanDerWaalsContact CD2-CB 3.47Å; L222-L253 HydrophobicContact CD1-CB 4.39Å; L222-L253 HydrophobicContact CD1-CD2 4Å; L222-L253 HydrophobicContact CG-CD2 4.3Å; F223-L253 WeakPolarHBondContact O-CD2 3.22Å; V224-L253 HydrophobicContact CB-CD2 4.1Å; V224-L253 HydrophobicContact CG1-CD2 4.21Å; V224-L253 HydrophobicContact CG2-CD2 3.79Å; H225-L253 PolarHBondContact CD2-O 2.66Å; H225-L253 VanDerWaalsContact CD2-O 3.28Å; L253-Y255 HydrophobicContact CG-CD1 4.35Å; L253-L279 HydrophobicContact CD1-CD1 3.97Å; L253-A282 HydrophobicContact CD1-CB 3.87Å
254	N	95	Very high	93	Very high	2 Å²	2	4.6 Å²	4.6	1%	0.011	2%	0.021	C	C	.	.			trans	-103.9	139.5	160.9	-70.5	-38.3	0	0	0	109.3	Y94 C199 T201 S233 G234 N235	Y94-N254 WeakPolarHBondContact CE1-O 3.26Å; Y94-N254 PolarHBondContact OH-O 3.28Å; C199-N254 WeakPolarHBondContact O-CB 3.18Å; T201-N254 PolarHBondContact O-N 2.9Å; T201-N254 PolarHBondContact OG1-ND2 3.45Å; S233-N254 WeakPolarHBondContact CA-OD1 3.41Å; S233-N254 PolarHBondContact OG-OD1 3.27Å; G234-N254 PolarHBondContact N-OD1 3.32Å; N235-N254 PolarHBondContact OD1-ND2 3.06Å; N235-N254 VanDerWaalsContact OD1-ND2 3.09Å
255	Y	95.6	Very high	92.2	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	2%	0.023	C	C	.	.			trans	-133.4	156.8	176.4	57.7	-93.1	0	0	0	110.1	C163 V224 H225 L253 L257 A275 L311	C163-Y255 PolarHBondContact SG-O 3Å; V224-Y255 HydrophobicContact CG1-CD1 4.47Å; V224-Y255 HydrophobicContact CG1-CE1 3.9Å; H225-Y255 AromaticContact CD2-CE1 3.57Å; H225-Y255 AromaticContact CE1-CE1 3.69Å; H225-Y255 AromaticContact CE1-CZ 3.8Å; H225-Y255 AromaticContact NE2-CD1 3.63Å; H225-Y255 AromaticContact NE2-CE1 3.22Å; H225-Y255 WeakPolarHBondContact NE2-CE1 3.32Å; H225-Y255 AromaticContact NE2-CZ 3.8Å; H225-Y255 PolarHBondContact O-OH 3.43Å; L253-Y255 HydrophobicContact CG-CD1 4.35Å; Y255-L257 HydrophobicContact CD2-CD2 3.92Å; Y255-L257 HydrophobicContact CE2-CD2 3.42Å; Y255-L257 VanDerWaalsContact CE2-CD2 3.42Å; Y255-L257 PolarHBondContact O-N 3.06Å; Y255-A275 HydrophobicContact CD2-CB 3.77Å; Y255-A275 HydrophobicContact CE2-CB 4.38Å; Y255-L311 HydrophobicContact CD2-CD2 4.29Å; Y255-L311 HydrophobicContact CE1-CD2 4.31Å; Y255-L311 HydrophobicContact CE2-CD2 4.06Å
256	R	95.2	Very high	91.1	Very high	3 Å²	3	10 Å²	10	1%	0.011	5%	0.052	C	C	.	.			trans	-60.4	136.7	-178.4	-75.9	172.9	-75.6	-175.7	-6.9	111.7	R137 S139 L200 L260 G261 A275 D278	R137-R256 PolarHBondContact O-NH1 3.35Å; S139-R256 PolarHBondContact O-NH1 3.39Å; S139-R256 PolarHBondContact O-NH2 2.99Å; L200-R256 HydrophobicContact CD2-CG 4.21Å; R256-L260 HydrophobicContact CB-CB 4.37Å; R256-G261 WeakPolarHBondContact O-CA 3.45Å; R256-A275 WeakPolarHBondContact O-CB 3.1Å; R256-D278 VanDerWaalsContact CB-OD2 3.29Å; R256-D278 WeakPolarHBondContact CB-OD2 3.37Å; R256-D278 WeakPolarHBondContact CG-OD2 3.39Å; R256-D278 IonicContact CZ-OD1 3.28Å; R256-D278 IonicContact CZ-OD2 2.99Å; R256-D278 PolarHBondContact N-OD2 2.86Å; R256-D278 IonicContact NE-OD1 3.71Å; R256-D278 PolarHBondContact NE-OD1 3.32Å; R256-D278 IonicContact NE-OD2 2.64Å; R256-D278 PolarHBondContact NE-OD2 3.31Å; R256-D278 IonicContact NH2-OD1 3.38Å; R256-D278 PolarHBondContact NH2-OD1 3.33Å; R256-D278 IonicContact NH2-OD2 3.03Å
257	L	93.9	Very high	89.7	Confident	1 Å²	1	13 Å²	13	1%	0.005	7%	0.069	C	C	.	.			trans	-113	164.7	-178.6	-61.5	173.3	0	0	0	111.6	Y229 Y255 L260 G261	Y229-L257 CarbonylContact O-C 3.55Å; Y229-L257 WeakPolarHBondContact O-CA 3.27Å; Y229-L257 WeakPolarHBondContact O-CB 3.27Å; Y255-L257 HydrophobicContact CD2-CD2 3.92Å; Y255-L257 HydrophobicContact CE2-CD2 3.42Å; Y255-L257 VanDerWaalsContact CE2-CD2 3.42Å; Y255-L257 PolarHBondContact O-N 3.06Å; L257-L260 WeakPolarHBondContact O-CB 3.19Å; L257-L260 PolarHBondContact O-N 3.46Å; L257-G261 PolarHBondContact O-N 2.79Å
258	G	91.3	Very high	87.8	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	57.9	-135.4	170	0	0	0	0	0	113.9	Y229 L260 G261 F262	Y229-G258 PolarHBondContact O-N 3.21Å; G258-L260 PolarHBondContact O-N 3.36Å; G258-G261 PolarHBondContact O-N 3.47Å; G258-F262 PolarHBondContact O-N 3.1Å
259	L	90.9	Very high	86.1	Confident	2 Å²	2	25.9 Å²	25.9	1%	0.01	15%	0.146	C	C	.	.	H	α-helix	trans	-58.8	-37.9	177.6	-77.1	171.9	0	0	0	111.9	G261 L263 L356 L445 Q446 L449 L458	L259-G261 VanDerWaalsContact C-N 3.32Å; L259-G261 PolarHBondContact O-N 3.49Å; L259-L263 HydrophobicContact CD2-CD1 4.32Å; L259-L263 WeakPolarHBondContact O-CB 3.2Å; L259-L263 PolarHBondContact O-N 3.09Å; L259-L356 HydrophobicContact CD1-CD2 4.33Å; L259-L356 HydrophobicContact CD2-CD1 4.08Å; L259-L356 HydrophobicContact CD2-CD2 4.34Å; L259-L445 HydrophobicContact CD1-CD2 4.42Å; L259-Q446 HydrophobicContact CD1-CB 3.98Å; L259-Q446 HydrophobicContact CG-CB 4.36Å; L259-L449 HydrophobicContact CD1-CD1 4.43Å; L259-L449 HydrophobicContact CD2-CD1 4.09Å; L259-L449 HydrophobicContact CG-CD1 4.39Å; L259-L458 HydrophobicContact CD2-CD1 4.32Å; L259-L458 HydrophobicContact CD2-CD2 3.88Å; L259-L458 HydrophobicContact CG-CD1 4.11Å; L259-L458 HydrophobicContact CG-CD2 4.48Å
260	L	91.9	Very high	84.5	Confident	12 Å²	12	26.5 Å²	26.5	6%	0.063	15%	0.149	C	C	.	.	H	α-helix	trans	-68.2	-33	179.4	-62.6	177.8	0	0	0	112.2	R137 F138 P164 E197 R256 L257 G258 Y274 L442	R137-L260 HydrophobicContact CG-CD2 3.48Å; R137-L260 VanDerWaalsContact CG-CD2 3.48Å; F138-L260 HydrophobicContact CE1-CD2 4.11Å; F138-L260 HydrophobicContact CZ-CD2 4.27Å; P164-L260 HydrophobicContact CB-CD1 3.95Å; P164-L260 HydrophobicContact CG-CD1 3.7Å; E197-L260 HydrophobicContact CG-CD1 4.14Å; R256-L260 HydrophobicContact CB-CB 4.37Å; L257-L260 WeakPolarHBondContact O-CB 3.19Å; L257-L260 PolarHBondContact O-N 3.46Å; G258-L260 PolarHBondContact O-N 3.36Å; L260-Y274 WeakPolarHBondContact O-CD2 3.39Å; L260-L442 HydrophobicContact CD2-CD1 3.72Å
261	G	92.4	Very high	83.3	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-84.3	-31.3	-179.4	0	0	0	0	0	114.7	R256 L257 G258 L259 Y274 A275	R256-G261 WeakPolarHBondContact O-CA 3.45Å; L257-G261 PolarHBondContact O-N 2.79Å; G258-G261 PolarHBondContact O-N 3.47Å; L259-G261 VanDerWaalsContact C-N 3.32Å; L259-G261 PolarHBondContact O-N 3.49Å; G261-Y274 WeakPolarHBondContact O-CA 3.46Å; G261-Y274 VanDerWaalsContact O-CB 3.31Å; G261-Y274 WeakPolarHBondContact O-CB 3.24Å; G261-Y274 PolarHBondContact O-N 3.11Å; G261-A275 PolarHBondContact O-N 2.66Å
262	F	91.8	Very high	82.7	Confident	5 Å²	5	28.2 Å²	28.2	2%	0.022	16%	0.161	C	C	.	.	H	α-helix	trans	-137	3.1	-161.2	-58.8	-73.6	0	0	0	116.3	Y229 G258 F264 A275 L458 G459 P460	Y229-F262 HydrophobicContact CD1-CE1 4.45Å; Y229-F262 AromaticContact CD1-CE2 3.86Å; Y229-F262 HydrophobicContact CD1-CE2 3.86Å; Y229-F262 AromaticContact CD1-CZ 3.51Å; Y229-F262 HydrophobicContact CD1-CZ 3.51Å; Y229-F262 HydrophobicContact CE1-CZ 4.11Å; Y229-F262 AromaticContact CG-CE2 3.81Å; Y229-F262 HydrophobicContact CG-CE2 3.81Å; Y229-F262 AromaticContact CG-CZ 3.79Å; Y229-F262 HydrophobicContact CG-CZ 3.79Å; G258-F262 PolarHBondContact O-N 3.1Å; F262-F264 PolarHBondContact O-N 3.25Å; F262-F264 VanDerWaalsContact O-N 3.11Å; F262-A275 HydrophobicContact CE1-CB 3.61Å; F262-A275 HydrophobicContact CE2-CB 4.11Å; F262-A275 HydrophobicContact CZ-CB 3.37Å; F262-L458 HydrophobicContact CB-CB 4.45Å; F262-G459 WeakPolarHBondContact CD1-O 3Å; F262-P460 HydrophobicContact CD1-CG 4.48Å; F262-P460 VanDerWaalsContact CE1-CD 3.5Å; F262-P460 HydrophobicContact CE1-CG 3.85Å
263	L	88.8	Confident	82.4	Confident	7 Å²	7	28.2 Å²	28.2	4%	0.037	16%	0.161	C	C	.	.			trans	-57.2	120.7	176	-179.2	68	0	0	0	110.8	F138 L259 I270 G272 Y274 L353 L356 L434	F138-L263 HydrophobicContact CD1-CD2 4.41Å; F138-L263 HydrophobicContact CE1-CB 4.36Å; F138-L263 HydrophobicContact CE1-CD2 3.96Å; F138-L263 HydrophobicContact CZ-CD2 4.04Å; L259-L263 HydrophobicContact CD2-CD1 4.32Å; L259-L263 WeakPolarHBondContact O-CB 3.2Å; L259-L263 PolarHBondContact O-N 3.09Å; L263-I270 WeakPolarHBondContact O-CG2 3.16Å; L263-G272 WeakPolarHBondContact O-CA 3.29Å; L263-Y274 WeakPolarHBondContact O-CE2 3.4Å; L263-L353 HydrophobicContact CD1-CD2 4.06Å; L263-L356 HydrophobicContact CD1-CD1 3.94Å; L263-L434 HydrophobicContact CD2-CD1 3.71Å
264	F	85.4	Confident	82.3	Confident	19 Å²	19	28.2 Å²	28.2	8%	0.083	16%	0.161	C	C	.	.			trans	-126.5	138.6	-178.1	173.3	-104.5	0	0	0	111	F262 N266 S271 T349 V461 L463	F262-F264 PolarHBondContact O-N 3.25Å; F262-F264 VanDerWaalsContact O-N 3.11Å; F264-N266 HydrophobicContact CE1-CB 4.22Å; F264-N266 HydrophobicContact CZ-CB 4.4Å; F264-S271 WeakPolarHBondContact CD2-O 3.4Å; F264-T349 HydrophobicContact CB-CG2 4.33Å; F264-T349 HydrophobicContact CD1-CG2 3.88Å; F264-V461 HydrophobicContact CB-CG2 3.9Å; F264-V461 HydrophobicContact CD1-CG1 4.03Å; F264-V461 HydrophobicContact CD1-CG2 4.38Å; F264-V461 HydrophobicContact CE1-CG1 4.21Å; F264-V461 HydrophobicContact CG-CB 4.43Å; F264-V461 HydrophobicContact CG-CG1 4.28Å; F264-V461 HydrophobicContact CG-CG2 4.14Å; F264-L463 HydrophobicContact CD2-CD1 4.41Å; F264-L463 HydrophobicContact CD2-CD2 4.25Å; F264-L463 HydrophobicContact CE1-CD2 4.09Å; F264-L463 HydrophobicContact CE2-CD1 3.87Å; F264-L463 HydrophobicContact CE2-CD2 3.44Å; F264-L463 VanDerWaalsContact CE2-CD2 3.44Å; F264-L463 HydrophobicContact CE2-CG 4.27Å; F264-L463 HydrophobicContact CZ-CD2 3.33Å
265	T	75.6	Confident	82.2	Confident	8 Å²	8	28.1 Å²	28.1	5%	0.049	16%	0.161	C	C	.	.			trans	-128.7	133.7	166.8	71	0	0	0	0	109.8	N267 I270 L353 L427	T265-N267 PolarHBondContact O-N 2.95Å; T265-N267 PolarHBondContact OG1-O 2.92Å; T265-I270 HydrophobicContact CG2-CB 4.36Å; T265-I270 HydrophobicContact CG2-CD1 3.66Å; T265-I270 PolarHBondContact N-O 2.93Å; T265-I270 VanDerWaalsContact O-O 3.07Å; T265-I270 WeakPolarHBondContact OG1-CB 3.32Å; T265-L353 HydrophobicContact CG2-CD1 4.05Å; T265-L353 HydrophobicContact CG2-CD2 3.81Å; T265-L427 HydrophobicContact CG2-CD2 4.07Å
266	N	66.9	Low	82.1	Confident	141 Å²	141	28.1 Å²	28.1	75%	0.754	16%	0.161	S	C	*	.	S	Bend	trans	-63.5	0.7	-178.5	-161.3	19.7	0	0	0	114.8	F264	F264-N266 HydrophobicContact CE1-CB 4.22Å; F264-N266 HydrophobicContact CZ-CB 4.4Å
267	N	60.7	Low	81.9	Confident	64 Å²	64	29.7 Å²	29.7	34%	0.342	17%	0.167	S	C	.	.	S	Bend	trans	-116.9	145.3	-174.4	-69.3	-21.5	0	0	0	112.5	T265 G269 L424 L427	T265-N267 PolarHBondContact O-N 2.95Å; T265-N267 PolarHBondContact OG1-O 2.92Å; N267-G269 PolarHBondContact O-N 3.41Å; N267-L424 HydrophobicContact CB-CD1 3.59Å; N267-L427 HydrophobicContact CB-CD1 4.37Å; N267-L427 WeakPolarHBondContact ND2-CD1 3.28Å
268	H	52.5	Low	82	Confident	211 Å²	211	29.7 Å²	29.7	98%	0.977	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.5	85.9	-170.6	-66.4	-77	0	0	0	116.3
269	G	56.4	Low	82.1	Confident	68 Å²	68	29.7 Å²	29.7	70%	0.701	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	170.7	-32.2	167.9	0	0	0	0	0	115.2	N267	N267-G269 PolarHBondContact O-N 3.41Å
270	I	63.1	Low	82.2	Confident	13 Å²	13	31 Å²	31	7%	0.067	17%	0.173	C	C	.	.			trans	-119	98.1	-177	-55.5	166.7	0	0	0	108.2	L263 T265 G272 Y274 F431	L263-I270 WeakPolarHBondContact O-CG2 3.16Å; T265-I270 HydrophobicContact CG2-CB 4.36Å; T265-I270 HydrophobicContact CG2-CD1 3.66Å; T265-I270 PolarHBondContact N-O 2.93Å; T265-I270 VanDerWaalsContact O-O 3.07Å; T265-I270 WeakPolarHBondContact OG1-CB 3.32Å; I270-G272 VanDerWaalsContact C-N 3.25Å; I270-G272 PolarHBondContact O-N 3.46Å; I270-Y274 HydrophobicContact CG2-CE2 4.44Å; I270-Y274 VanDerWaalsContact CG2-OH 3.26Å; I270-Y274 WeakPolarHBondContact CG2-OH 3.41Å; I270-F431 HydrophobicContact CD1-CB 3.97Å; I270-F431 HydrophobicContact CD1-CD2 3.18Å; I270-F431 HydrophobicContact CD1-CE2 3.71Å; I270-F431 HydrophobicContact CD1-CG 3.72Å; I270-F431 HydrophobicContact CG1-CD2 3.76Å; I270-F431 HydrophobicContact CG1-CE2 3.74Å; I270-F431 HydrophobicContact CG1-CG 4.37Å; I270-F431 HydrophobicContact CG1-CZ 4.41Å
271	S	72.2	Confident	82.2	Confident	37 Å²	37	30.5 Å²	30.5	26%	0.259	17%	0.171	S	C	.	.			trans	-74.9	-14.5	-178.9	47.2	0	0	0	0	113.4	H140 F264 L463	H140-S271 PolarHBondContact NE2-OG 3.43Å; F264-S271 WeakPolarHBondContact CD2-O 3.4Å; S271-L463 WeakPolarHBondContact O-CD1 3.42Å
272	G	84.5	Confident	82.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.171	C	C	.	.			trans	61	-162.5	-172.5	0	0	0	0	0	112.2	L263 I270 Y274	L263-G272 WeakPolarHBondContact O-CA 3.29Å; I270-G272 VanDerWaalsContact C-N 3.25Å; I270-G272 PolarHBondContact O-N 3.46Å; G272-Y274 PolarHBondContact O-N 3.12Å; G272-Y274 VanDerWaalsContact O-N 3.14Å
273	N	90.9	Very high	82.3	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.17	C	C	.	.			trans	57.1	27.7	176.5	-65.6	-27.7	0	0	0	114.6	A275 L276 Y277 P460 V461 L466	N273-A275 PolarHBondContact O-N 3.47Å; N273-L276 HydrophobicContact CB-CB 4.4Å; N273-L276 HydrophobicContact CB-CD1 4.09Å; N273-L276 WeakPolarHBondContact O-CB 3.46Å; N273-L276 PolarHBondContact O-N 3.07Å; N273-Y277 HydrophobicContact CB-CE2 4.37Å; N273-Y277 VanDerWaalsContact O-CD2 3.23Å; N273-Y277 WeakPolarHBondContact O-CD2 3.3Å; N273-Y277 PolarHBondContact O-N 2.94Å; N273-P460 VanDerWaalsContact OD1-CA 3.29Å; N273-P460 WeakPolarHBondContact OD1-CA 3.21Å; N273-V461 PolarHBondContact ND2-O 3.13Å; N273-V461 PolarHBondContact OD1-N 3.32Å; N273-L466 HydrophobicContact CB-CD2 4.44Å
274	Y	92.5	Very high	82.4	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-55.7	-37	-177	-59.9	-64.7	0	0	0	113	F138 L260 G261 L263 I270 G272 L276 Y277 D278	F138-Y274 HydrophobicContact CB-CE2 4.33Å; F138-Y274 AromaticContact CD1-CE2 3.98Å; F138-Y274 HydrophobicContact CD1-CE2 3.98Å; F138-Y274 WeakPolarHBondContact O-CE1 3.38Å; F138-Y274 VanDerWaalsContact O-CZ 3.25Å; F138-Y274 PolarHBondContact O-OH 3.1Å; L260-Y274 WeakPolarHBondContact O-CD2 3.39Å; G261-Y274 WeakPolarHBondContact O-CA 3.46Å; G261-Y274 VanDerWaalsContact O-CB 3.31Å; G261-Y274 WeakPolarHBondContact O-CB 3.24Å; G261-Y274 PolarHBondContact O-N 3.11Å; L263-Y274 WeakPolarHBondContact O-CE2 3.4Å; I270-Y274 HydrophobicContact CG2-CE2 4.44Å; I270-Y274 VanDerWaalsContact CG2-OH 3.26Å; I270-Y274 WeakPolarHBondContact CG2-OH 3.41Å; G272-Y274 PolarHBondContact O-N 3.12Å; G272-Y274 VanDerWaalsContact O-N 3.14Å; Y274-L276 VanDerWaalsContact C-N 3.31Å; Y274-L276 PolarHBondContact O-N 3.14Å; Y274-Y277 CarbonylContact O-C 3.59Å; Y274-Y277 WeakPolarHBondContact O-CA 3.37Å; Y274-Y277 WeakPolarHBondContact O-CB 3.12Å; Y274-Y277 PolarHBondContact O-N 3.37Å; Y274-D278 PolarHBondContact O-N 2.83Å
275	A	94.1	Very high	82.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.7	-35.9	173.4	0	0	0	0	0	113.8	Y255 R256 G261 F262 N273 Y277 D278 L279 L311	Y255-A275 HydrophobicContact CD2-CB 3.77Å; Y255-A275 HydrophobicContact CE2-CB 4.38Å; R256-A275 WeakPolarHBondContact O-CB 3.1Å; G261-A275 PolarHBondContact O-N 2.66Å; F262-A275 HydrophobicContact CE1-CB 3.61Å; F262-A275 HydrophobicContact CE2-CB 4.11Å; F262-A275 HydrophobicContact CZ-CB 3.37Å; N273-A275 PolarHBondContact O-N 3.47Å; A275-Y277 VanDerWaalsContact C-N 3.34Å; A275-D278 PolarHBondContact O-N 2.8Å; A275-L279 PolarHBondContact O-N 2.96Å; A275-L311 HydrophobicContact CB-CD1 4.49Å
276	L	92.9	Very high	83.6	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-68.2	-36.1	174	-75.3	171.6	0	0	0	111.1	N273 Y274 D278 H280 L311 F315 M320 P460 L466 F467	N273-L276 HydrophobicContact CB-CB 4.4Å; N273-L276 HydrophobicContact CB-CD1 4.09Å; N273-L276 WeakPolarHBondContact O-CB 3.46Å; N273-L276 PolarHBondContact O-N 3.07Å; Y274-L276 VanDerWaalsContact C-N 3.31Å; Y274-L276 PolarHBondContact O-N 3.14Å; L276-D278 VanDerWaalsContact C-N 3.35Å; L276-H280 WeakPolarHBondContact O-CB 3.4Å; L276-H280 PolarHBondContact O-N 2.96Å; L276-L311 HydrophobicContact CD2-CD1 3.47Å; L276-L311 VanDerWaalsContact CD2-CD1 3.47Å; L276-L311 HydrophobicContact CD2-CG 3.92Å; L276-L311 HydrophobicContact CG-CD1 3.77Å; L276-F315 HydrophobicContact CD2-CB 3.97Å; L276-M320 HydrophobicContact CB-CE 4.22Å; L276-M320 HydrophobicContact CB-SD 4.4Å; L276-M320 VanDerWaalsContact O-CE 3.27Å; L276-M320 WeakPolarHBondContact O-CE 3.2Å; L276-P460 HydrophobicContact CD1-CB 4.42Å; L276-L466 HydrophobicContact CD1-CD2 4.29Å; L276-F467 HydrophobicContact CD1-CE2 4.29Å; L276-F467 HydrophobicContact CD1-CZ 3.84Å
277	Y	92	Very high	84.7	Confident	36 Å²	36	26 Å²	26	14%	0.141	14%	0.144	C	C	.	.	H	α-helix	trans	-69.4	-33.6	173.9	-69.2	-77.9	0	0	0	112.2	H140 S141 V142 N273 Y274 A275 H280 A281 M320	H140-Y277 HydrophobicContact CB-CD1 4.2Å; H140-Y277 HydrophobicContact CB-CG 4.28Å; H140-Y277 AromaticContact CD2-CD1 3.92Å; H140-Y277 AromaticContact CD2-CD2 3.4Å; H140-Y277 VanDerWaalsContact CD2-CD2 3.4Å; H140-Y277 WeakPolarHBondContact CD2-CD2 3.44Å; H140-Y277 AromaticContact CD2-CE1 3.95Å; H140-Y277 AromaticContact CD2-CE2 3.46Å; H140-Y277 VanDerWaalsContact CD2-CE2 3.46Å; H140-Y277 WeakPolarHBondContact CD2-CE2 3.45Å; H140-Y277 AromaticContact CD2-CG 3.65Å; H140-Y277 AromaticContact CD2-CZ 3.73Å; H140-Y277 AromaticContact CE1-CE1 3.62Å; H140-Y277 AromaticContact CE1-CE2 3.8Å; H140-Y277 AromaticContact CE1-CZ 3.34Å; H140-Y277 PolarHBondContact CE1-OH 2.95Å; H140-Y277 AromaticContact CG-CD1 3.86Å; H140-Y277 AromaticContact CG-CE1 3.95Å; H140-Y277 AromaticContact CG-CG 3.98Å; H140-Y277 AromaticContact ND1-CE1 3.78Å; H140-Y277 AromaticContact ND1-CZ 3.97Å; H140-Y277 AromaticContact NE2-CD2 3.6Å; H140-Y277 AromaticContact NE2-CE1 3.73Å; H140-Y277 AromaticContact NE2-CE2 3.1Å; H140-Y277 WeakPolarHBondContact NE2-CE2 3.41Å; H140-Y277 AromaticContact NE2-CZ 3.16Å; H140-Y277 PolarHBondContact NE2-OH 3.12Å; S141-Y277 PolarHBondContact OG-O 2.87Å; S141-Y277 VanDerWaalsContact OG-O 3.11Å; V142-Y277 HydrophobicContact CG2-CD1 4.34Å; N273-Y277 HydrophobicContact CB-CE2 4.37Å; N273-Y277 VanDerWaalsContact O-CD2 3.23Å; N273-Y277 WeakPolarHBondContact O-CD2 3.3Å; N273-Y277 PolarHBondContact O-N 2.94Å; Y274-Y277 CarbonylContact O-C 3.59Å; Y274-Y277 WeakPolarHBondContact O-CA 3.37Å; Y274-Y277 WeakPolarHBondContact O-CB 3.12Å; Y274-Y277 PolarHBondContact O-N 3.37Å; A275-Y277 VanDerWaalsContact C-N 3.34Å; Y277-H280 WeakPolarHBondContact O-CB 3.38Å; Y277-H280 PolarHBondContact O-N 3.4Å; Y277-A281 WeakPolarHBondContact O-CB 3.48Å; Y277-A281 PolarHBondContact O-N 2.92Å; Y277-M320 HydrophobicContact CD1-CE 3.4Å; Y277-M320 VanDerWaalsContact CD1-CE 3.4Å; Y277-M320 HydrophobicContact CD1-SD 4.14Å; Y277-M320 HydrophobicContact CD2-CE 4.4Å; Y277-M320 HydrophobicContact CE1-CE 3.71Å; Y277-M320 HydrophobicContact CE1-SD 3.82Å; Y277-M320 HydrophobicContact CE2-SD 4.46Å; Y277-M320 HydrophobicContact CG-CE 3.79Å
278	D	94.3	Very high	86.1	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.3	-46.2	174	-64.2	-15.7	0	0	0	110.9	Y94 S141 L200 R256 Y274 A275 L276 H280 A281 A282	Y94-D278 VanDerWaalsContact CE2-O 3.3Å; Y94-D278 WeakPolarHBondContact CE2-O 3.28Å; S141-D278 WeakPolarHBondContact CB-OD1 3.38Å; S141-D278 WeakPolarHBondContact OG-CA 3.27Å; S141-D278 PolarHBondContact OG-N 3.37Å; S141-D278 PolarHBondContact OG-OD1 3.28Å; L200-D278 HydrophobicContact CD2-CB 4.25Å; R256-D278 VanDerWaalsContact CB-OD2 3.29Å; R256-D278 WeakPolarHBondContact CB-OD2 3.37Å; R256-D278 WeakPolarHBondContact CG-OD2 3.39Å; R256-D278 IonicContact CZ-OD1 3.28Å; R256-D278 IonicContact CZ-OD2 2.99Å; R256-D278 PolarHBondContact N-OD2 2.86Å; R256-D278 IonicContact NE-OD1 3.71Å; R256-D278 PolarHBondContact NE-OD1 3.32Å; R256-D278 IonicContact NE-OD2 2.64Å; R256-D278 PolarHBondContact NE-OD2 3.31Å; R256-D278 IonicContact NH2-OD1 3.38Å; R256-D278 PolarHBondContact NH2-OD1 3.33Å; R256-D278 IonicContact NH2-OD2 3.03Å; Y274-D278 PolarHBondContact O-N 2.83Å; A275-D278 PolarHBondContact O-N 2.8Å; L276-D278 VanDerWaalsContact C-N 3.35Å; D278-H280 VanDerWaalsContact C-N 3.31Å; D278-H280 PolarHBondContact O-N 3.28Å; D278-A281 PolarHBondContact O-N 3.5Å; D278-A282 WeakPolarHBondContact O-CB 3.47Å; D278-A282 PolarHBondContact O-N 2.97Å
279	L	94.4	Very high	87.9	Confident	0 Å²	0	16 Å²	16	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.3	-42	172.9	179.3	59.4	0	0	0	111.8	L222 V224 L253 A275 A282 I283 L311 V312 F315	L222-L279 HydrophobicContact CD2-CD1 4.03Å; V224-L279 HydrophobicContact CG2-CD1 3.97Å; L253-L279 HydrophobicContact CD1-CD1 3.97Å; A275-L279 PolarHBondContact O-N 2.96Å; L279-A282 PolarHBondContact O-N 3.29Å; L279-I283 HydrophobicContact CD1-CD1 4.12Å; L279-I283 HydrophobicContact CD1-CG1 4.45Å; L279-I283 HydrophobicContact CG-CD1 4.1Å; L279-I283 VanDerWaalsContact O-CG1 3.32Å; L279-I283 WeakPolarHBondContact O-CG1 3.47Å; L279-I283 PolarHBondContact O-N 2.78Å; L279-L311 HydrophobicContact CD2-CD2 4.38Å; L279-L311 HydrophobicContact CD2-CG 4.29Å; L279-V312 HydrophobicContact CD2-CG2 4.4Å; L279-F315 HydrophobicContact CD2-CB 3.9Å; L279-F315 HydrophobicContact CD2-CD2 4.39Å; L279-F315 HydrophobicContact CD2-CG 4.02Å
280	H	92.3	Very high	89.6	Confident	29 Å²	29	12.8 Å²	12.8	13%	0.134	7%	0.067	C	C	.	.	H	α-helix	trans	-60.8	-48.8	175.1	-177.9	-173	0	0	0	111.8	L276 Y277 D278 A282 I283 M284 F315 M320 T325	L276-H280 WeakPolarHBondContact O-CB 3.4Å; L276-H280 PolarHBondContact O-N 2.96Å; Y277-H280 WeakPolarHBondContact O-CB 3.38Å; Y277-H280 PolarHBondContact O-N 3.4Å; D278-H280 VanDerWaalsContact C-N 3.31Å; D278-H280 PolarHBondContact O-N 3.28Å; H280-A282 VanDerWaalsContact C-N 3.35Å; H280-A282 PolarHBondContact O-N 3.43Å; H280-I283 PolarHBondContact O-N 3.45Å; H280-M284 WeakPolarHBondContact O-CG 3.36Å; H280-M284 PolarHBondContact O-N 2.85Å; H280-F315 HydrophobicContact CB-CE2 3.99Å; H280-M320 HydrophobicContact CB-CE 3.59Å; H280-T325 WeakPolarHBondContact CD2-CG2 3.41Å; H280-T325 PolarHBondContact CD2-OG1 3.23Å; H280-T325 WeakPolarHBondContact NE2-CG2 3.45Å; H280-T325 PolarHBondContact NE2-OG1 2.84Å
281	A	91.5	Very high	91	Very high	2 Å²	2	16.5 Å²	16.5	2%	0.017	8%	0.084	C	C	.	.	H	α-helix	trans	-61.4	-42.3	178.7	0	0	0	0	0	111.8	Y94 V142 Y277 D278 I283 M284 W285	Y94-A281 HydrophobicContact CD2-CB 4.14Å; Y94-A281 HydrophobicContact CE2-CB 4.21Å; V142-A281 HydrophobicContact CG2-CB 4.49Å; Y277-A281 WeakPolarHBondContact O-CB 3.48Å; Y277-A281 PolarHBondContact O-N 2.92Å; D278-A281 PolarHBondContact O-N 3.5Å; A281-I283 PolarHBondContact O-N 2.95Å; A281-M284 PolarHBondContact O-N 3.37Å; A281-W285 WeakPolarHBondContact O-CB 3.42Å; A281-W285 PolarHBondContact O-N 3.49Å
282	A	93.1	Very high	91.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.2	-46.6	175.1	0	0	0	0	0	112	Y94 L202 L253 D278 L279 H280 M284 W285 I286	Y94-A282 HydrophobicContact CD1-CB 4.35Å; Y94-A282 HydrophobicContact CD2-CB 3.86Å; Y94-A282 HydrophobicContact CE1-CB 4.32Å; Y94-A282 HydrophobicContact CE2-CB 3.87Å; Y94-A282 HydrophobicContact CG-CB 4.1Å; L202-A282 HydrophobicContact CD2-CB 4.09Å; L253-A282 HydrophobicContact CD1-CB 3.87Å; D278-A282 WeakPolarHBondContact O-CB 3.47Å; D278-A282 PolarHBondContact O-N 2.97Å; L279-A282 PolarHBondContact O-N 3.29Å; H280-A282 VanDerWaalsContact C-N 3.35Å; H280-A282 PolarHBondContact O-N 3.43Å; A282-M284 VanDerWaalsContact C-N 3.33Å; A282-M284 PolarHBondContact O-N 3.37Å; A282-W285 PolarHBondContact O-N 3.39Å; A282-I286 VanDerWaalsContact O-CG1 3.24Å; A282-I286 WeakPolarHBondContact O-CG1 3.49Å; A282-I286 PolarHBondContact O-N 2.96Å
283	I	94.1	Very high	92.2	Very high	1 Å²	1	17 Å²	17	1%	0.005	9%	0.087	C	C	.	.	H	α-helix	trans	-62.5	-41.1	178	-69.6	165.9	0	0	0	111.3	L222 L279 H280 A281 I286 K287 L302 F315 T325 I329	L222-I283 HydrophobicContact CD2-CG1 4Å; L279-I283 HydrophobicContact CD1-CD1 4.12Å; L279-I283 HydrophobicContact CD1-CG1 4.45Å; L279-I283 HydrophobicContact CG-CD1 4.1Å; L279-I283 VanDerWaalsContact O-CG1 3.32Å; L279-I283 WeakPolarHBondContact O-CG1 3.47Å; L279-I283 PolarHBondContact O-N 2.78Å; H280-I283 PolarHBondContact O-N 3.45Å; A281-I283 PolarHBondContact O-N 2.95Å; I283-I286 PolarHBondContact O-N 3.5Å; I283-K287 HydrophobicContact CG2-CD 4.29Å; I283-K287 WeakPolarHBondContact O-CG 3.27Å; I283-K287 PolarHBondContact O-N 3.01Å; I283-L302 HydrophobicContact CD1-CD1 4.17Å; I283-L302 HydrophobicContact CD1-CD2 4.09Å; I283-L302 HydrophobicContact CG1-CD2 4.33Å; I283-F315 HydrophobicContact CD1-CD1 4.31Å; I283-F315 HydrophobicContact CD1-CE1 3.62Å; I283-F315 HydrophobicContact CD1-CZ 3.73Å; I283-T325 HydrophobicContact CG2-CG2 4.04Å; I283-I329 HydrophobicContact CD1-CD1 4.35Å; I283-I329 HydrophobicContact CG2-CD1 4.2Å
284	M	91.3	Very high	92.2	Very high	43 Å²	43	18.4 Å²	18.4	21%	0.212	9%	0.094	C	C	.	.	H	α-helix	trans	-63.3	-44.5	176	-72.7	-63.1	-63.8	0	0	111.4	H280 A281 A282 I286 K287 T288 T325	H280-M284 WeakPolarHBondContact O-CG 3.36Å; H280-M284 PolarHBondContact O-N 2.85Å; A281-M284 PolarHBondContact O-N 3.37Å; A282-M284 VanDerWaalsContact C-N 3.33Å; A282-M284 PolarHBondContact O-N 3.37Å; M284-I286 VanDerWaalsContact C-N 3.35Å; M284-I286 PolarHBondContact O-N 3.47Å; M284-K287 PolarHBondContact O-N 3.5Å; M284-T288 PolarHBondContact O-N 3.45Å; M284-T288 PolarHBondContact O-OG1 2.94Å; M284-T325 HydrophobicContact SD-CG2 4.38Å; M284-T325 PolarHBondContact SD-OG1 2.94Å
285	W	91.3	Very high	92.2	Very high	12 Å²	12	18.4 Å²	18.4	5%	0.045	9%	0.094	C	C	.	.	H	α-helix	trans	-60.2	-44.3	175.9	-174.8	99.1	0	0	0	112.3	L65 V92 F145 L202 I204 A281 A282 T288 N289 F293	L65-W285 HydrophobicContact CD1-CZ2 4.16Å; L65-W285 HydrophobicContact CD2-CH2 4.48Å; L65-W285 HydrophobicContact CD2-CZ2 4.25Å; V92-W285 HydrophobicContact CG1-CH2 3.5Å; V92-W285 HydrophobicContact CG1-CZ2 3.35Å; V92-W285 HydrophobicContact CG1-CZ3 4.4Å; F145-W285 HydrophobicContact CE2-CB 4.02Å; F145-W285 HydrophobicContact CE2-CG 4.5Å; L202-W285 HydrophobicContact CD1-CD2 4.08Å; L202-W285 HydrophobicContact CD1-CE3 3.34Å; L202-W285 HydrophobicContact CD1-CZ3 3.62Å; I204-W285 HydrophobicContact CD1-CH2 3.77Å; I204-W285 HydrophobicContact CD1-CZ3 3.75Å; A281-W285 WeakPolarHBondContact O-CB 3.42Å; A281-W285 PolarHBondContact O-N 3.49Å; A282-W285 PolarHBondContact O-N 3.39Å; W285-T288 PolarHBondContact O-N 2.96Å; W285-N289 HydrophobicContact CD2-CB 4.32Å; W285-N289 HydrophobicContact CE3-CB 4.36Å; W285-N289 HydrophobicContact CH2-CB 3.94Å; W285-N289 HydrophobicContact CZ2-CB 3.92Å; W285-N289 HydrophobicContact CZ3-CB 4.18Å; W285-N289 PolarHBondContact NE1-ND2 2.91Å; W285-N289 WeakPolarHBondContact O-CB 3.46Å; W285-N289 PolarHBondContact O-N 3.2Å; W285-N289 PolarHBondContact O-ND2 3.02Å; W285-F293 AromaticContact CH2-CE2 3.9Å; W285-F293 HydrophobicContact CH2-CE2 3.9Å; W285-F293 HydrophobicContact CH2-CZ 4.09Å
286	I	93.6	Very high	92.3	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-59	-51.1	176.8	-70.3	163.7	0	0	0	109.2	L202 I220 L222 I251 A282 I283 M284 T288 N289 I290 I300	L202-I286 HydrophobicContact CD1-CG1 4.07Å; I220-I286 HydrophobicContact CD1-CG2 4.45Å; I220-I286 HydrophobicContact CG2-CG2 4.45Å; L222-I286 HydrophobicContact CD1-CD1 3.92Å; L222-I286 HydrophobicContact CD2-CD1 3.91Å; L222-I286 HydrophobicContact CG-CD1 4.33Å; I251-I286 HydrophobicContact CD1-CD1 3.88Å; I251-I286 HydrophobicContact CD1-CG1 3.87Å; I251-I286 HydrophobicContact CD1-CG2 4.16Å; I251-I286 HydrophobicContact CG2-CD1 4.36Å; A282-I286 VanDerWaalsContact O-CG1 3.24Å; A282-I286 WeakPolarHBondContact O-CG1 3.49Å; A282-I286 PolarHBondContact O-N 2.96Å; I283-I286 PolarHBondContact O-N 3.5Å; M284-I286 VanDerWaalsContact C-N 3.35Å; M284-I286 PolarHBondContact O-N 3.47Å; I286-T288 PolarHBondContact O-N 3.37Å; I286-N289 PolarHBondContact O-N 3.25Å; I286-I290 HydrophobicContact CG2-CB 3.98Å; I286-I290 HydrophobicContact CG2-CG1 4.22Å; I286-I290 HydrophobicContact CG2-CG2 4.15Å; I286-I290 WeakPolarHBondContact O-CB 3.11Å; I286-I290 WeakPolarHBondContact O-CG2 3.18Å; I286-I290 PolarHBondContact O-N 3.3Å; I286-I300 HydrophobicContact CG2-CD1 4.27Å
287	K	91.4	Very high	92.4	Very high	29 Å²	29	20.4 Å²	20.4	13%	0.126	11%	0.106	C	C	.	.	H	α-helix	trans	-57.6	-38.6	-179.7	-79	177.1	165	178.5	0	113.7	I283 M284 I300 T324 T325 S327	I283-K287 HydrophobicContact CG2-CD 4.29Å; I283-K287 WeakPolarHBondContact O-CG 3.27Å; I283-K287 PolarHBondContact O-N 3.01Å; M284-K287 PolarHBondContact O-N 3.5Å; K287-I300 HydrophobicContact CD-CD1 4.45Å; K287-I300 HydrophobicContact CG-CD1 3.73Å; K287-T324 PolarHBondContact NZ-O 3.25Å; K287-T325 PolarHBondContact NZ-O 2.76Å; K287-S327 WeakPolarHBondContact CE-O 3.45Å; K287-S327 PolarHBondContact NZ-O 3.16Å
288	T	90.1	Very high	92.5	Very high	54 Å²	54	22.8 Å²	22.8	33%	0.331	12%	0.121	S	C	.	.	H	α-helix	trans	-72	-45.3	178.1	-59.3	0	0	0	0	111.4	I66 M284 W285 I286	I66-T288 HydrophobicContact CD1-CG2 4.22Å; I66-T288 WeakPolarHBondContact CD1-O 3.46Å; M284-T288 PolarHBondContact O-N 3.45Å; M284-T288 PolarHBondContact O-OG1 2.94Å; W285-T288 PolarHBondContact O-N 2.96Å; I286-T288 PolarHBondContact O-N 3.37Å
289	N	90.5	Very high	92.5	Very high	11 Å²	11	25.8 Å²	25.8	6%	0.059	14%	0.135	C	C	.	.	H	α-helix	trans	-105.6	-17.2	-163.8	-69.5	-68.3	0	0	0	115.6	L65 W285 I286 E291 S292 F293	L65-N289 HydrophobicContact CD2-CB 4.05Å; W285-N289 HydrophobicContact CD2-CB 4.32Å; W285-N289 HydrophobicContact CE3-CB 4.36Å; W285-N289 HydrophobicContact CH2-CB 3.94Å; W285-N289 HydrophobicContact CZ2-CB 3.92Å; W285-N289 HydrophobicContact CZ3-CB 4.18Å; W285-N289 PolarHBondContact NE1-ND2 2.91Å; W285-N289 WeakPolarHBondContact O-CB 3.46Å; W285-N289 PolarHBondContact O-N 3.2Å; W285-N289 PolarHBondContact O-ND2 3.02Å; I286-N289 PolarHBondContact O-N 3.25Å; N289-E291 PolarHBondContact O-N 3.44Å; N289-E291 VanDerWaalsContact O-N 3.14Å; N289-S292 WeakPolarHBondContact O-CB 3.46Å; N289-S292 PolarHBondContact O-N 2.95Å; N289-S292 VanDerWaalsContact O-N 3.13Å; N289-F293 WeakPolarHBondContact O-CD2 3.28Å
290	I	92.3	Very high	92.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-69.2	-19.3	-166.3	-156.7	61.8	0	0	0	113.9	I204 I220 V249 I251 I286 S292 F293 N294 G295	I204-I290 HydrophobicContact CG2-CD1 4.43Å; I220-I290 HydrophobicContact CD1-CB 3.95Å; I220-I290 HydrophobicContact CD1-CG1 3.43Å; I220-I290 VanDerWaalsContact CD1-CG1 3.43Å; I220-I290 HydrophobicContact CD1-CG2 3.37Å; I220-I290 HydrophobicContact CG1-CG1 3.85Å; V249-I290 HydrophobicContact CG1-CD1 4.05Å; I251-I290 HydrophobicContact CD1-CD1 3.72Å; I251-I290 HydrophobicContact CD1-CG1 4.46Å; I286-I290 HydrophobicContact CG2-CB 3.98Å; I286-I290 HydrophobicContact CG2-CG1 4.22Å; I286-I290 HydrophobicContact CG2-CG2 4.15Å; I286-I290 WeakPolarHBondContact O-CB 3.11Å; I286-I290 WeakPolarHBondContact O-CG2 3.18Å; I286-I290 PolarHBondContact O-N 3.3Å; I290-S292 PolarHBondContact O-N 3.42Å; I290-F293 HydrophobicContact CD1-CB 4.01Å; I290-F293 HydrophobicContact CD1-CD2 4.01Å; I290-F293 HydrophobicContact CD1-CG 4.14Å; I290-F293 CarbonylContact O-C 3.58Å; I290-F293 WeakPolarHBondContact O-CA 3.42Å; I290-F293 WeakPolarHBondContact O-CB 3.08Å; I290-F293 PolarHBondContact O-N 3.22Å; I290-N294 PolarHBondContact O-N 3.37Å; I290-G295 PolarHBondContact O-N 2.91Å
291	E	92.1	Very high	92.9	Very high	91 Å²	91	24.5 Å²	24.5	43%	0.425	13%	0.129	S	C	.	.	G	3₁₀ helix	trans	-63.8	-28.4	176	-66.7	-173.4	-172.4	0	0	112.4	K217 N289 F293 N294 G295 S297	K217-E291 PolarHBondContact NZ-O 3.34Å; N289-E291 PolarHBondContact O-N 3.44Å; N289-E291 VanDerWaalsContact O-N 3.14Å; E291-F293 PolarHBondContact O-N 3.38Å; E291-N294 PolarHBondContact O-N 3.43Å; E291-N294 VanDerWaalsContact O-N 3.08Å; E291-G295 WeakPolarHBondContact CA-O 3.41Å; E291-S297 PolarHBondContact OE1-OG 3.4Å
292	S	89.6	Confident	93.2	Very high	44 Å²	44	24.4 Å²	24.4	31%	0.308	13%	0.128	S	C	.	.	G	3₁₀ helix	trans	-66.9	-24.7	171.8	-62.6	0	0	0	0	112.8	T64 N289 I290 N294	T64-S292 WeakPolarHBondContact O-CB 3.25Å; T64-S292 PolarHBondContact O-OG 3.17Å; N289-S292 WeakPolarHBondContact O-CB 3.46Å; N289-S292 PolarHBondContact O-N 2.95Å; N289-S292 VanDerWaalsContact O-N 3.13Å; I290-S292 PolarHBondContact O-N 3.42Å; S292-N294 VanDerWaalsContact C-N 3.25Å
293	F	91.1	Very high	93.4	Very high	4 Å²	4	24.7 Å²	24.7	2%	0.018	13%	0.13	C	C	.	.	G	3₁₀ helix	trans	-92.2	13.5	173.5	-57.7	-101.4	0	0	0	112.3	I63 L65 L71 Y89 I204 V206 W285 N289 I290 E291 G295	I63-F293 HydrophobicContact CD1-CB 4.2Å; I63-F293 HydrophobicContact CD1-CD1 3.28Å; I63-F293 HydrophobicContact CD1-CE1 3.78Å; I63-F293 HydrophobicContact CD1-CG 3.8Å; I63-F293 HydrophobicContact CG2-CE2 4.42Å; I63-F293 HydrophobicContact CG2-CZ 4.44Å; L65-F293 HydrophobicContact CD2-CE2 3.65Å; L65-F293 HydrophobicContact CD2-CZ 4Å; L71-F293 HydrophobicContact CD1-CE1 4.25Å; L71-F293 HydrophobicContact CD1-CE2 4.46Å; L71-F293 HydrophobicContact CD1-CZ 3.54Å; Y89-F293 HydrophobicContact CD1-CE1 4.18Å; Y89-F293 AromaticContact CD2-CD1 3.95Å; Y89-F293 HydrophobicContact CD2-CD1 3.95Å; Y89-F293 AromaticContact CD2-CE1 3.73Å; Y89-F293 HydrophobicContact CD2-CE1 3.73Å; Y89-F293 HydrophobicContact CE1-CE1 4.43Å; Y89-F293 AromaticContact CE2-CD1 3.94Å; Y89-F293 HydrophobicContact CE2-CD1 3.94Å; Y89-F293 HydrophobicContact CE2-CE1 4.02Å; Y89-F293 AromaticContact CG-CE1 3.84Å; Y89-F293 HydrophobicContact CG-CE1 3.84Å; I204-F293 HydrophobicContact CD1-CD1 4.36Å; I204-F293 HydrophobicContact CD1-CE1 3.79Å; I204-F293 HydrophobicContact CD1-CE2 4.16Å; I204-F293 HydrophobicContact CD1-CZ 3.64Å; I204-F293 HydrophobicContact CG2-CD1 3.96Å; I204-F293 HydrophobicContact CG2-CE1 4.28Å; I204-F293 HydrophobicContact CG2-CG 4.46Å; V206-F293 HydrophobicContact CG2-CB 4.03Å; V206-F293 HydrophobicContact CG2-CD1 3.97Å; V206-F293 HydrophobicContact CG2-CG 4.49Å; W285-F293 AromaticContact CH2-CE2 3.9Å; W285-F293 HydrophobicContact CH2-CE2 3.9Å; W285-F293 HydrophobicContact CH2-CZ 4.09Å; N289-F293 WeakPolarHBondContact O-CD2 3.28Å; I290-F293 HydrophobicContact CD1-CB 4.01Å; I290-F293 HydrophobicContact CD1-CD2 4.01Å; I290-F293 HydrophobicContact CD1-CG 4.14Å; I290-F293 CarbonylContact O-C 3.58Å; I290-F293 WeakPolarHBondContact O-CA 3.42Å; I290-F293 WeakPolarHBondContact O-CB 3.08Å; I290-F293 PolarHBondContact O-N 3.22Å; E291-F293 PolarHBondContact O-N 3.38Å; F293-G295 PolarHBondContact O-N 3.21Å
294	N	91.2	Very high	93.6	Very high	29 Å²	29	24.7 Å²	24.7	16%	0.155	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	22.3	-175.4	-153.8	51	0	0	0	114.5	Y216 K217 R218 I290 E291 S292	Y216-N294 PolarHBondContact O-ND2 3.45Å; K217-N294 WeakPolarHBondContact CA-O 3.45Å; K217-N294 WeakPolarHBondContact CD-OD1 3.49Å; K217-N294 PolarHBondContact NZ-OD1 2.94Å; R218-N294 PolarHBondContact N-O 3.09Å; I290-N294 PolarHBondContact O-N 3.37Å; E291-N294 PolarHBondContact O-N 3.43Å; E291-N294 VanDerWaalsContact O-N 3.08Å; S292-N294 VanDerWaalsContact C-N 3.25Å
295	G	94.2	Very high	93.7	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	157.7	170.8	0	0	0	0	0	112.8	R218 I290 E291 F293	R218-G295 CarbonylContact O-C 3.53Å; R218-G295 WeakPolarHBondContact O-CA 3.32Å; I290-G295 PolarHBondContact O-N 2.91Å; E291-G295 WeakPolarHBondContact CA-O 3.41Å; F293-G295 PolarHBondContact O-N 3.21Å
296	N	94.8	Very high	93.8	Very high	31 Å²	31	22 Å²	22	17%	0.166	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	104.2	178.1	-174.5	-4.3	0	0	0	110.3	K217 R218 I220 N298 E299	K217-N296 HydrophobicContact CB-CB 3.79Å; R218-N296 WeakPolarHBondContact O-CB 3.01Å; R218-N296 PolarHBondContact O-N 3.47Å; I220-N296 VanDerWaalsContact CD1-O 3.31Å; I220-N296 WeakPolarHBondContact CD1-O 3.43Å; N296-N298 PolarHBondContact O-N 2.89Å; N296-N298 WeakPolarHBondContact OD1-CB 3.5Å; N296-N298 PolarHBondContact OD1-N 3.02Å; N296-N298 VanDerWaalsContact OD1-N 3.08Å; N296-E299 HydrophobicContact CB-CB 4.21Å; N296-E299 WeakPolarHBondContact ND2-CG 3.23Å; N296-E299 PolarHBondContact ND2-OE2 3.1Å; N296-E299 PolarHBondContact O-N 2.96Å
297	S	94.3	Very high	93.8	Very high	12 Å²	12	22.9 Å²	22.9	8%	0.084	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57	-17.5	178.9	59.9	0	0	0	0	114.1	E291 I300	E291-S297 PolarHBondContact OE1-OG 3.4Å; S297-I300 WeakPolarHBondContact O-CD1 3.45Å
298	N	94.7	Very high	94.1	Very high	86 Å²	86	21.5 Å²	21.5	46%	0.46	12%	0.115	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	-0.6	178.9	-65.5	-56.2	0	0	0	115	N296 G328 K330	N296-N298 PolarHBondContact O-N 2.89Å; N296-N298 WeakPolarHBondContact OD1-CB 3.5Å; N296-N298 PolarHBondContact OD1-N 3.02Å; N296-N298 VanDerWaalsContact OD1-N 3.08Å; N298-G328 CarbonylContact C-O 3.57Å; N298-K330 WeakPolarHBondContact O-CE 3.27Å; N298-K330 WeakPolarHBondContact O-CG 3.41Å
299	E	94.5	Very high	94.4	Very high	63 Å²	63	18.9 Å²	18.9	29%	0.294	10%	0.1	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	64.1	-178.6	-69.9	-179.8	161.1	0	0	111.2	P219 I220 N296 G328	P219-E299 HydrophobicContact CB-CB 4.32Å; I220-E299 PolarHBondContact N-O 2.99Å; N296-E299 HydrophobicContact CB-CB 4.21Å; N296-E299 WeakPolarHBondContact ND2-CG 3.23Å; N296-E299 PolarHBondContact ND2-OE2 3.1Å; N296-E299 PolarHBondContact O-N 2.96Å; E299-G328 PolarHBondContact N-O 3.48Å
300	I	97.2	Very high	94.6	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.4	178.9	-59.8	170	0	0	0	110	I220 I286 K287 S297 L302 G328 I329 K330	I220-I300 HydrophobicContact CD1-CG1 4.35Å; I286-I300 HydrophobicContact CG2-CD1 4.27Å; K287-I300 HydrophobicContact CD-CD1 4.45Å; K287-I300 HydrophobicContact CG-CD1 3.73Å; S297-I300 WeakPolarHBondContact O-CD1 3.45Å; I300-L302 HydrophobicContact CG2-CD2 4.1Å; I300-G328 PolarHBondContact N-O 3.32Å; I300-I329 HydrophobicContact CB-CG1 4.21Å; I300-I329 HydrophobicContact CG2-CG1 4.19Å; I300-I329 WeakPolarHBondContact O-CA 3.28Å; I300-K330 PolarHBondContact O-N 3.09Å
301	T	98.1	Very high	94.8	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.1	169.5	-57.4	0	0	0	0	109.5	I220 F221 L222 I303 R331 I333 I762	I220-T301 PolarHBondContact O-N 3.29Å; F221-T301 CarbonylContact C-O 3.56Å; F221-T301 VanDerWaalsContact CA-O 3.26Å; F221-T301 WeakPolarHBondContact CA-O 3.46Å; L222-T301 PolarHBondContact N-O 3.14Å; T301-I303 HydrophobicContact CG2-CG1 3.99Å; T301-R331 WeakPolarHBondContact CA-O 3.46Å; T301-R331 HydrophobicContact CG2-CB 3.81Å; T301-I333 HydrophobicContact CG2-CD1 4.02Å; T301-I333 HydrophobicContact CG2-CG1 3.98Å; T301-I762 HydrophobicContact CG2-CG1 4.25Å
302	L	98.1	Very high	95.1	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123.2	171.9	-60.1	-175.5	0	0	0	109.3	L222 I283 I300 V312 F315 I329 R331 I332 I333	L222-L302 HydrophobicContact CB-CD2 4.05Å; L222-L302 HydrophobicContact CD2-CD2 3.98Å; L222-L302 HydrophobicContact CG-CD2 4.5Å; I283-L302 HydrophobicContact CD1-CD1 4.17Å; I283-L302 HydrophobicContact CD1-CD2 4.09Å; I283-L302 HydrophobicContact CG1-CD2 4.33Å; I300-L302 HydrophobicContact CG2-CD2 4.1Å; L302-V312 HydrophobicContact CB-CG1 3.75Å; L302-V312 HydrophobicContact CB-CG2 4.49Å; L302-V312 HydrophobicContact CD1-CG1 4.04Å; L302-F315 HydrophobicContact CD1-CD1 4.29Å; L302-F315 HydrophobicContact CD1-CE1 4.42Å; L302-I329 HydrophobicContact CD1-CD1 4.09Å; L302-I329 HydrophobicContact CD1-CG2 4.29Å; L302-I329 HydrophobicContact CG-CD1 4.5Å; L302-I329 HydrophobicContact CG-CG2 4.09Å; L302-R331 PolarHBondContact N-O 3.39Å; L302-I332 CarbonylContact O-C 3.55Å; L302-I332 WeakPolarHBondContact O-CA 3.15Å; L302-I333 PolarHBondContact O-N 2.82Å
303	I	97.8	Very high	95.3	Very high	7 Å²	7	12 Å²	12	4%	0.036	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.5	176.3	-52	-174	0	0	0	107.4	F221 L222 F223 V224 T301 I333 L335 L758 I762	F221-I303 HydrophobicContact CB-CD1 3.88Å; F221-I303 HydrophobicContact CB-CG1 4.3Å; F221-I303 HydrophobicContact CD2-CD1 3.79Å; F221-I303 HydrophobicContact CG-CD1 4.11Å; L222-I303 PolarHBondContact O-N 2.9Å; F223-I303 CarbonylContact C-O 3.57Å; F223-I303 WeakPolarHBondContact CA-O 3.48Å; F223-I303 HydrophobicContact CD2-CB 4.17Å; F223-I303 HydrophobicContact CD2-CG2 3.78Å; F223-I303 HydrophobicContact CE2-CG2 4.12Å; V224-I303 PolarHBondContact N-O 3.41Å; T301-I303 HydrophobicContact CG2-CG1 3.99Å; I303-I333 WeakPolarHBondContact CA-O 3.44Å; I303-I333 HydrophobicContact CB-CB 4.33Å; I303-I333 HydrophobicContact CD1-CD1 3.93Å; I303-I333 HydrophobicContact CG1-CB 4.06Å; I303-I333 HydrophobicContact CG1-CD1 3.94Å; I303-I333 HydrophobicContact CG1-CG1 4.17Å; I303-I333 HydrophobicContact CG2-CB 4.12Å; I303-I333 HydrophobicContact CG2-CG2 4.23Å; I303-L335 HydrophobicContact CG2-CD1 4.43Å; I303-L758 HydrophobicContact CD1-CD1 4.46Å; I303-I762 HydrophobicContact CD1-CD1 4.37Å
304	G	97.2	Very high	95.4	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	148.4	173.2	0	0	0	0	0	110.5	A309 I333 L335	G304-A309 WeakPolarHBondContact O-CB 3.49Å; G304-I333 PolarHBondContact N-O 3.41Å; G304-L335 PolarHBondContact O-N 2.9Å
305	Y	94.3	Very high	95.5	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	139.9	171.2	167.5	-86.9	0	0	0	110.1	V224 G226 H307 G308 A309 L335 N336 F718 A719 L722	V224-Y305 PolarHBondContact O-N 2.95Å; G226-Y305 VanDerWaalsContact CA-O 3.26Å; G226-Y305 WeakPolarHBondContact CA-O 3.36Å; Y305-H307 PolarHBondContact O-N 3.37Å; Y305-G308 WeakPolarHBondContact O-CA 3.4Å; Y305-G308 PolarHBondContact O-N 3.03Å; Y305-A309 PolarHBondContact O-N 3.33Å; Y305-A309 VanDerWaalsContact O-N 3.17Å; Y305-L335 CarbonylContact C-O 3.58Å; Y305-L335 VanDerWaalsContact CA-O 3.28Å; Y305-L335 WeakPolarHBondContact CA-O 3.41Å; Y305-L335 HydrophobicContact CD2-CB 3.77Å; Y305-L335 HydrophobicContact CG-CB 4.48Å; Y305-N336 HydrophobicContact CD2-CB 4.26Å; Y305-N336 HydrophobicContact CE2-CB 3.73Å; Y305-N336 VanDerWaalsContact CE2-ND2 3.35Å; Y305-N336 WeakPolarHBondContact CE2-ND2 3.26Å; Y305-F718 HydrophobicContact CD1-CZ 4.25Å; Y305-F718 AromaticContact CE1-CD1 3.97Å; Y305-F718 HydrophobicContact CE1-CD1 3.97Å; Y305-F718 HydrophobicContact CE1-CD2 4.46Å; Y305-F718 AromaticContact CE1-CE1 3.31Å; Y305-F718 HydrophobicContact CE1-CE1 3.31Å; Y305-F718 AromaticContact CE1-CE2 3.87Å; Y305-F718 HydrophobicContact CE1-CE2 3.87Å; Y305-F718 HydrophobicContact CE1-CG 4.5Å; Y305-F718 AromaticContact CE1-CZ 3.25Å; Y305-F718 HydrophobicContact CE1-CZ 3.25Å; Y305-F718 HydrophobicContact CE2-CE2 4.33Å; Y305-F718 AromaticContact CZ-CD1 3.75Å; Y305-F718 AromaticContact CZ-CD2 3.77Å; Y305-F718 AromaticContact CZ-CE1 3.52Å; Y305-F718 AromaticContact CZ-CE2 3.53Å; Y305-F718 AromaticContact CZ-CG 3.86Å; Y305-F718 AromaticContact CZ-CZ 3.41Å; Y305-F718 VanDerWaalsContact CZ-CZ 3.41Å; Y305-F718 WeakPolarHBondContact OH-CA 3.24Å; Y305-F718 WeakPolarHBondContact OH-CB 3.26Å; Y305-F718 WeakPolarHBondContact OH-CD1 3.35Å; Y305-F718 WeakPolarHBondContact OH-CD2 3.33Å; Y305-F718 WeakPolarHBondContact OH-CE1 3.27Å; Y305-F718 WeakPolarHBondContact OH-CE2 3.35Å; Y305-F718 WeakPolarHBondContact OH-CG 3.38Å; Y305-F718 WeakPolarHBondContact OH-CZ 3.23Å; Y305-F718 PolarHBondContact OH-O 2.51Å; Y305-A719 HydrophobicContact CE1-CB 4.01Å; Y305-A719 VanDerWaalsContact CE2-CA 3.49Å; Y305-A719 HydrophobicContact CE2-CB 3.65Å; Y305-A719 VanDerWaalsContact OH-CA 3.29Å; Y305-A719 WeakPolarHBondContact OH-CA 3.3Å; Y305-A719 WeakPolarHBondContact OH-CB 3.45Å; Y305-A719 PolarHBondContact OH-N 3Å; Y305-L722 HydrophobicContact CD1-CD1 4.08Å; Y305-L722 HydrophobicContact CD2-CD1 3.91Å; Y305-L722 HydrophobicContact CD2-CD2 3.79Å; Y305-L722 HydrophobicContact CD2-CG 3.89Å; Y305-L722 HydrophobicContact CE1-CD1 4.44Å; Y305-L722 HydrophobicContact CE2-CD1 4.23Å; Y305-L722 HydrophobicContact CE2-CG 4.18Å; Y305-L722 HydrophobicContact CG-CD1 3.83Å; Y305-L722 HydrophobicContact CG-CD2 4.15Å; Y305-L722 HydrophobicContact CG-CG 4.29Å
306	G	93.5	Very high	95.4	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.4	-123.5	174.8	0	0	0	0	0	114.3	G308 A309 A310 L335	G306-G308 PolarHBondContact O-N 3.16Å; G306-A309 WeakPolarHBondContact O-CB 3.49Å; G306-A309 PolarHBondContact O-N 2.9Å; G306-A309 VanDerWaalsContact O-N 3.16Å; G306-A310 PolarHBondContact O-N 2.92Å; G306-L335 PolarHBondContact N-O 3.33Å
307	H	93.6	Very high	95.1	Very high	18 Å²	18	10 Å²	10	8%	0.083	5%	0.052	C	C	.	.	H	α-helix	trans	-62.6	-29.4	173.8	-69.4	85.7	0	0	0	112.9	G226 E227 S228 Y229 Y305 A310 L311 W343	G226-H307 PolarHBondContact O-N 2.85Å; E227-H307 PolarHBondContact O-ND1 3.44Å; S228-H307 WeakPolarHBondContact CA-ND1 3.44Å; Y229-H307 HydrophobicContact CD1-CB 3.99Å; Y229-H307 AromaticContact CD2-CD2 3.65Å; Y229-H307 HydrophobicContact CE1-CB 3.74Å; Y229-H307 WeakPolarHBondContact CE1-O 3.35Å; Y229-H307 AromaticContact CE2-CD2 3.66Å; Y229-H307 HydrophobicContact CG-CB 4.46Å; Y229-H307 AromaticContact CG-CD2 3.98Å; Y229-H307 PolarHBondContact OH-O 3.48Å; Y305-H307 PolarHBondContact O-N 3.37Å; H307-A310 PolarHBondContact O-N 3.22Å; H307-L311 WeakPolarHBondContact O-CB 3.46Å; H307-L311 PolarHBondContact O-N 3.49Å; H307-W343 AromaticContact CD2-CE3 3.73Å; H307-W343 AromaticContact CD2-CZ3 3.98Å; H307-W343 AromaticContact NE2-CE3 3.65Å
308	G	96.4	Very high	94.8	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-71.6	-37.7	173.5	0	0	0	0	0	111.8	H225 G226 Y305 G306 L311 V312	H225-G308 VanDerWaalsContact O-CA 3.3Å; H225-G308 WeakPolarHBondContact O-CA 3.11Å; G226-G308 VanDerWaalsContact CA-N 3.28Å; Y305-G308 WeakPolarHBondContact O-CA 3.4Å; Y305-G308 PolarHBondContact O-N 3.03Å; G306-G308 PolarHBondContact O-N 3.16Å; G308-L311 PolarHBondContact O-N 3.01Å; G308-V312 WeakPolarHBondContact O-CG2 3.35Å; G308-V312 PolarHBondContact O-N 2.98Å
309	A	97.2	Very high	94.3	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-62.5	-45.3	170.5	0	0	0	0	0	111	G304 Y305 G306 L311 V312 H313 L334	G304-A309 WeakPolarHBondContact O-CB 3.49Å; Y305-A309 PolarHBondContact O-N 3.33Å; Y305-A309 VanDerWaalsContact O-N 3.17Å; G306-A309 WeakPolarHBondContact O-CB 3.49Å; G306-A309 PolarHBondContact O-N 2.9Å; G306-A309 VanDerWaalsContact O-N 3.16Å; A309-L311 VanDerWaalsContact C-N 3.33Å; A309-L311 PolarHBondContact O-N 3.33Å; A309-V312 PolarHBondContact O-N 3Å; A309-H313 WeakPolarHBondContact O-CB 3.43Å; A309-H313 PolarHBondContact O-N 3.45Å; A309-L334 HydrophobicContact CB-CB 4.32Å; A309-L334 HydrophobicContact CB-CD2 4.26Å; A309-L334 WeakPolarHBondContact O-CD2 3.43Å
310	A	95.3	Very high	93.8	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-61.3	-40.8	174.5	0	0	0	0	0	112.1	Y229 G306 H307 H313 L314 W343	Y229-A310 WeakPolarHBondContact OH-CB 3.47Å; G306-A310 PolarHBondContact O-N 2.92Å; H307-A310 PolarHBondContact O-N 3.22Å; A310-H313 PolarHBondContact O-N 2.61Å; A310-L314 WeakPolarHBondContact O-CB 3.18Å; A310-L314 VanDerWaalsContact O-CG 3.26Å; A310-L314 WeakPolarHBondContact O-CG 3.37Å; A310-L314 PolarHBondContact O-N 2.93Å; A310-W343 HydrophobicContact CB-CH2 4.11Å; A310-W343 HydrophobicContact CB-CZ3 3.68Å
311	L	96.2	Very high	93.3	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-63.6	-45.3	177.1	-166.3	71.7	0	0	0	111.8	V224 Y229 Y255 A275 L276 L279 H307 G308 A309 L314 F315 P460	V224-L311 HydrophobicContact CG1-CD2 4.29Å; Y229-L311 HydrophobicContact CE1-CB 4.33Å; Y229-L311 HydrophobicContact CE1-CD1 4.28Å; Y255-L311 HydrophobicContact CD2-CD2 4.29Å; Y255-L311 HydrophobicContact CE1-CD2 4.31Å; Y255-L311 HydrophobicContact CE2-CD2 4.06Å; A275-L311 HydrophobicContact CB-CD1 4.49Å; L276-L311 HydrophobicContact CD2-CD1 3.47Å; L276-L311 VanDerWaalsContact CD2-CD1 3.47Å; L276-L311 HydrophobicContact CD2-CG 3.92Å; L276-L311 HydrophobicContact CG-CD1 3.77Å; L279-L311 HydrophobicContact CD2-CD2 4.38Å; L279-L311 HydrophobicContact CD2-CG 4.29Å; H307-L311 WeakPolarHBondContact O-CB 3.46Å; H307-L311 PolarHBondContact O-N 3.49Å; G308-L311 PolarHBondContact O-N 3.01Å; A309-L311 VanDerWaalsContact C-N 3.33Å; A309-L311 PolarHBondContact O-N 3.33Å; L311-L314 PolarHBondContact O-N 3.32Å; L311-F315 VanDerWaalsContact O-CB 3.3Å; L311-F315 WeakPolarHBondContact O-CB 3.38Å; L311-F315 PolarHBondContact O-N 3.46Å; L311-P460 HydrophobicContact CD1-CG 4.03Å
312	V	97	Very high	92.5	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-62.8	-45	175.2	169.5	0	0	0	0	111.1	V224 L279 L302 G308 A309 F315 S316 I332 L334	V224-V312 HydrophobicContact CB-CG2 3.94Å; V224-V312 HydrophobicContact CG1-CG2 4.39Å; V224-V312 HydrophobicContact CG2-CG2 3.52Å; L279-V312 HydrophobicContact CD2-CG2 4.4Å; L302-V312 HydrophobicContact CB-CG1 3.75Å; L302-V312 HydrophobicContact CB-CG2 4.49Å; L302-V312 HydrophobicContact CD1-CG1 4.04Å; G308-V312 WeakPolarHBondContact O-CG2 3.35Å; G308-V312 PolarHBondContact O-N 2.98Å; A309-V312 PolarHBondContact O-N 3Å; V312-F315 PolarHBondContact O-N 3.21Å; V312-S316 WeakPolarHBondContact O-CB 3.23Å; V312-S316 PolarHBondContact O-N 3.42Å; V312-I332 HydrophobicContact CG1-CG2 3.79Å; V312-L334 HydrophobicContact CB-CD2 4.27Å; V312-L334 HydrophobicContact CG1-CD2 4.06Å
313	H	95.1	Very high	91.6	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-61.7	-48.7	178.1	-173	-172.1	0	0	0	110.5	A309 A310 F315 S316 L317 L334 S338 G339 F340 F526 T632	A309-H313 WeakPolarHBondContact O-CB 3.43Å; A309-H313 PolarHBondContact O-N 3.45Å; A310-H313 PolarHBondContact O-N 2.61Å; H313-F315 PolarHBondContact O-N 2.78Å; H313-S316 PolarHBondContact O-N 3.09Å; H313-S316 PolarHBondContact O-OG 2.93Å; H313-L317 WeakPolarHBondContact O-CG 3.41Å; H313-L317 PolarHBondContact O-N 3.25Å; H313-L334 HydrophobicContact CB-CD1 3.86Å; H313-L334 HydrophobicContact CB-CD2 4.14Å; H313-S338 PolarHBondContact CE1-OG 2.9Å; H313-S338 PolarHBondContact ND1-OG 2.91Å; H313-S338 VanDerWaalsContact ND1-OG 3.09Å; H313-G339 PolarHBondContact ND1-N 2.96Å; H313-F340 AromaticContact CE1-CD2 3.98Å; H313-F340 AromaticContact CE1-CE2 3.8Å; H313-F526 AromaticContact CD2-CD2 3.83Å; H313-F526 AromaticContact CD2-CE2 3.76Å; H313-F526 AromaticContact NE2-CD2 3.95Å; H313-F526 AromaticContact NE2-CE2 3.56Å; H313-F526 AromaticContact NE2-CZ 3.76Å; H313-T632 WeakPolarHBondContact CE1-CG2 3.49Å
314	L	92.8	Very high	90.7	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.7	-44.6	175.6	-71.6	170.6	0	0	0	111.6	A310 L311 S316 L317 S318 T345 P460 I462 F467 Y470	A310-L314 WeakPolarHBondContact O-CB 3.18Å; A310-L314 VanDerWaalsContact O-CG 3.26Å; A310-L314 WeakPolarHBondContact O-CG 3.37Å; A310-L314 PolarHBondContact O-N 2.93Å; L311-L314 PolarHBondContact O-N 3.32Å; L314-S316 VanDerWaalsContact C-N 3.29Å; L314-S316 PolarHBondContact O-N 3.26Å; L314-L317 PolarHBondContact O-N 2.84Å; L314-L317 VanDerWaalsContact O-N 3.12Å; L314-S318 WeakPolarHBondContact O-CB 3.43Å; L314-S318 PolarHBondContact O-N 3.18Å; L314-T345 HydrophobicContact CD1-CG2 3.94Å; L314-T345 HydrophobicContact CD2-CG2 4.21Å; L314-P460 HydrophobicContact CD1-CB 3.66Å; L314-P460 HydrophobicContact CD1-CG 3.75Å; L314-I462 HydrophobicContact CD2-CD1 3.88Å; L314-F467 HydrophobicContact CB-CE1 4.01Å; L314-F467 HydrophobicContact CB-CZ 4.14Å; L314-F467 HydrophobicContact CD2-CE1 4.07Å; L314-F467 HydrophobicContact CD2-CZ 4.45Å; L314-F467 VanDerWaalsContact O-CE1 3.24Å; L314-F467 WeakPolarHBondContact O-CE1 3.31Å; L314-Y470 HydrophobicContact CD2-CD2 4.35Å; L314-Y470 HydrophobicContact CD2-CE2 3.84Å
315	F	94.1	Very high	89.8	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-54	-46.7	174.6	174.8	-97.7	0	0	0	111.6	L276 L279 H280 I283 L302 L311 V312 H313 L317 S318 M320 S321 T325 I329 L525	L276-F315 HydrophobicContact CD2-CB 3.97Å; L279-F315 HydrophobicContact CD2-CB 3.9Å; L279-F315 HydrophobicContact CD2-CD2 4.39Å; L279-F315 HydrophobicContact CD2-CG 4.02Å; H280-F315 HydrophobicContact CB-CE2 3.99Å; I283-F315 HydrophobicContact CD1-CD1 4.31Å; I283-F315 HydrophobicContact CD1-CE1 3.62Å; I283-F315 HydrophobicContact CD1-CZ 3.73Å; L302-F315 HydrophobicContact CD1-CD1 4.29Å; L302-F315 HydrophobicContact CD1-CE1 4.42Å; L311-F315 VanDerWaalsContact O-CB 3.3Å; L311-F315 WeakPolarHBondContact O-CB 3.38Å; L311-F315 PolarHBondContact O-N 3.46Å; V312-F315 PolarHBondContact O-N 3.21Å; H313-F315 PolarHBondContact O-N 2.78Å; F315-L317 PolarHBondContact O-N 2.65Å; F315-S318 WeakPolarHBondContact O-CB 3.46Å; F315-S318 PolarHBondContact O-N 3.49Å; F315-S318 PolarHBondContact O-OG 2.87Å; F315-M320 HydrophobicContact CD2-CB 4.39Å; F315-M320 HydrophobicContact CE2-CB 4.03Å; F315-S321 VanDerWaalsContact O-CB 3.29Å; F315-S321 WeakPolarHBondContact O-CB 3.32Å; F315-S321 PolarHBondContact O-OG 3.43Å; F315-T325 HydrophobicContact CE2-CG2 4.48Å; F315-T325 HydrophobicContact CZ-CG2 3.74Å; F315-I329 HydrophobicContact CE1-CD1 4.35Å; F315-L525 HydrophobicContact CE1-CD2 4.24Å
316	S	92.3	Very high	89.2	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66	-21.2	-179.5	74.6	0	0	0	0	115.2	V312 H313 L314 S321 L525 F526	V312-S316 WeakPolarHBondContact O-CB 3.23Å; V312-S316 PolarHBondContact O-N 3.42Å; H313-S316 PolarHBondContact O-N 3.09Å; H313-S316 PolarHBondContact O-OG 2.93Å; L314-S316 VanDerWaalsContact C-N 3.29Å; L314-S316 PolarHBondContact O-N 3.26Å; S316-S321 PolarHBondContact O-OG 2.73Å; S316-L525 PolarHBondContact O-N 3.44Å; S316-F526 PolarHBondContact O-N 3.12Å; S316-F526 VanDerWaalsContact O-N 3.16Å
317	L	87.2	Confident	88.8	Confident	24 Å²	24	24.1 Å²	24.1	13%	0.126	15%	0.147	C	C	.	.	H	α-helix	trans	-91.9	-15.1	174.7	-65.4	175.3	0	0	0	112.8	H313 L314 F315 F340 Y470 F526 M635	H313-L317 WeakPolarHBondContact O-CG 3.41Å; H313-L317 PolarHBondContact O-N 3.25Å; L314-L317 PolarHBondContact O-N 2.84Å; L314-L317 VanDerWaalsContact O-N 3.12Å; F315-L317 PolarHBondContact O-N 2.65Å; L317-F340 HydrophobicContact CD1-CE1 4.43Å; L317-F340 HydrophobicContact CD1-CZ 4.38Å; L317-Y470 HydrophobicContact CD1-CD2 4.15Å; L317-Y470 HydrophobicContact CD1-CE2 4.4Å; L317-F526 HydrophobicContact CD2-CB 3.8Å; L317-F526 HydrophobicContact CD2-CD1 3.9Å; L317-F526 HydrophobicContact CD2-CG 3.91Å; L317-M635 HydrophobicContact CD2-CE 4.37Å
318	S	87.5	Confident	88.6	Confident	2 Å²	2	23.6 Å²	23.6	1%	0.014	15%	0.146	C	C	.	.	S	Bend	trans	-82.8	160.4	-175	79.5	0	0	0	0	112.1	L314 F315 M320 S321 L466	L314-S318 WeakPolarHBondContact O-CB 3.43Å; L314-S318 PolarHBondContact O-N 3.18Å; F315-S318 WeakPolarHBondContact O-CB 3.46Å; F315-S318 PolarHBondContact O-N 3.49Å; F315-S318 PolarHBondContact O-OG 2.87Å; S318-M320 PolarHBondContact O-N 3.21Å; S318-M320 WeakPolarHBondContact OG-CB 3.39Å; S318-M320 PolarHBondContact OG-N 3.16Å; S318-S321 PolarHBondContact O-N 3.22Å; S318-S321 PolarHBondContact O-OG 2.97Å; S318-L466 CarbonylContact C-O 3.49Å; S318-L466 WeakPolarHBondContact CA-O 3.41Å
319	K	84.6	Confident	88.6	Confident	100 Å²	100	23.9 Å²	23.9	44%	0.435	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	-63.6	-19.1	170.5	-66.8	-167.2	-174.6	178	0	113.3	S321 Q322 N465 L466 P468	K319-S321 PolarHBondContact O-N 3.39Å; K319-Q322 WeakPolarHBondContact O-CB 3.45Å; K319-Q322 PolarHBondContact O-N 3.22Å; K319-Q322 VanDerWaalsContact O-N 3.16Å; K319-N465 WeakPolarHBondContact CD-O 3.47Å; K319-N465 WeakPolarHBondContact CE-O 3.37Å; K319-L466 PolarHBondContact N-O 3.44Å; K319-P468 HydrophobicContact CD-CG 4.43Å; K319-P468 VanDerWaalsContact CE-CG 3.41Å; K319-P468 HydrophobicContact CG-CG 4.18Å
320	M	85	Confident	88.4	Confident	18 Å²	18	27.9 Å²	27.9	9%	0.089	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-67.9	-24	-179.8	-68.4	165.2	63.6	0	0	112.8	L276 Y277 H280 F315 S318 Q322 L466	L276-M320 HydrophobicContact CB-CE 4.22Å; L276-M320 HydrophobicContact CB-SD 4.4Å; L276-M320 VanDerWaalsContact O-CE 3.27Å; L276-M320 WeakPolarHBondContact O-CE 3.2Å; Y277-M320 HydrophobicContact CD1-CE 3.4Å; Y277-M320 VanDerWaalsContact CD1-CE 3.4Å; Y277-M320 HydrophobicContact CD1-SD 4.14Å; Y277-M320 HydrophobicContact CD2-CE 4.4Å; Y277-M320 HydrophobicContact CE1-CE 3.71Å; Y277-M320 HydrophobicContact CE1-SD 3.82Å; Y277-M320 HydrophobicContact CE2-SD 4.46Å; Y277-M320 HydrophobicContact CG-CE 3.79Å; H280-M320 HydrophobicContact CB-CE 3.59Å; F315-M320 HydrophobicContact CD2-CB 4.39Å; F315-M320 HydrophobicContact CE2-CB 4.03Å; S318-M320 PolarHBondContact O-N 3.21Å; S318-M320 WeakPolarHBondContact OG-CB 3.39Å; S318-M320 PolarHBondContact OG-N 3.16Å; M320-Q322 VanDerWaalsContact C-N 3.27Å; M320-L466 HydrophobicContact CB-CD1 4.37Å; M320-L466 HydrophobicContact CG-CD1 3.42Å; M320-L466 VanDerWaalsContact CG-CD1 3.42Å; M320-L466 HydrophobicContact SD-CD1 3.37Å; M320-L466 WeakPolarHBondContact SD-CD1 3.27Å; M320-L466 HydrophobicContact SD-CD2 4.06Å; M320-L466 HydrophobicContact SD-CG 4.36Å
321	S	86.7	Confident	88.5	Confident	3 Å²	3	28.7 Å²	28.7	2%	0.021	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-84.2	0.1	175.9	69.9	0	0	0	0	113.4	F315 S316 S318 K319 G326 L525	F315-S321 VanDerWaalsContact O-CB 3.29Å; F315-S321 WeakPolarHBondContact O-CB 3.32Å; F315-S321 PolarHBondContact O-OG 3.43Å; S316-S321 PolarHBondContact O-OG 2.73Å; S318-S321 PolarHBondContact O-N 3.22Å; S318-S321 PolarHBondContact O-OG 2.97Å; K319-S321 PolarHBondContact O-N 3.39Å; S321-G326 WeakPolarHBondContact O-CA 3.49Å; S321-G326 PolarHBondContact O-N 3.01Å; S321-G326 VanDerWaalsContact O-N 3.16Å; S321-L525 WeakPolarHBondContact OG-CB 3.3Å
322	Q	80.1	Confident	88.6	Confident	82 Å²	82	28.7 Å²	28.7	38%	0.383	17%	0.168	S	C	.	.	S	Bend	trans	-81.8	161.6	177.8	-62.6	-179.9	-11.4	0	0	111.1	K319 M320	K319-Q322 WeakPolarHBondContact O-CB 3.45Å; K319-Q322 PolarHBondContact O-N 3.22Å; K319-Q322 VanDerWaalsContact O-N 3.16Å; M320-Q322 VanDerWaalsContact C-N 3.27Å
323	G	80.7	Confident	88.6	Confident	59 Å²	59	28.8 Å²	28.8	61%	0.608	17%	0.169	S	C	*	.	G	3₁₀ helix	trans	70.2	-143.5	176.8	0	0	0	0	0	114.1	T325 G326 S327	G323-T325 PolarHBondContact O-N 3.39Å; G323-G326 PolarHBondContact O-N 2.87Å; G323-G326 VanDerWaalsContact O-N 3.11Å; G323-S327 PolarHBondContact O-N 2.85Å; G323-S327 VanDerWaalsContact O-N 3.08Å
324	T	78.5	Confident	88.7	Confident	109 Å²	109	28.8 Å²	28.8	67%	0.669	17%	0.169	S	C	*	.	G	3₁₀ helix	trans	-59.8	-30.2	-174.9	51.6	0	0	0	0	112.7	K287	K287-T324 PolarHBondContact NZ-O 3.25Å
325	T	79	Confident	88.9	Confident	7 Å²	7	29.1 Å²	29.1	4%	0.043	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-72.9	-31.8	178.2	-51.1	0	0	0	0	113	H280 I283 M284 K287 F315 G323 I329	H280-T325 WeakPolarHBondContact CD2-CG2 3.41Å; H280-T325 PolarHBondContact CD2-OG1 3.23Å; H280-T325 WeakPolarHBondContact NE2-CG2 3.45Å; H280-T325 PolarHBondContact NE2-OG1 2.84Å; I283-T325 HydrophobicContact CG2-CG2 4.04Å; M284-T325 HydrophobicContact SD-CG2 4.38Å; M284-T325 PolarHBondContact SD-OG1 2.94Å; K287-T325 PolarHBondContact NZ-O 2.76Å; F315-T325 HydrophobicContact CE2-CG2 4.48Å; F315-T325 HydrophobicContact CZ-CG2 3.74Å; G323-T325 PolarHBondContact O-N 3.39Å; T325-I329 WeakPolarHBondContact O-CD1 3.13Å
326	G	80.7	Confident	88.9	Confident	8 Å²	8	29.1 Å²	29.1	8%	0.082	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-36.9	171.6	0	0	0	0	0	113	S321 G323 G328 I329	S321-G326 WeakPolarHBondContact O-CA 3.49Å; S321-G326 PolarHBondContact O-N 3.01Å; S321-G326 VanDerWaalsContact O-N 3.16Å; G323-G326 PolarHBondContact O-N 2.87Å; G323-G326 VanDerWaalsContact O-N 3.11Å; G326-G328 PolarHBondContact O-N 2.73Å; G326-G328 VanDerWaalsContact O-N 3.16Å; G326-I329 PolarHBondContact O-N 2.55Å
327	S	85.6	Confident	88.9	Confident	77 Å²	77	29.1 Å²	29.1	54%	0.538	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	115.5	-173.1	-176.7	0	0	0	0	113.2	K287 G323	K287-S327 WeakPolarHBondContact CE-O 3.45Å; K287-S327 PolarHBondContact NZ-O 3.16Å; G323-S327 PolarHBondContact O-N 2.85Å; G323-S327 VanDerWaalsContact O-N 3.08Å
328	G	89.3	Confident	89.1	Confident	6 Å²	6	28 Å²	28	6%	0.062	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	100.6	-11.9	-179.2	0	0	0	0	0	114.5	N298 E299 I300 G326 K330	N298-G328 CarbonylContact C-O 3.57Å; E299-G328 PolarHBondContact N-O 3.48Å; I300-G328 PolarHBondContact N-O 3.32Å; G326-G328 PolarHBondContact O-N 2.73Å; G326-G328 VanDerWaalsContact O-N 3.16Å; G328-K330 PolarHBondContact O-N 2.88Å
329	I	94.9	Very high	89.2	Confident	6 Å²	6	28 Å²	28	3%	0.031	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	116.6	162.1	-59.5	166	0	0	0	106.6	I283 I300 L302 F315 T325 G326 L525 T529	I283-I329 HydrophobicContact CD1-CD1 4.35Å; I283-I329 HydrophobicContact CG2-CD1 4.2Å; I300-I329 HydrophobicContact CB-CG1 4.21Å; I300-I329 HydrophobicContact CG2-CG1 4.19Å; I300-I329 WeakPolarHBondContact O-CA 3.28Å; L302-I329 HydrophobicContact CD1-CD1 4.09Å; L302-I329 HydrophobicContact CD1-CG2 4.29Å; L302-I329 HydrophobicContact CG-CD1 4.5Å; L302-I329 HydrophobicContact CG-CG2 4.09Å; F315-I329 HydrophobicContact CE1-CD1 4.35Å; T325-I329 WeakPolarHBondContact O-CD1 3.13Å; G326-I329 PolarHBondContact O-N 2.55Å; I329-L525 HydrophobicContact CB-CD1 4.01Å; I329-L525 HydrophobicContact CB-CD2 4.21Å; I329-L525 HydrophobicContact CD1-CD2 3.67Å; I329-L525 HydrophobicContact CG2-CD1 4.26Å; I329-L525 HydrophobicContact CG2-CD2 4.09Å; I329-T529 HydrophobicContact CG2-CG2 4Å
330	K	94.7	Very high	89.3	Confident	85 Å²	85	25.7 Å²	25.7	37%	0.37	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-24.9	-177.2	-62.6	-60	-177.2	-179.3	0	112.2	N298 I300 G328 T529 D530	N298-K330 WeakPolarHBondContact O-CE 3.27Å; N298-K330 WeakPolarHBondContact O-CG 3.41Å; I300-K330 PolarHBondContact O-N 3.09Å; G328-K330 PolarHBondContact O-N 2.88Å; K330-T529 CarbonylContact O-C 3.57Å; K330-T529 WeakPolarHBondContact O-CA 3.16Å; K330-D530 PolarHBondContact O-N 3.01Å
331	R	96.8	Very high	89.5	Confident	16 Å²	16	25 Å²	25	6%	0.06	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	146.2	-163.5	-53.6	177	-177.1	96.3	4.7	111.8	T301 L302 D530 F761 I762 H763	T301-R331 WeakPolarHBondContact CA-O 3.46Å; T301-R331 HydrophobicContact CG2-CB 3.81Å; L302-R331 PolarHBondContact N-O 3.39Å; R331-D530 CarbonylContact C-O 3.37Å; R331-D530 VanDerWaalsContact CA-O 3.28Å; R331-D530 WeakPolarHBondContact CA-O 3.3Å; R331-D530 HydrophobicContact CG-CB 4.3Å; R331-F761 HydrophobicContact CB-CE1 3.9Å; R331-F761 HydrophobicContact CB-CZ 4.3Å; R331-F761 WeakPolarHBondContact CD-O 3.44Å; R331-F761 HydrophobicContact CG-CE1 4.39Å; R331-F761 PolarHBondContact NE-O 3.3Å; R331-I762 VanDerWaalsContact CZ-O 3.24Å; R331-I762 PolarHBondContact NH1-O 2.79Å; R331-H763 VanDerWaalsContact CZ-O 3.31Å; R331-H763 PolarHBondContact NH1-O 2.91Å; R331-H763 PolarHBondContact NH2-O 3.04Å
332	I	97.6	Very high	89.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134	175.4	-62.5	179.8	0	0	0	108.9	L302 V312 L334 T529 D530 L531 L532	L302-I332 CarbonylContact O-C 3.55Å; L302-I332 WeakPolarHBondContact O-CA 3.15Å; V312-I332 HydrophobicContact CG1-CG2 3.79Å; I332-L334 HydrophobicContact CG2-CD2 3.55Å; I332-L334 HydrophobicContact CG2-CG 3.81Å; I332-T529 HydrophobicContact CD1-CG2 4.37Å; I332-T529 WeakPolarHBondContact CD1-OG1 3.07Å; I332-T529 HydrophobicContact CG1-CG2 4.32Å; I332-D530 PolarHBondContact N-O 3.36Å; I332-L531 HydrophobicContact CB-CD1 4.23Å; I332-L531 HydrophobicContact CG2-CD1 4.09Å; I332-L531 WeakPolarHBondContact O-CA 3.39Å; I332-L532 PolarHBondContact O-N 3.4Å
333	I	98	Very high	89.6	Confident	3 Å²	3	22.8 Å²	22.8	2%	0.015	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	117.7	173.9	-52.3	-172.9	0	0	0	108.9	T301 L302 I303 G304 L335 L532 L758 F761	T301-I333 HydrophobicContact CG2-CD1 4.02Å; T301-I333 HydrophobicContact CG2-CG1 3.98Å; L302-I333 PolarHBondContact O-N 2.82Å; I303-I333 WeakPolarHBondContact CA-O 3.44Å; I303-I333 HydrophobicContact CB-CB 4.33Å; I303-I333 HydrophobicContact CD1-CD1 3.93Å; I303-I333 HydrophobicContact CG1-CB 4.06Å; I303-I333 HydrophobicContact CG1-CD1 3.94Å; I303-I333 HydrophobicContact CG1-CG1 4.17Å; I303-I333 HydrophobicContact CG2-CB 4.12Å; I303-I333 HydrophobicContact CG2-CG2 4.23Å; G304-I333 PolarHBondContact N-O 3.41Å; I333-L335 HydrophobicContact CG2-CD2 3.97Å; I333-L335 HydrophobicContact CG2-CG 4.06Å; I333-L532 CarbonylContact C-O 3.5Å; I333-L532 VanDerWaalsContact CA-O 3.25Å; I333-L532 WeakPolarHBondContact CA-O 3.45Å; I333-L532 HydrophobicContact CG1-CB 4.16Å; I333-L532 HydrophobicContact CG2-CB 4.36Å; I333-L532 HydrophobicContact CG2-CD2 3.82Å; I333-L758 HydrophobicContact CD1-CD1 3.26Å; I333-F761 HydrophobicContact CD1-CD1 3.74Å; I333-F761 HydrophobicContact CD1-CE1 3.99Å; I333-F761 HydrophobicContact CG1-CD1 3.99Å; I333-F761 HydrophobicContact CG1-CE1 3.68Å
334	L	97.6	Very high	90	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	109.8	-179.2	-56.8	-176.7	0	0	0	110.1	A309 V312 H313 I332 L531 L532 I533 G534 T632	A309-L334 HydrophobicContact CB-CB 4.32Å; A309-L334 HydrophobicContact CB-CD2 4.26Å; A309-L334 WeakPolarHBondContact O-CD2 3.43Å; V312-L334 HydrophobicContact CB-CD2 4.27Å; V312-L334 HydrophobicContact CG1-CD2 4.06Å; H313-L334 HydrophobicContact CB-CD1 3.86Å; H313-L334 HydrophobicContact CB-CD2 4.14Å; I332-L334 HydrophobicContact CG2-CD2 3.55Å; I332-L334 HydrophobicContact CG2-CG 3.81Å; L334-L531 HydrophobicContact CD1-CD1 3.99Å; L334-L531 HydrophobicContact CG-CD1 4.03Å; L334-L532 PolarHBondContact N-O 3.39Å; L334-I533 HydrophobicContact CB-CB 4.47Å; L334-I533 HydrophobicContact CB-CD1 4.31Å; L334-I533 HydrophobicContact CB-CG1 4.05Å; L334-I533 HydrophobicContact CD1-CD1 4.42Å; L334-I533 CarbonylContact O-C 3.45Å; L334-I533 VanDerWaalsContact O-CA 3.29Å; L334-I533 WeakPolarHBondContact O-CA 2.92Å; L334-I533 WeakPolarHBondContact O-CG1 3.43Å; L334-G534 PolarHBondContact O-N 3.44Å; L334-T632 HydrophobicContact CD1-CG2 4.3Å
335	L	95.9	Very high	90.5	Very high	6 Å²	6	15 Å²	15	3%	0.031	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.8	-179.4	-56.9	175.1	0	0	0	110.7	I303 G304 Y305 G306 I333 G337 L722 L725	I303-L335 HydrophobicContact CG2-CD1 4.43Å; G304-L335 PolarHBondContact O-N 2.9Å; Y305-L335 CarbonylContact C-O 3.58Å; Y305-L335 VanDerWaalsContact CA-O 3.28Å; Y305-L335 WeakPolarHBondContact CA-O 3.41Å; Y305-L335 HydrophobicContact CD2-CB 3.77Å; Y305-L335 HydrophobicContact CG-CB 4.48Å; G306-L335 PolarHBondContact N-O 3.33Å; I333-L335 HydrophobicContact CG2-CD2 3.97Å; I333-L335 HydrophobicContact CG2-CG 4.06Å; L335-G337 PolarHBondContact O-N 3.36Å; L335-L722 HydrophobicContact CD1-CD2 3.69Å; L335-L725 HydrophobicContact CD1-CD1 3.67Å; L335-L725 HydrophobicContact CD2-CD1 4.17Å
336	N	94	Very high	90.7	Very high	0 Å²	0	15 Å²	15	0%	0	8%	0.084	C	C	.	.	S	Bend	trans	50.3	33.8	176.3	-64	-66.3	0	0	0	114.5	Y305 G534 W535 T536 Y625 F718 D721	Y305-N336 HydrophobicContact CD2-CB 4.26Å; Y305-N336 HydrophobicContact CE2-CB 3.73Å; Y305-N336 VanDerWaalsContact CE2-ND2 3.35Å; Y305-N336 WeakPolarHBondContact CE2-ND2 3.26Å; N336-G534 PolarHBondContact N-O 3.48Å; N336-W535 VanDerWaalsContact OD1-CA 3.28Å; N336-W535 WeakPolarHBondContact OD1-CA 3.41Å; N336-T536 PolarHBondContact OD1-N 2.63Å; N336-T536 PolarHBondContact OD1-OG1 2.98Å; N336-Y625 WeakPolarHBondContact O-CD1 3.02Å; N336-Y625 WeakPolarHBondContact O-CE1 3.37Å; N336-F718 HydrophobicContact CB-CD2 3.91Å; N336-F718 HydrophobicContact CB-CE2 3.88Å; N336-D721 PolarHBondContact ND2-OD1 3.47Å; N336-D721 PolarHBondContact ND2-OD2 3.26Å; N336-D721 VanDerWaalsContact ND2-OD2 3.12Å
337	G	92.4	Very high	90.3	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.01	11%	0.109	C	C	.	.			trans	-168.6	154	179.8	0	0	0	0	0	114.2	L335	L335-G337 PolarHBondContact O-N 3.36Å
338	S	91.3	Very high	89.4	Confident	1 Å²	1	20.1 Å²	20.1	1%	0.007	10%	0.097	C	C	.	.			trans	-150.7	146.1	176.9	172	0	0	0	0	110.5	H313 F340 A341 S344 T632	H313-S338 PolarHBondContact CE1-OG 2.9Å; H313-S338 PolarHBondContact ND1-OG 2.91Å; H313-S338 VanDerWaalsContact ND1-OG 3.09Å; S338-F340 PolarHBondContact O-N 3.46Å; S338-F340 VanDerWaalsContact O-N 3.12Å; S338-F340 PolarHBondContact OG-N 2.62Å; S338-A341 WeakPolarHBondContact O-CB 3.48Å; S338-A341 PolarHBondContact O-N 3.1Å; S338-S344 WeakPolarHBondContact O-CB 3.46Å; S338-T632 WeakPolarHBondContact CB-OG1 3.43Å; S338-T632 PolarHBondContact OG-OG1 3.34Å
339	G	89.7	Confident	88.8	Confident	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-14	167	0	0	0	0	0	115	H313 S344 Y470	H313-G339 PolarHBondContact ND1-N 2.96Å; G339-S344 PolarHBondContact O-OG 3.49Å; G339-Y470 PolarHBondContact O-OH 2.85Å
340	F	87.6	Confident	87.9	Confident	53 Å²	53	23.3 Å²	23.3	23%	0.232	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-4.5	173.4	-61.3	-41.9	0	0	0	114.7	H313 L317 S338 Y470 P628 Q631 T632 M635	H313-F340 AromaticContact CE1-CD2 3.98Å; H313-F340 AromaticContact CE1-CE2 3.8Å; L317-F340 HydrophobicContact CD1-CE1 4.43Å; L317-F340 HydrophobicContact CD1-CZ 4.38Å; S338-F340 PolarHBondContact O-N 3.46Å; S338-F340 VanDerWaalsContact O-N 3.12Å; S338-F340 PolarHBondContact OG-N 2.62Å; F340-Y470 AromaticContact CD1-CE2 3.84Å; F340-Y470 HydrophobicContact CD1-CE2 3.84Å; F340-Y470 HydrophobicContact CE1-CD2 4.22Å; F340-Y470 AromaticContact CE1-CE2 3.71Å; F340-Y470 HydrophobicContact CE1-CE2 3.71Å; F340-P628 HydrophobicContact CB-CB 4.3Å; F340-Q631 HydrophobicContact CD2-CB 4.36Å; F340-T632 WeakPolarHBondContact CD2-OG1 3.37Å; F340-M635 HydrophobicContact CE2-CB 4.5Å; F340-M635 HydrophobicContact CE2-SD 3.79Å; F340-M635 HydrophobicContact CZ-SD 3.42Å; F340-M635 WeakPolarHBondContact CZ-SD 3.46Å
341	A	87.6	Confident	87.1	Confident	2 Å²	2	21.5 Å²	21.5	2%	0.017	12%	0.116	C	C	.	.	S	Bend	trans	-68.1	143.2	177.4	0	0	0	0	0	111	S338 W343 S344 L624 P628	S338-A341 WeakPolarHBondContact O-CB 3.48Å; S338-A341 PolarHBondContact O-N 3.1Å; A341-W343 HydrophobicContact CB-CD2 3.86Å; A341-W343 HydrophobicContact CB-CE3 4.46Å; A341-W343 HydrophobicContact CB-CG 4.29Å; A341-W343 HydrophobicContact CB-CH2 4.14Å; A341-W343 HydrophobicContact CB-CZ2 3.49Å; A341-W343 VanDerWaalsContact CB-CZ2 3.49Å; A341-W343 PolarHBondContact O-N 3.08Å; A341-W343 VanDerWaalsContact O-N 3.1Å; A341-S344 VanDerWaalsContact O-CB 3.26Å; A341-S344 WeakPolarHBondContact O-CB 3.31Å; A341-S344 PolarHBondContact O-N 3Å; A341-S344 PolarHBondContact O-OG 2.95Å; A341-L624 WeakPolarHBondContact CB-O 3.47Å; A341-P628 HydrophobicContact CB-CB 4.14Å; A341-P628 HydrophobicContact CB-CG 4.21Å
342	P	83.5	Confident	86.5	Confident	33 Å²	33	21 Å²	21	21%	0.214	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-27.3	-179.7	-26.6	35.1	0	0	0	114.7	M566 L624	P342-M566 HydrophobicContact CG-CE 3.95Å; P342-L624 HydrophobicContact CB-CD2 4.34Å; P342-L624 HydrophobicContact CG-CD2 4.08Å
343	W	86.2	Confident	85.9	Confident	7 Å²	7	21.4 Å²	21.4	3%	0.027	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-1.8	176.4	51.9	-101.5	0	0	0	113.7	H307 A310 A341 T345 L454 T456 L624 Y625	H307-W343 AromaticContact CD2-CE3 3.73Å; H307-W343 AromaticContact CD2-CZ3 3.98Å; H307-W343 AromaticContact NE2-CE3 3.65Å; A310-W343 HydrophobicContact CB-CH2 4.11Å; A310-W343 HydrophobicContact CB-CZ3 3.68Å; A341-W343 HydrophobicContact CB-CD2 3.86Å; A341-W343 HydrophobicContact CB-CE3 4.46Å; A341-W343 HydrophobicContact CB-CG 4.29Å; A341-W343 HydrophobicContact CB-CH2 4.14Å; A341-W343 HydrophobicContact CB-CZ2 3.49Å; A341-W343 VanDerWaalsContact CB-CZ2 3.49Å; A341-W343 PolarHBondContact O-N 3.08Å; A341-W343 VanDerWaalsContact O-N 3.1Å; W343-T345 VanDerWaalsContact C-N 3.34Å; W343-L454 WeakPolarHBondContact CB-O 3.38Å; W343-T456 HydrophobicContact CB-CG2 4.36Å; W343-T456 WeakPolarHBondContact O-CB 3.3Å; W343-T456 WeakPolarHBondContact O-CG2 3.35Å; W343-T456 PolarHBondContact O-OG1 3.06Å; W343-L624 PolarHBondContact NE1-O 3.06Å; W343-Y625 AromaticContact CE2-CE1 3.78Å; W343-Y625 AromaticContact CE2-CZ 3.93Å; W343-Y625 HydrophobicContact CH2-CE1 4.23Å; W343-Y625 AromaticContact CZ2-CD1 3.7Å; W343-Y625 HydrophobicContact CZ2-CD1 3.7Å; W343-Y625 AromaticContact CZ2-CE1 3.35Å; W343-Y625 HydrophobicContact CZ2-CE1 3.35Å; W343-Y625 AromaticContact CZ2-CZ 3.98Å; W343-Y625 AromaticContact NE1-CE1 3.91Å; W343-Y625 AromaticContact NE1-CE2 3.88Å; W343-Y625 AromaticContact NE1-CZ 3.7Å
344	S	89.9	Confident	85.2	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.129	C	C	.	.	S	Bend	trans	-76.2	-22.5	-178.4	71.5	0	0	0	0	113.2	S338 G339 A341 P460	S338-S344 WeakPolarHBondContact O-CB 3.46Å; G339-S344 PolarHBondContact O-OG 3.49Å; A341-S344 VanDerWaalsContact O-CB 3.26Å; A341-S344 WeakPolarHBondContact O-CB 3.31Å; A341-S344 PolarHBondContact O-N 3Å; A341-S344 PolarHBondContact O-OG 2.95Å; S344-P460 WeakPolarHBondContact O-CD 3.39Å
345	T	87.8	Confident	84.7	Confident	3 Å²	3	25 Å²	25	2%	0.018	13%	0.134	C	C	.	.	S	Bend	trans	-135.6	149.1	-173.8	62.2	0	0	0	0	111.6	L314 W343 H347 P460 I462	L314-T345 HydrophobicContact CD1-CG2 3.94Å; L314-T345 HydrophobicContact CD2-CG2 4.21Å; W343-T345 VanDerWaalsContact C-N 3.34Å; T345-H347 PolarHBondContact OG1-CE1 3.36Å; T345-H347 PolarHBondContact OG1-NE2 3.4Å; T345-P460 CarbonylContact C-O 3.56Å; T345-P460 WeakPolarHBondContact CA-O 3.49Å; T345-P460 VanDerWaalsContact CB-O 3.32Å; T345-P460 WeakPolarHBondContact CB-O 3.31Å; T345-I462 HydrophobicContact CG2-CD1 3.57Å; T345-I462 HydrophobicContact CG2-CG1 3.65Å
346	S	83.8	Confident	84.3	Confident	7 Å²	7	24.7 Å²	24.7	5%	0.049	13%	0.133	C	C	.	.			trans	-90.8	124.1	174.5	179.6	0	0	0	0	110.9	R457 P460	S346-R457 VanDerWaalsContact CB-O 3.27Å; S346-R457 WeakPolarHBondContact CB-O 3.29Å; S346-R457 PolarHBondContact OG-O 3.2Å; S346-P460 PolarHBondContact N-O 3.1Å
347	H	71.1	Confident	84	Confident	133 Å²	133	25.5 Å²	25.5	62%	0.616	14%	0.137	S	C	*	.			trans	-102.7	-11.4	174	-59.3	-54.9	0	0	0	113.2	T345	T345-H347 PolarHBondContact OG1-CE1 3.36Å; T345-H347 PolarHBondContact OG1-NE2 3.4Å
348	Q	68.5	Low	83.7	Confident	61 Å²	61	29.3 Å²	29.3	29%	0.285	15%	0.153	S	C	.	.			trans	-112.3	40.2	-167.7	-68.2	-171.3	-8.5	0	0	112.9	S350 S351 I352	Q348-S350 VanDerWaalsContact C-N 3.3Å; Q348-S350 PolarHBondContact O-N 2.83Å; Q348-S351 PolarHBondContact O-N 2.89Å; Q348-S351 PolarHBondContact O-OG 3.34Å; Q348-I352 PolarHBondContact O-N 2.87Å
349	T	75.2	Confident	83.4	Confident	29 Å²	29	33.3 Å²	33.3	18%	0.178	17%	0.172	C	C	.	.	H	α-helix	trans	-62.4	-35.9	-176.4	56.1	0	0	0	0	113	F264 I352 L353 V461	F264-T349 HydrophobicContact CB-CG2 4.33Å; F264-T349 HydrophobicContact CD1-CG2 3.88Å; T349-I352 PolarHBondContact O-N 3.23Å; T349-L353 WeakPolarHBondContact O-CG 3.49Å; T349-L353 PolarHBondContact O-N 3.42Å; T349-V461 HydrophobicContact CG2-CG1 4.24Å; T349-V461 HydrophobicContact CG2-CG2 3.59Å
350	S	76.4	Confident	83.3	Confident	50 Å²	50	34.8 Å²	34.8	35%	0.35	18%	0.18	S	C	.	.	H	α-helix	trans	-68.2	-37.1	-179.2	-62.4	0	0	0	0	113.1	Q348 L353 I354	Q348-S350 VanDerWaalsContact C-N 3.3Å; Q348-S350 PolarHBondContact O-N 2.83Å; S350-L353 PolarHBondContact O-N 3.18Å; S350-I354 VanDerWaalsContact O-CG1 3.31Å; S350-I354 WeakPolarHBondContact O-CG1 3.46Å; S350-I354 PolarHBondContact O-N 3.33Å
351	S	78.8	Confident	83.2	Confident	46 Å²	46	38.1 Å²	38.1	32%	0.322	20%	0.2	S	C	.	.	H	α-helix	trans	-68.6	-38.9	179.6	59.6	0	0	0	0	111.4	Q348 L353 I354 E355	Q348-S351 PolarHBondContact O-N 2.89Å; Q348-S351 PolarHBondContact O-OG 3.34Å; S351-L353 PolarHBondContact O-N 3.43Å; S351-I354 PolarHBondContact O-N 2.8Å; S351-E355 WeakPolarHBondContact O-CB 3.47Å; S351-E355 PolarHBondContact O-N 3.35Å
352	I	83.6	Confident	82.8	Confident	6 Å²	6	38.6 Å²	38.6	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-60.9	-45.6	174.4	-62.3	165.8	0	0	0	110.3	Q348 T349 I354 E355 L356 L449 R457 L458	Q348-I352 PolarHBondContact O-N 2.87Å; T349-I352 PolarHBondContact O-N 3.23Å; I352-I354 VanDerWaalsContact C-N 3.34Å; I352-I354 PolarHBondContact O-N 2.87Å; I352-E355 PolarHBondContact O-N 2.95Å; I352-L356 HydrophobicContact CG2-CD1 3.9Å; I352-L356 HydrophobicContact CG2-CG 4.27Å; I352-L356 WeakPolarHBondContact O-CB 3.38Å; I352-L356 VanDerWaalsContact O-CG 3.25Å; I352-L356 WeakPolarHBondContact O-CG 3.47Å; I352-L356 PolarHBondContact O-N 2.99Å; I352-L449 HydrophobicContact CG2-CD1 4.12Å; I352-R457 HydrophobicContact CD1-CB 3.74Å; I352-R457 WeakPolarHBondContact CD1-O 3.44Å; I352-R457 HydrophobicContact CG1-CB 4.28Å; I352-L458 HydrophobicContact CD1-CD2 4.19Å; I352-L458 HydrophobicContact CG2-CD2 4.37Å
353	L	85.6	Confident	82.3	Confident	9 Å²	9	39.8 Å²	39.8	5%	0.047	21%	0.209	C	C	.	.	H	α-helix	trans	-61.8	-42.8	177.7	-67.4	172.4	0	0	0	112	L263 T265 T349 S350 S351 E355 L356 L357 I422 L427 L430	L263-L353 HydrophobicContact CD1-CD2 4.06Å; T265-L353 HydrophobicContact CG2-CD1 4.05Å; T265-L353 HydrophobicContact CG2-CD2 3.81Å; T349-L353 WeakPolarHBondContact O-CG 3.49Å; T349-L353 PolarHBondContact O-N 3.42Å; S350-L353 PolarHBondContact O-N 3.18Å; S351-L353 PolarHBondContact O-N 3.43Å; L353-E355 VanDerWaalsContact C-N 3.32Å; L353-E355 PolarHBondContact O-N 3.49Å; L353-L356 PolarHBondContact O-N 3.5Å; L353-L357 WeakPolarHBondContact O-CB 3.38Å; L353-L357 VanDerWaalsContact O-CG 3.24Å; L353-L357 WeakPolarHBondContact O-CG 3.43Å; L353-L357 PolarHBondContact O-N 3.14Å; L353-I422 HydrophobicContact CB-CD1 3.69Å; L353-I422 HydrophobicContact CD1-CD1 4.26Å; L353-L427 HydrophobicContact CD1-CD2 4.02Å; L353-L427 HydrophobicContact CD2-CD2 4.39Å; L353-L430 HydrophobicContact CD2-CD2 3.92Å
354	I	83.4	Confident	81.3	Confident	53 Å²	53	43.8 Å²	43.8	27%	0.272	23%	0.231	S	C	.	.	H	α-helix	trans	-62.2	-42.4	175.8	-69.1	166.4	0	0	0	110.6	S350 S351 I352 L357 K358 T420 I422	S350-I354 VanDerWaalsContact O-CG1 3.31Å; S350-I354 WeakPolarHBondContact O-CG1 3.46Å; S350-I354 PolarHBondContact O-N 3.33Å; S351-I354 PolarHBondContact O-N 2.8Å; I352-I354 VanDerWaalsContact C-N 3.34Å; I352-I354 PolarHBondContact O-N 2.87Å; I354-L357 PolarHBondContact O-N 2.86Å; I354-K358 HydrophobicContact CG2-CD 4.31Å; I354-K358 WeakPolarHBondContact O-CG 3.42Å; I354-K358 PolarHBondContact O-N 2.99Å; I354-T420 HydrophobicContact CD1-CG2 4.43Å; I354-I422 HydrophobicContact CG1-CD1 4.02Å
355	E	85.5	Confident	79.8	Confident	24 Å²	24	50.8 Å²	50.8	11%	0.112	26%	0.264	C	S	.	.	H	α-helix	trans	-65.6	-43.7	178.6	-171.2	167.1	-167.1	0	0	112	S351 I352 L353 L357 K358 Q359 L449 T450 R457	S351-E355 WeakPolarHBondContact O-CB 3.47Å; S351-E355 PolarHBondContact O-N 3.35Å; I352-E355 PolarHBondContact O-N 2.95Å; L353-E355 VanDerWaalsContact C-N 3.32Å; L353-E355 PolarHBondContact O-N 3.49Å; E355-L357 VanDerWaalsContact C-N 3.34Å; E355-L357 PolarHBondContact O-N 2.99Å; E355-K358 WeakPolarHBondContact O-CB 3.34Å; E355-K358 PolarHBondContact O-N 3.3Å; E355-K358 VanDerWaalsContact O-N 3.16Å; E355-Q359 HydrophobicContact CG-CG 4.38Å; E355-Q359 VanDerWaalsContact O-CG 3.29Å; E355-Q359 WeakPolarHBondContact O-CG 3.26Å; E355-Q359 PolarHBondContact O-N 3.29Å; E355-L449 HydrophobicContact CB-CD2 4.11Å; E355-L449 HydrophobicContact CG-CD2 3.79Å; E355-T450 VanDerWaalsContact CD-N 3.28Å; E355-T450 WeakPolarHBondContact OE1-CG2 3.39Å; E355-T450 PolarHBondContact OE1-N 2.89Å; E355-T450 PolarHBondContact OE1-OG1 3.02Å; E355-T450 PolarHBondContact OE2-N 3.37Å; E355-T450 VanDerWaalsContact OE2-N 3.15Å; E355-T450 PolarHBondContact OE2-OG1 3.43Å; E355-R457 IonicContact OE2-NH1 3.68Å
356	L	88.4	Confident	78.4	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.6	-44.3	173.7	-70.7	169.5	0	0	0	111.6	L259 L263 I352 L353 K358 Q359 L360 L430 L434 L445 L449	L259-L356 HydrophobicContact CD1-CD2 4.33Å; L259-L356 HydrophobicContact CD2-CD1 4.08Å; L259-L356 HydrophobicContact CD2-CD2 4.34Å; L263-L356 HydrophobicContact CD1-CD1 3.94Å; I352-L356 HydrophobicContact CG2-CD1 3.9Å; I352-L356 HydrophobicContact CG2-CG 4.27Å; I352-L356 WeakPolarHBondContact O-CB 3.38Å; I352-L356 VanDerWaalsContact O-CG 3.25Å; I352-L356 WeakPolarHBondContact O-CG 3.47Å; I352-L356 PolarHBondContact O-N 2.99Å; L353-L356 PolarHBondContact O-N 3.5Å; L356-K358 VanDerWaalsContact C-N 3.3Å; L356-K358 PolarHBondContact O-N 2.95Å; L356-Q359 PolarHBondContact O-N 3.22Å; L356-L360 WeakPolarHBondContact O-CB 3.43Å; L356-L360 VanDerWaalsContact O-CG 3.23Å; L356-L360 WeakPolarHBondContact O-CG 3.23Å; L356-L360 PolarHBondContact O-N 3.45Å; L356-L430 HydrophobicContact CB-CD1 3.99Å; L356-L430 HydrophobicContact CB-CD2 4.34Å; L356-L434 HydrophobicContact CD1-CD1 4.46Å; L356-L445 HydrophobicContact CD2-CD1 4.19Å; L356-L445 HydrophobicContact CD2-CD2 3.5Å; L356-L445 HydrophobicContact CD2-CG 3.7Å; L356-L449 HydrophobicContact CD2-CD1 4.34Å; L356-L449 HydrophobicContact CD2-CD2 3.84Å; L356-L449 HydrophobicContact CD2-CG 4.49Å; L356-L449 HydrophobicContact CG-CD2 4.02Å
357	L	87	Confident	77	Confident	17 Å²	17	54.2 Å²	54.2	9%	0.089	28%	0.281	C	S	.	.	H	α-helix	trans	-59.8	-40.9	175.7	-72.2	169.1	0	0	0	111.7	L353 I354 E355 N361 I362 I422 L426 L430	L353-L357 WeakPolarHBondContact O-CB 3.38Å; L353-L357 VanDerWaalsContact O-CG 3.24Å; L353-L357 WeakPolarHBondContact O-CG 3.43Å; L353-L357 PolarHBondContact O-N 3.14Å; I354-L357 PolarHBondContact O-N 2.86Å; E355-L357 VanDerWaalsContact C-N 3.34Å; E355-L357 PolarHBondContact O-N 2.99Å; L357-N361 PolarHBondContact O-N 3.47Å; L357-N361 VanDerWaalsContact O-N 3.16Å; L357-I362 HydrophobicContact CD2-CB 3.72Å; L357-I362 HydrophobicContact CD2-CD1 4.32Å; L357-I362 HydrophobicContact CD2-CG2 3.59Å; L357-I362 PolarHBondContact O-N 2.99Å; L357-I422 HydrophobicContact CD1-CD1 4.42Å; L357-I422 HydrophobicContact CD1-CG2 3.79Å; L357-L426 HydrophobicContact CD2-CB 4.23Å; L357-L430 HydrophobicContact CD2-CB 3.96Å; L357-L430 HydrophobicContact CD2-CD1 4.47Å; L357-L430 HydrophobicContact CD2-CD2 4.2Å; L357-L430 HydrophobicContact CD2-CG 4.44Å; L357-L430 HydrophobicContact CG-CD2 4.25Å
358	K	86.1	Confident	75.9	Confident	81 Å²	81	57.4 Å²	57.4	35%	0.352	29%	0.288	S	S	.	.	H	α-helix	trans	-66.2	-48.7	176.4	-72.6	177.2	-175.8	-172.9	0	111.8	I354 E355 L356 L360 N361 Y406	I354-K358 HydrophobicContact CG2-CD 4.31Å; I354-K358 WeakPolarHBondContact O-CG 3.42Å; I354-K358 PolarHBondContact O-N 2.99Å; E355-K358 WeakPolarHBondContact O-CB 3.34Å; E355-K358 PolarHBondContact O-N 3.3Å; E355-K358 VanDerWaalsContact O-N 3.16Å; L356-K358 VanDerWaalsContact C-N 3.3Å; L356-K358 PolarHBondContact O-N 2.95Å; K358-L360 PolarHBondContact O-N 3.27Å; K358-N361 PolarHBondContact O-N 2.97Å; K358-N361 VanDerWaalsContact O-N 3.1Å; K358-N361 PolarHBondContact O-OD1 2.99Å; K358-Y406 HydrophobicContact CD-CE1 4.39Å
359	Q	86.2	Confident	75.1	Confident	86 Å²	86	59.6 Å²	59.6	40%	0.402	30%	0.301	S	S	.	.	H	α-helix	trans	-62.4	-32	-179.7	-69	-68	-13.8	0	0	112.3	E355 L356 L445	E355-Q359 HydrophobicContact CG-CG 4.38Å; E355-Q359 VanDerWaalsContact O-CG 3.29Å; E355-Q359 WeakPolarHBondContact O-CG 3.26Å; E355-Q359 PolarHBondContact O-N 3.29Å; L356-Q359 PolarHBondContact O-N 3.22Å; Q359-L445 HydrophobicContact CB-CD1 3.63Å; Q359-L445 HydrophobicContact CG-CD1 4.28Å
360	L	86.9	Confident	73.9	Confident	31 Å²	31	61.6 Å²	61.6	16%	0.162	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	2.9	178.4	-60.9	174.7	0	0	0	113.8	L356 K358 I362 L430 T433 L434 F441 L445	L356-L360 WeakPolarHBondContact O-CB 3.43Å; L356-L360 VanDerWaalsContact O-CG 3.23Å; L356-L360 WeakPolarHBondContact O-CG 3.23Å; L356-L360 PolarHBondContact O-N 3.45Å; K358-L360 PolarHBondContact O-N 3.27Å; L360-I362 HydrophobicContact CB-CD1 3.79Å; L360-I362 HydrophobicContact CB-CG1 3.81Å; L360-I362 HydrophobicContact CD1-CD1 4.01Å; L360-I362 PolarHBondContact O-N 3.3Å; L360-I362 VanDerWaalsContact O-N 3.16Å; L360-L430 HydrophobicContact CD1-CD1 3.36Å; L360-T433 HydrophobicContact CD1-CG2 4.35Å; L360-L434 HydrophobicContact CD1-CD2 4.08Å; L360-L434 HydrophobicContact CD1-CG 4.45Å; L360-F441 HydrophobicContact CD2-CE1 3.59Å; L360-F441 HydrophobicContact CD2-CZ 3.32Å; L360-L445 HydrophobicContact CD1-CD2 4.4Å; L360-L445 HydrophobicContact CD2-CD1 4.31Å; L360-L445 HydrophobicContact CD2-CD2 4.26Å; L360-L445 HydrophobicContact CG-CD2 4.5Å
361	N	85.3	Confident	72.4	Confident	123 Å²	123	64.7 Å²	64.7	66%	0.658	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	32.3	-174.8	-74	-28.9	0	0	0	114	L357 K358 T363 N366	L357-N361 PolarHBondContact O-N 3.47Å; L357-N361 VanDerWaalsContact O-N 3.16Å; K358-N361 PolarHBondContact O-N 2.97Å; K358-N361 VanDerWaalsContact O-N 3.1Å; K358-N361 PolarHBondContact O-OD1 2.99Å; N361-T363 PolarHBondContact O-N 3.23Å; N361-N366 PolarHBondContact O-ND2 3.42Å
362	I	79.6	Confident	70.6	Confident	11 Å²	11	66.6 Å²	66.6	6%	0.056	33%	0.331	C	S	.	.			trans	-82.1	106.2	-179.8	-63.5	173.6	0	0	0	108.9	L357 L360 L426 L430	L357-I362 HydrophobicContact CD2-CB 3.72Å; L357-I362 HydrophobicContact CD2-CD1 4.32Å; L357-I362 HydrophobicContact CD2-CG2 3.59Å; L357-I362 PolarHBondContact O-N 2.99Å; L360-I362 HydrophobicContact CB-CD1 3.79Å; L360-I362 HydrophobicContact CB-CG1 3.81Å; L360-I362 HydrophobicContact CD1-CD1 4.01Å; L360-I362 PolarHBondContact O-N 3.3Å; L360-I362 VanDerWaalsContact O-N 3.16Å; I362-L426 HydrophobicContact CG2-CD2 3.75Å; I362-L430 HydrophobicContact CD1-CB 4.09Å; I362-L430 HydrophobicContact CD1-CD1 4.03Å
363	T	73	Confident	68.6	Low	59 Å²	59	72.3 Å²	72.3	36%	0.362	36%	0.361	S	S	.	.			trans	-116.7	164.3	179.6	68.2	0	0	0	0	111.9	N361 Q365 N366	N361-T363 PolarHBondContact O-N 3.23Å; T363-Q365 PolarHBondContact O-N 2.95Å; T363-Q365 PolarHBondContact OG1-N 3.47Å; T363-N366 PolarHBondContact O-N 3.01Å; T363-N366 VanDerWaalsContact O-N 3.15Å; T363-N366 PolarHBondContact OG1-N 2.97Å; T363-N366 PolarHBondContact OG1-OD1 3.26Å
364	N	64.2	Low	66.4	Low	91 Å²	91	78.1 Å²	78.1	49%	0.487	39%	0.393	S	S	.	.	H	α-helix	trans	-58.8	-25	170.3	-78.1	-32.2	0	0	0	112.7	L367 R368 L426	N364-L367 PolarHBondContact O-N 3.15Å; N364-R368 PolarHBondContact O-N 2.84Å; N364-L426 WeakPolarHBondContact OD1-CD1 3.24Å
365	Q	59.1	Low	64.3	Low	147 Å²	147	83 Å²	83	69%	0.687	41%	0.414	S	S	*	.	H	α-helix	trans	-69.1	-40	176.4	-70.2	176.6	-22.3	0	0	111.4	T363 L367 R368 N369	T363-Q365 PolarHBondContact O-N 2.95Å; T363-Q365 PolarHBondContact OG1-N 3.47Å; Q365-L367 PolarHBondContact O-N 3.28Å; Q365-R368 PolarHBondContact O-N 3.38Å; Q365-R368 VanDerWaalsContact O-N 3.08Å; Q365-N369 PolarHBondContact O-N 3.49Å
366	N	58.9	Low	62	Low	58 Å²	58	88.4 Å²	88.4	31%	0.31	44%	0.444	S	S	.	.	H	α-helix	trans	-60.7	-33	176.3	-60.6	0.4	0	0	0	111.9	N361 T363 N370	N361-N366 PolarHBondContact O-ND2 3.42Å; T363-N366 PolarHBondContact O-N 3.01Å; T363-N366 VanDerWaalsContact O-N 3.15Å; T363-N366 PolarHBondContact OG1-N 2.97Å; T363-N366 PolarHBondContact OG1-OD1 3.26Å; N366-N370 PolarHBondContact O-N 3.28Å; N366-N370 PolarHBondContact O-ND2 3.14Å
367	L	54.1	Low	59.4	Low	24 Å²	24	94.2 Å²	94.2	13%	0.126	48%	0.475	C	S	.	.	H	α-helix	trans	-71.3	-32.5	176.2	-71.1	172.6	0	0	0	113.3	N364 Q365 K371 Q425 L426 H429	N364-L367 PolarHBondContact O-N 3.15Å; Q365-L367 PolarHBondContact O-N 3.28Å; L367-K371 PolarHBondContact O-N 2.64Å; L367-Q425 HydrophobicContact CD1-CB 3.61Å; L367-Q425 HydrophobicContact CD2-CB 4.21Å; L367-L426 HydrophobicContact CD1-CD2 3.42Å; L367-L426 VanDerWaalsContact CD1-CD2 3.42Å; L367-L426 HydrophobicContact CD1-CG 3.75Å; L367-L426 HydrophobicContact CG-CD2 4.08Å; L367-H429 HydrophobicContact CD2-CB 4.21Å
368	R	47.8	Very low	56.6	Low	200 Å²	200	98.5 Å²	98.5	76%	0.755	50%	0.504	S	S	*	.	H	α-helix	trans	-70.3	-40.4	176.4	-72.4	-175.3	178.9	-178.5	-0.7	111.3	N364 Q365 N370 K371	N364-R368 PolarHBondContact O-N 2.84Å; Q365-R368 PolarHBondContact O-N 3.38Å; Q365-R368 VanDerWaalsContact O-N 3.08Å; R368-N370 VanDerWaalsContact C-N 3.35Å; R368-N370 PolarHBondContact O-N 2.74Å; R368-K371 PolarHBondContact O-N 3.33Å
369	N	51.1	Low	54	Low	107 Å²	107	104.4 Å²	104.4	57%	0.572	53%	0.525	S	S	*	.	H	α-helix	trans	-70.3	-29.3	179.8	-64.8	-6.3	0	0	0	113.1	Q365 S372	Q365-N369 PolarHBondContact O-N 3.49Å; N369-S372 PolarHBondContact O-OG 2.87Å
370	N	50	Low	51.4	Low	70 Å²	70	107 Å²	107	37%	0.374	54%	0.538	S	S	.	.	H	α-helix	trans	-83.2	-23.1	177.2	-72.4	-15.3	0	0	0	113.4	N366 R368 L373 N374	N366-N370 PolarHBondContact O-N 3.28Å; N366-N370 PolarHBondContact O-ND2 3.14Å; R368-N370 VanDerWaalsContact C-N 3.35Å; R368-N370 PolarHBondContact O-N 2.74Å; N370-L373 PolarHBondContact O-N 3.09Å; N370-N374 PolarHBondContact O-N 2.88Å
371	K	46.8	Very low	48.7	Very low	115 Å²	115	113.5 Å²	113.5	50%	0.5	57%	0.567	S	S	.	*	H	α-helix	trans	-66.9	-34.4	174.8	-89.1	-176.2	173.6	-176.7	0	112.7	L367 R368 L373 N374	L367-K371 PolarHBondContact O-N 2.64Å; R368-K371 PolarHBondContact O-N 3.33Å; K371-L373 PolarHBondContact O-N 3.2Å; K371-N374 PolarHBondContact O-N 3.42Å
372	S	39.8	Very low	46.1	Very low	86 Å²	86	116.2 Å²	116.2	60%	0.601	58%	0.575	S	S	*	*	H	α-helix	trans	-70.9	-11.5	175.8	52.4	0	0	0	0	114.5	N369	N369-S372 PolarHBondContact O-OG 2.87Å
373	L	40.8	Very low	43.8	Very low	127 Å²	127	123.3 Å²	123.3	67%	0.665	61%	0.613	S	S	*	*	H	α-helix	trans	-100.4	-23.2	178.6	-80.4	154.4	0	0	0	113.1	N370 K371	N370-L373 PolarHBondContact O-N 3.09Å; K371-L373 PolarHBondContact O-N 3.2Å
374	N	40.5	Very low	41.8	Very low	131 Å²	131	125.9 Å²	125.9	70%	0.701	62%	0.623	S	S	*	*	H	α-helix	trans	-100.4	1.3	-173.4	-79.3	-7.3	0	0	0	115.1	N370 K371 N376	N370-N374 PolarHBondContact O-N 2.88Å; K371-N374 PolarHBondContact O-N 3.42Å; N374-N376 VanDerWaalsContact C-N 3.26Å; N374-N376 PolarHBondContact O-N 3.12Å
375	E	39.6	Very low	40.2	Very low	156 Å²	156	127.3 Å²	127.3	73%	0.729	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-4.5	175.5	-76.8	178.9	176.4	0	0	113.6
376	N	37.8	Very low	38.9	Very low	137 Å²	137	127.8 Å²	127.8	73%	0.733	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	10.9	-172.4	-73.8	-19.4	0	0	0	116.9	N374	N374-N376 VanDerWaalsContact C-N 3.26Å; N374-N376 PolarHBondContact O-N 3.12Å
377	N	32.1	Very low	37.6	Very low	122 Å²	122	130.1 Å²	130.1	65%	0.652	64%	0.644	S	S	*	*			trans	-165.5	104.3	169	-112.9	-25.4	0	0	0	114.2
378	P	29.6	Very low	36.6	Very low	107 Å²	107	134.9 Å²	134.9	70%	0.695	67%	0.67	S	S	*	*	S	Bend	trans	-87.5	1.7	-179.2	-6.2	24.1	0	0	0	116.1
379	Y	31.2	Very low	35.7	Very low	204 Å²	204	131.7 Å²	131.7	80%	0.8	66%	0.658	S	S	*	*	S	Bend	trans	-147.1	78.2	-171.1	-62.9	-80.4	0	0	0	113.6
380	Q	30.6	Very low	34.9	Very low	142 Å²	142	135 Å²	135	66%	0.664	67%	0.67	S	S	*	*			trans	-164	14.6	164.5	-113.8	166.5	28.5	0	0	117.3	H382	Q380-H382 VanDerWaalsContact C-N 3.31Å; Q380-H382 PolarHBondContact O-N 3.02Å
381	H	31.5	Very low	33.8	Very low	167 Å²	167	140.9 Å²	140.9	77%	0.773	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	42.6	-169.8	-97.7	-63.9	0	0	0	116.4
382	H	30.7	Very low	32.9	Very low	179 Å²	179	140.4 Å²	140.4	83%	0.829	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116	-10.1	172.5	-106.9	-31	0	0	0	117.6	Q380	Q380-H382 VanDerWaalsContact C-N 3.31Å; Q380-H382 PolarHBondContact O-N 3.02Å
383	N	31.3	Very low	32.3	Very low	161 Å²	161	142.5 Å²	142.5	86%	0.861	71%	0.707	S	S	*	*	S	Bend	trans	-141	15.7	-174.4	-79.4	-30.5	0	0	0	117
384	I	30	Very low	31.7	Very low	113 Å²	113	145.1 Å²	145.1	58%	0.579	71%	0.713	S	S	*	*			trans	-136	95.6	-175.1	-53.6	172.5	0	0	0	109.7
385	E	31.1	Very low	31.1	Very low	121 Å²	121	144 Å²	144	57%	0.565	71%	0.714	S	S	*	*			trans	-176.8	19.3	150.2	-108.9	175	-172.2	0	0	116.5
386	Y	31.1	Very low	30.4	Very low	157 Å²	157	145.9 Å²	145.9	62%	0.616	72%	0.722	S	S	*	*	S	Bend	trans	-85.5	-15.8	170.8	-103.2	-86.8	0	0	0	114.6	V132	V132-Y386 HydrophobicContact CG1-CE1 4.12Å; V132-Y386 WeakPolarHBondContact CG1-OH 3.5Å; V132-Y386 HydrophobicContact CG2-CE1 4.36Å
387	S	31.4	Very low	30.1	Very low	106 Å²	106	145.5 Å²	145.5	74%	0.741	73%	0.725	S	S	*	*	S	Bend	trans	-102.4	-5.6	-173	78.4	0	0	0	0	116.8
388	N	33	Very low	29.9	Very low	125 Å²	125	146.7 Å²	146.7	67%	0.668	73%	0.732	S	S	*	*	S	Bend	trans	-107.2	11.3	-170	-74.2	-11.1	0	0	0	115.7
389	R	30.2	Very low	29.9	Very low	133 Å²	133	148.2 Å²	148.2	50%	0.502	73%	0.734	S	S	.	*			trans	-96.6	23.4	-167.9	-119.6	-169.4	-67.6	-141.7	-3.5	117.4	N436	R389-N436 PolarHBondContact NH1-O 3.49Å
390	Q	33.5	Very low	29.8	Very low	175 Å²	175	146.5 Å²	146.5	82%	0.818	74%	0.735	S	S	*	*	S	Bend	trans	-117.7	-0.8	-175	-87.6	-170.7	-9	0	0	118.1
391	K	27.5	Very low	29.9	Very low	195 Å²	195	149.1 Å²	149.1	85%	0.848	74%	0.744	S	S	*	*	S	Bend	trans	-142.3	125	178.8	-70.9	-178.7	179.9	172.1	0	112.2
392	S	27.6	Very low	30.1	Very low	104 Å²	104	145.3 Å²	145.3	73%	0.727	74%	0.736	S	S	*	*			trans	104.6	134.7	161.9	78.1	0	0	0	0	118.2
393	L	26.9	Very low	30.1	Very low	130 Å²	130	141.9 Å²	141.9	68%	0.681	72%	0.723	S	S	*	*			trans	88.2	112.1	155.8	-62.2	138.3	0	0	0	115.9
394	F	29.4	Very low	30.3	Very low	182 Å²	182	141.9 Å²	141.9	80%	0.798	72%	0.716	S	S	*	*			cis	-152.7	154.3	22.1	-87.8	-85.4	0	0	0	112.6
395	P	27	Very low	30.4	Very low	109 Å²	109	140.2 Å²	140.2	71%	0.708	72%	0.719	S	S	*	*			trans	-80	146.9	177.7	16.4	-1.9	0	0	0	113	T397	P395-T397 PolarHBondContact O-N 3.33Å
396	Q	26	Very low	30.5	Very low	195 Å²	195	140.4 Å²	140.4	91%	0.911	72%	0.715	S	S	*	*			trans	-60.7	114.5	167.9	-66.2	178.2	-11	0	0	110.5
397	T	30.2	Very low	30.8	Very low	129 Å²	129	136.3 Å²	136.3	79%	0.791	70%	0.704	S	S	*	*			trans	-147.2	136.4	158.4	46.5	0	0	0	0	112.2	P395	P395-T397 PolarHBondContact O-N 3.33Å
398	N	27.5	Very low	31	Very low	147 Å²	147	136.5 Å²	136.5	79%	0.786	70%	0.697	S	S	*	*			trans	-68.4	126.8	-175.9	-64.5	-47.4	0	0	0	112.3
399	N	30.2	Very low	31.1	Very low	138 Å²	138	135 Å²	135	74%	0.738	70%	0.696	S	S	*	*			trans	-137.3	77	160.2	-98.4	-25	0	0	0	110.4	K401	N399-K401 PolarHBondContact O-N 3.01Å
400	M	28.8	Very low	31.3	Very low	168 Å²	168	131.2 Å²	131.2	83%	0.828	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-1.6	-178.7	-112	-169.8	-94.2	0	0	114.8
401	K	32.6	Very low	31.3	Very low	198 Å²	198	130 Å²	130	86%	0.861	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-20.6	-173.4	-73.4	-176.6	177.5	179.2	0	115.3	N399	N399-K401 PolarHBondContact O-N 3.01Å
402	S	36.1	Very low	31.4	Very low	86 Å²	86	127.9 Å²	127.9	60%	0.601	68%	0.677	S	S	*	*	S	Bend	trans	-85.9	-17.5	177.7	54.1	0	0	0	0	114	K404	S402-K404 VanDerWaalsContact C-N 3.3Å; S402-K404 PolarHBondContact O-N 3.37Å
403	L	31.5	Very low	31.4	Very low	107 Å²	107	127.5 Å²	127.5	56%	0.56	67%	0.667	S	S	*	*	H	α-helix	trans	-69	-25	-180	-117.4	93.3	0	0	0	113.7	Y406 N407	L403-Y406 PolarHBondContact O-N 3.5Å; L403-N407 PolarHBondContact O-N 3.2Å
404	K	34.1	Very low	31.3	Very low	162 Å²	162	123.2 Å²	123.2	70%	0.704	65%	0.654	S	S	*	*	H	α-helix	trans	-71.4	-43.1	-174.3	-142.3	173.4	-175.4	-177.9	0	112.2	S402 Y406 N407 D408	S402-K404 VanDerWaalsContact C-N 3.3Å; S402-K404 PolarHBondContact O-N 3.37Å; K404-Y406 VanDerWaalsContact C-N 3.28Å; K404-Y406 PolarHBondContact O-N 3.2Å; K404-N407 PolarHBondContact O-N 3.26Å; K404-D408 PolarHBondContact O-N 3.1Å
405	A	33.8	Very low	31.1	Very low	78 Å²	78	118.5 Å²	118.5	65%	0.645	64%	0.642	S	S	*	*	H	α-helix	trans	-67.9	-26.6	175.6	0	0	0	0	0	113.3
406	Y	32.6	Very low	31.3	Very low	124 Å²	124	117.3 Å²	117.3	49%	0.486	63%	0.626	S	S	.	*	H	α-helix	trans	-78.6	-33.2	175.9	-170.9	-103.3	0	0	0	112.5	K358 L403 K404 L410	K358-Y406 HydrophobicContact CD-CE1 4.39Å; L403-Y406 PolarHBondContact O-N 3.5Å; K404-Y406 VanDerWaalsContact C-N 3.28Å; K404-Y406 PolarHBondContact O-N 3.2Å; Y406-L410 HydrophobicContact CD1-CD1 3.85Å; Y406-L410 HydrophobicContact CE1-CD1 3.32Å; Y406-L410 HydrophobicContact CE2-CD1 4.12Å; Y406-L410 HydrophobicContact CG-CD1 4.45Å; Y406-L410 VanDerWaalsContact CZ-CD1 3.46Å; Y406-L410 PolarHBondContact O-N 2.99Å
407	N	37.3	Very low	31.3	Very low	72 Å²	72	111.9 Å²	111.9	39%	0.385	61%	0.606	S	S	.	*	H	α-helix	trans	-67.2	-38.6	173.9	-79.6	-12.1	0	0	0	112	L403 K404 S409 L410 H411	L403-N407 PolarHBondContact O-N 3.2Å; K404-N407 PolarHBondContact O-N 3.26Å; N407-S409 VanDerWaalsContact C-N 3.33Å; N407-S409 PolarHBondContact O-N 2.58Å; N407-L410 PolarHBondContact O-N 3.18Å; N407-H411 PolarHBondContact O-CD2 2.76Å; N407-H411 PolarHBondContact O-N 2.96Å
408	D	35.5	Very low	31.4	Very low	110 Å²	110	112 Å²	112	59%	0.588	61%	0.606	S	S	*	*	H	α-helix	trans	-67.2	-31.9	-179.3	-65.3	-21.9	0	0	0	112.6	K404	K404-D408 PolarHBondContact O-N 3.1Å
409	S	35	Very low	31.5	Very low	94 Å²	94	111.7 Å²	111.7	66%	0.657	61%	0.605	S	S	*	*	H	α-helix	trans	-77.5	-21.8	175	-178.1	0	0	0	0	113.9	N407	N407-S409 VanDerWaalsContact C-N 3.33Å; N407-S409 PolarHBondContact O-N 2.58Å
410	L	33.7	Very low	32.2	Very low	52 Å²	52	107.6 Å²	107.6	27%	0.272	59%	0.585	S	S	.	*	H	α-helix	trans	-93.2	-20.8	179.6	-108	127.7	0	0	0	112.7	Y406 N407 N412 L413	Y406-L410 HydrophobicContact CD1-CD1 3.85Å; Y406-L410 HydrophobicContact CE1-CD1 3.32Å; Y406-L410 HydrophobicContact CE2-CD1 4.12Å; Y406-L410 HydrophobicContact CG-CD1 4.45Å; Y406-L410 VanDerWaalsContact CZ-CD1 3.46Å; Y406-L410 PolarHBondContact O-N 2.99Å; N407-L410 PolarHBondContact O-N 3.18Å; L410-N412 PolarHBondContact O-N 3.19Å; L410-L413 HydrophobicContact CD2-CD1 4.05Å; L410-L413 HydrophobicContact CG-CD1 4.26Å; L410-L413 WeakPolarHBondContact O-CB 3.45Å; L410-L413 PolarHBondContact O-N 3.45Å; L410-L413 VanDerWaalsContact O-N 3.08Å
411	H	34.1	Very low	33.6	Very low	150 Å²	150	106.7 Å²	106.7	69%	0.694	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-13.8	178.6	-97.5	-66	0	0	0	114.5	N407 L413	N407-H411 PolarHBondContact O-CD2 2.76Å; N407-H411 PolarHBondContact O-N 2.96Å; H411-L413 VanDerWaalsContact C-N 3.28Å; H411-L413 PolarHBondContact O-N 3.34Å
412	N	29.4	Very low	35.3	Very low	150 Å²	150	98.4 Å²	98.4	80%	0.802	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-0.4	171.8	-74.4	-18.4	0	0	0	114.1	L410 G414	L410-N412 PolarHBondContact O-N 3.19Å; N412-G414 PolarHBondContact O-N 2.92Å
413	L	27.2	Very low	37.2	Very low	96 Å²	96	97.1 Å²	97.1	50%	0.503	54%	0.538	S	S	.	.	S	Bend	trans	-94.4	96.6	175	-69.8	159.8	0	0	0	109.3	L410 H411	L410-L413 HydrophobicContact CD2-CD1 4.05Å; L410-L413 HydrophobicContact CG-CD1 4.26Å; L410-L413 WeakPolarHBondContact O-CB 3.45Å; L410-L413 PolarHBondContact O-N 3.45Å; L410-L413 VanDerWaalsContact O-N 3.08Å; H411-L413 VanDerWaalsContact C-N 3.28Å; H411-L413 PolarHBondContact O-N 3.34Å
414	G	24.5	Very low	39.2	Very low	40 Å²	40	96.1 Å²	96.1	41%	0.412	53%	0.533	S	S	.	.			trans	-56.1	160.1	175.9	0	0	0	0	0	113	N412 F416	N412-G414 PolarHBondContact O-N 2.92Å; G414-F416 PolarHBondContact O-N 3.44Å
415	P	26.4	Very low	41.2	Very low	84 Å²	84	93 Å²	93	55%	0.545	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	7	-158.1	-10.1	24.8	0	0	0	116.3	Y564	P415-Y564 WeakPolarHBondContact CB-OH 3.19Å; P415-Y564 WeakPolarHBondContact CG-OH 3.47Å
416	F	31.2	Very low	43.5	Very low	84 Å²	84	90 Å²	90	37%	0.368	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.3	24	-170.5	-73.1	-75.2	0	0	0	115	G414 T418 P568	G414-F416 PolarHBondContact O-N 3.44Å; F416-T418 PolarHBondContact O-N 3.04Å; F416-P568 HydrophobicContact CD1-CB 4.16Å; F416-P568 HydrophobicContact CD2-CB 4.04Å; F416-P568 HydrophobicContact CE1-CB 3.91Å; F416-P568 HydrophobicContact CE2-CB 3.79Å; F416-P568 HydrophobicContact CG-CB 4.22Å; F416-P568 HydrophobicContact CZ-CB 3.72Å
417	T	25.9	Very low	45.8	Very low	81 Å²	81	84.6 Å²	84.6	50%	0.497	47%	0.473	S	S	.	.			trans	-77.8	91.3	175.4	58.1	0	0	0	0	111.3	N419	T417-N419 PolarHBondContact O-N 2.66Å
418	T	31.2	Very low	47.8	Very low	130 Å²	130	87.5 Å²	87.5	80%	0.798	48%	0.482	S	S	*	.			trans	-71.5	38.5	174.2	52.2	0	0	0	0	113.8	F416	F416-T418 PolarHBondContact O-N 3.04Å
419	N	30.9	Very low	50	Low	142 Å²	142	85 Å²	85	76%	0.759	47%	0.467	S	S	*	.			trans	-148.2	40.6	-177.6	-118.1	1.1	0	0	0	114.2	T417 N421	T417-N419 PolarHBondContact O-N 2.66Å; N419-N421 PolarHBondContact O-N 2.91Å
420	T	45.5	Very low	52.4	Low	51 Å²	51	80.6 Å²	80.6	31%	0.313	44%	0.436	S	S	.	.			trans	-84.2	98.2	165.4	54.7	0	0	0	0	109.3	I354 I422	I354-T420 HydrophobicContact CD1-CG2 4.43Å; T420-I422 VanDerWaalsContact C-N 3.28Å; T420-I422 PolarHBondContact O-N 3.24Å
421	N	57.6	Low	54.8	Low	150 Å²	150	80.4 Å²	80.4	80%	0.802	43%	0.433	S	S	*	.			trans	-66.7	87.1	167.3	-81.7	-21.5	0	0	0	109.2	N419 P423	N419-N421 PolarHBondContact O-N 2.91Å; N421-P423 VanDerWaalsContact O-CD 3.26Å; N421-P423 WeakPolarHBondContact O-CD 3.42Å
422	I	67.7	Low	57.1	Low	23 Å²	23	78 Å²	78	12%	0.118	42%	0.423	C	S	.	.			trans	-62.8	121.9	170.1	-57.9	175.8	0	0	0	107.4	L353 I354 L357 T420 L424 L426 L427	L353-I422 HydrophobicContact CB-CD1 3.69Å; L353-I422 HydrophobicContact CD1-CD1 4.26Å; I354-I422 HydrophobicContact CG1-CD1 4.02Å; L357-I422 HydrophobicContact CD1-CD1 4.42Å; L357-I422 HydrophobicContact CD1-CG2 3.79Å; T420-I422 VanDerWaalsContact C-N 3.28Å; T420-I422 PolarHBondContact O-N 3.24Å; I422-L424 PolarHBondContact O-N 2.6Å; I422-L426 HydrophobicContact CG2-CB 4.27Å; I422-L427 HydrophobicContact CB-CD1 4.38Å; I422-L427 HydrophobicContact CB-CD2 4.32Å; I422-L427 HydrophobicContact CB-CG 4.28Å; I422-L427 HydrophobicContact CD1-CD2 4.36Å; I422-L427 HydrophobicContact CG2-CD1 4.42Å; I422-L427 HydrophobicContact CG2-CD2 3.85Å; I422-L427 HydrophobicContact CG2-CG 3.79Å
423	P	75.8	Confident	59.8	Low	59 Å²	59	72.9 Å²	72.9	38%	0.383	40%	0.398	S	S	.	.			trans	-49.5	130.3	177.6	-28.7	30.9	0	0	0	112.6	N421 Q425 L426 L427	N421-P423 VanDerWaalsContact O-CD 3.26Å; N421-P423 WeakPolarHBondContact O-CD 3.42Å; P423-Q425 PolarHBondContact O-N 2.97Å; P423-Q425 VanDerWaalsContact O-N 3.08Å; P423-L426 HydrophobicContact CB-CD1 4.1Å; P423-L426 HydrophobicContact CB-CG 4.22Å; P423-L426 HydrophobicContact CG-CD1 3.88Å; P423-L426 WeakPolarHBondContact O-CB 3.14Å; P423-L426 PolarHBondContact O-N 2.77Å; P423-L427 PolarHBondContact O-N 2.92Å
424	L	74.1	Confident	62.7	Low	87 Å²	87	68.3 Å²	68.3	46%	0.455	37%	0.374	S	S	.	.	H	α-helix	trans	-54.2	-34.1	-177.7	-176.8	64.2	0	0	0	113.1	N267 I422 L427 K428	N267-L424 HydrophobicContact CB-CD1 3.59Å; I422-L424 PolarHBondContact O-N 2.6Å; L424-L427 PolarHBondContact O-N 3.06Å; L424-K428 WeakPolarHBondContact O-CG 3.34Å; L424-K428 PolarHBondContact O-N 3.19Å
425	Q	76.3	Confident	65.7	Low	97 Å²	97	69.5 Å²	69.5	45%	0.453	37%	0.368	S	S	.	.	H	α-helix	trans	-64.7	-37.1	177.8	-68.5	171	5.1	0	0	112.4	L367 P423 K428 H429	L367-Q425 HydrophobicContact CD1-CB 3.61Å; L367-Q425 HydrophobicContact CD2-CB 4.21Å; P423-Q425 PolarHBondContact O-N 2.97Å; P423-Q425 VanDerWaalsContact O-N 3.08Å; Q425-K428 PolarHBondContact O-N 2.87Å; Q425-H429 PolarHBondContact O-N 3.34Å
426	L	81	Confident	68.5	Low	13 Å²	13	68.7 Å²	68.7	7%	0.068	36%	0.359	C	S	.	.	H	α-helix	trans	-68	-41.8	175.9	-67.6	172.7	0	0	0	110.7	L357 I362 N364 L367 I422 P423 K428 H429 L430	L357-L426 HydrophobicContact CD2-CB 4.23Å; I362-L426 HydrophobicContact CG2-CD2 3.75Å; N364-L426 WeakPolarHBondContact OD1-CD1 3.24Å; L367-L426 HydrophobicContact CD1-CD2 3.42Å; L367-L426 VanDerWaalsContact CD1-CD2 3.42Å; L367-L426 HydrophobicContact CD1-CG 3.75Å; L367-L426 HydrophobicContact CG-CD2 4.08Å; I422-L426 HydrophobicContact CG2-CB 4.27Å; P423-L426 HydrophobicContact CB-CD1 4.1Å; P423-L426 HydrophobicContact CB-CG 4.22Å; P423-L426 HydrophobicContact CG-CD1 3.88Å; P423-L426 WeakPolarHBondContact O-CB 3.14Å; P423-L426 PolarHBondContact O-N 2.77Å; L426-K428 VanDerWaalsContact C-N 3.34Å; L426-K428 PolarHBondContact O-N 3.14Å; L426-H429 PolarHBondContact O-N 2.75Å; L426-L430 VanDerWaalsContact O-CB 3.3Å; L426-L430 WeakPolarHBondContact O-CB 3.44Å; L426-L430 PolarHBondContact O-N 3.26Å
427	L	80.6	Confident	71.1	Confident	11 Å²	11	65.4 Å²	65.4	6%	0.058	35%	0.346	C	S	.	.	H	α-helix	trans	-62.4	-41.2	176.2	-67.4	172.4	0	0	0	111.8	T265 N267 L353 I422 P423 L424 F431	T265-L427 HydrophobicContact CG2-CD2 4.07Å; N267-L427 HydrophobicContact CB-CD1 4.37Å; N267-L427 WeakPolarHBondContact ND2-CD1 3.28Å; L353-L427 HydrophobicContact CD1-CD2 4.02Å; L353-L427 HydrophobicContact CD2-CD2 4.39Å; I422-L427 HydrophobicContact CB-CD1 4.38Å; I422-L427 HydrophobicContact CB-CD2 4.32Å; I422-L427 HydrophobicContact CB-CG 4.28Å; I422-L427 HydrophobicContact CD1-CD2 4.36Å; I422-L427 HydrophobicContact CG2-CD1 4.42Å; I422-L427 HydrophobicContact CG2-CD2 3.85Å; I422-L427 HydrophobicContact CG2-CG 3.79Å; P423-L427 PolarHBondContact O-N 2.92Å; L424-L427 PolarHBondContact O-N 3.06Å; L427-F431 WeakPolarHBondContact O-CB 3.43Å; L427-F431 PolarHBondContact O-N 3.23Å
428	K	80.2	Confident	74.1	Confident	134 Å²	134	64.2 Å²	64.2	58%	0.583	34%	0.339	S	S	*	.	H	α-helix	trans	-61.7	-45.6	174	-75.2	-177.5	177.4	-172.6	0	111.9	L424 Q425 L426 F431 M432	L424-K428 WeakPolarHBondContact O-CG 3.34Å; L424-K428 PolarHBondContact O-N 3.19Å; Q425-K428 PolarHBondContact O-N 2.87Å; L426-K428 VanDerWaalsContact C-N 3.34Å; L426-K428 PolarHBondContact O-N 3.14Å; K428-F431 PolarHBondContact O-N 2.9Å; K428-M432 WeakPolarHBondContact O-CG 3.29Å; K428-M432 PolarHBondContact O-N 3.13Å
429	H	81.9	Confident	76.8	Confident	56 Å²	56	58.9 Å²	58.9	26%	0.259	31%	0.305	S	S	.	.	H	α-helix	trans	-65.7	-45.4	179	-172.6	64.2	0	0	0	111.7	L367 Q425 L426 F431 M432 T433	L367-H429 HydrophobicContact CD2-CB 4.21Å; Q425-H429 PolarHBondContact O-N 3.34Å; L426-H429 PolarHBondContact O-N 2.75Å; H429-F431 VanDerWaalsContact C-N 3.29Å; H429-F431 PolarHBondContact O-N 2.89Å; H429-M432 PolarHBondContact O-N 2.96Å; H429-T433 PolarHBondContact O-N 2.85Å; H429-T433 PolarHBondContact O-OG1 3.29Å
430	L	86	Confident	79.5	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-52	-50.1	173	173.6	63.4	0	0	0	111	L353 L356 L357 L360 I362 L426 T433 L434	L353-L430 HydrophobicContact CD2-CD2 3.92Å; L356-L430 HydrophobicContact CB-CD1 3.99Å; L356-L430 HydrophobicContact CB-CD2 4.34Å; L357-L430 HydrophobicContact CD2-CB 3.96Å; L357-L430 HydrophobicContact CD2-CD1 4.47Å; L357-L430 HydrophobicContact CD2-CD2 4.2Å; L357-L430 HydrophobicContact CD2-CG 4.44Å; L357-L430 HydrophobicContact CG-CD2 4.25Å; L360-L430 HydrophobicContact CD1-CD1 3.36Å; I362-L430 HydrophobicContact CD1-CB 4.09Å; I362-L430 HydrophobicContact CD1-CD1 4.03Å; L426-L430 VanDerWaalsContact O-CB 3.3Å; L426-L430 WeakPolarHBondContact O-CB 3.44Å; L426-L430 PolarHBondContact O-N 3.26Å; L430-T433 PolarHBondContact O-N 2.99Å; L430-L434 HydrophobicContact CD1-CD1 3.84Å; L430-L434 HydrophobicContact CD1-CG 4.06Å; L430-L434 HydrophobicContact CG-CD1 3.95Å; L430-L434 HydrophobicContact CG-CG 4.48Å; L430-L434 WeakPolarHBondContact O-CB 3.3Å; L430-L434 VanDerWaalsContact O-CG 3.3Å; L430-L434 WeakPolarHBondContact O-CG 3.38Å; L430-L434 PolarHBondContact O-N 3.37Å
431	F	82.3	Confident	81.5	Confident	48 Å²	48	60.2 Å²	60.2	21%	0.211	30%	0.302	C	S	.	.	H	α-helix	trans	-62.1	-45.8	-179.6	-178.8	-107.4	0	0	0	112.9	F138 I270 L427 K428 H429 T433 L434 K435	F138-F431 HydrophobicContact CB-CE2 3.44Å; F138-F431 VanDerWaalsContact CB-CE2 3.44Å; F138-F431 HydrophobicContact CB-CZ 3.77Å; F138-F431 HydrophobicContact CD2-CD2 4Å; F138-F431 AromaticContact CD2-CE2 3.35Å; F138-F431 HydrophobicContact CD2-CE2 3.35Å; F138-F431 AromaticContact CD2-CZ 3.96Å; F138-F431 HydrophobicContact CD2-CZ 3.96Å; F138-F431 HydrophobicContact CE2-CE2 4.28Å; F138-F431 AromaticContact CG-CE2 3.63Å; F138-F431 HydrophobicContact CG-CE2 3.63Å; F138-F431 HydrophobicContact CG-CZ 4.29Å; I270-F431 HydrophobicContact CD1-CB 3.97Å; I270-F431 HydrophobicContact CD1-CD2 3.18Å; I270-F431 HydrophobicContact CD1-CE2 3.71Å; I270-F431 HydrophobicContact CD1-CG 3.72Å; I270-F431 HydrophobicContact CG1-CD2 3.76Å; I270-F431 HydrophobicContact CG1-CE2 3.74Å; I270-F431 HydrophobicContact CG1-CG 4.37Å; I270-F431 HydrophobicContact CG1-CZ 4.41Å; L427-F431 WeakPolarHBondContact O-CB 3.43Å; L427-F431 PolarHBondContact O-N 3.23Å; K428-F431 PolarHBondContact O-N 2.9Å; H429-F431 VanDerWaalsContact C-N 3.29Å; H429-F431 PolarHBondContact O-N 2.89Å; F431-T433 VanDerWaalsContact C-N 3.3Å; F431-T433 PolarHBondContact O-N 3.37Å; F431-L434 PolarHBondContact O-N 2.9Å; F431-K435 HydrophobicContact CE1-CD 4.17Å; F431-K435 HydrophobicContact CZ-CD 4.49Å; F431-K435 VanDerWaalsContact O-CB 3.26Å; F431-K435 WeakPolarHBondContact O-CB 3.4Å; F431-K435 PolarHBondContact O-N 2.65Å
432	M	83.1	Confident	83.1	Confident	98 Å²	98	53.4 Å²	53.4	48%	0.483	27%	0.266	S	S	.	.	H	α-helix	trans	-61.8	-40.8	178.1	-71.3	-58.9	-65.3	0	0	111.6	K428 H429 K435 N436	K428-M432 WeakPolarHBondContact O-CG 3.29Å; K428-M432 PolarHBondContact O-N 3.13Å; H429-M432 PolarHBondContact O-N 2.96Å; M432-K435 PolarHBondContact O-N 3.24Å; M432-N436 WeakPolarHBondContact O-CB 3.49Å; M432-N436 PolarHBondContact O-N 3.11Å; M432-N436 VanDerWaalsContact O-N 3.1Å
433	T	86.9	Confident	84	Confident	43 Å²	43	53.1 Å²	53.1	26%	0.264	26%	0.264	S	S	.	.	H	α-helix	trans	-61.2	-50.2	174.4	-58	0	0	0	0	111.1	L360 H429 L430 F431 K435 N436 S437	L360-T433 HydrophobicContact CD1-CG2 4.35Å; H429-T433 PolarHBondContact O-N 2.85Å; H429-T433 PolarHBondContact O-OG1 3.29Å; L430-T433 PolarHBondContact O-N 2.99Å; F431-T433 VanDerWaalsContact C-N 3.3Å; F431-T433 PolarHBondContact O-N 3.37Å; T433-K435 PolarHBondContact O-N 2.67Å; T433-N436 PolarHBondContact O-N 3.07Å; T433-S437 PolarHBondContact O-N 3.06Å; T433-S437 PolarHBondContact O-OG 3.34Å
434	L	88.3	Confident	84.6	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-64.7	-38.2	179.5	-68.4	176.5	0	0	0	112.4	R137 F138 L263 L356 L360 L430 F431 N436 S437 L442 L445	R137-L434 PolarHBondContact NH1-O 2.85Å; F138-L434 HydrophobicContact CE2-CB 3.99Å; F138-L434 HydrophobicContact CZ-CB 4.25Å; L263-L434 HydrophobicContact CD2-CD1 3.71Å; L356-L434 HydrophobicContact CD1-CD1 4.46Å; L360-L434 HydrophobicContact CD1-CD2 4.08Å; L360-L434 HydrophobicContact CD1-CG 4.45Å; L430-L434 HydrophobicContact CD1-CD1 3.84Å; L430-L434 HydrophobicContact CD1-CG 4.06Å; L430-L434 HydrophobicContact CG-CD1 3.95Å; L430-L434 HydrophobicContact CG-CG 4.48Å; L430-L434 WeakPolarHBondContact O-CB 3.3Å; L430-L434 VanDerWaalsContact O-CG 3.3Å; L430-L434 WeakPolarHBondContact O-CG 3.38Å; L430-L434 PolarHBondContact O-N 3.37Å; F431-L434 PolarHBondContact O-N 2.9Å; L434-N436 VanDerWaalsContact C-N 3.29Å; L434-N436 PolarHBondContact O-N 3.04Å; L434-S437 PolarHBondContact O-N 2.7Å; L434-L442 HydrophobicContact CB-CD2 4.49Å; L434-L442 HydrophobicContact CD2-CD2 3.69Å; L434-L445 HydrophobicContact CD2-CD2 3.55Å
435	K	86.2	Confident	85.3	Confident	65 Å²	65	49.5 Å²	49.5	28%	0.283	24%	0.242	S	C	.	.	H	α-helix	trans	-64.1	-35.2	177.4	-173.8	177.6	178.7	-179	0	111.8	L135 R137 F138 F431 M432 T433	L135-K435 WeakPolarHBondContact O-CE 3.34Å; R137-K435 PolarHBondContact NH1-O 3.11Å; R137-K435 VanDerWaalsContact NH1-O 3.09Å; F138-K435 HydrophobicContact CD2-CB 4.38Å; F138-K435 HydrophobicContact CE2-CB 4.48Å; F431-K435 HydrophobicContact CE1-CD 4.17Å; F431-K435 HydrophobicContact CZ-CD 4.49Å; F431-K435 VanDerWaalsContact O-CB 3.26Å; F431-K435 WeakPolarHBondContact O-CB 3.4Å; F431-K435 PolarHBondContact O-N 2.65Å; M432-K435 PolarHBondContact O-N 3.24Å; T433-K435 PolarHBondContact O-N 2.67Å
436	N	85.1	Confident	85.9	Confident	67 Å²	67	45.4 Å²	45.4	36%	0.358	22%	0.223	S	C	.	.	H	α-helix	trans	-93.1	-3.3	-177.8	-75	-18.5	0	0	0	114.4	R389 M432 T433 L434	R389-N436 PolarHBondContact NH1-O 3.49Å; M432-N436 WeakPolarHBondContact O-CB 3.49Å; M432-N436 PolarHBondContact O-N 3.11Å; M432-N436 VanDerWaalsContact O-N 3.1Å; T433-N436 PolarHBondContact O-N 3.07Å; L434-N436 VanDerWaalsContact C-N 3.29Å; L434-N436 PolarHBondContact O-N 3.04Å
437	S	87.4	Confident	86	Confident	15 Å²	15	48.3 Å²	48.3	11%	0.105	24%	0.236	C	C	.	.	S	Bend	trans	-74.8	152.4	-178	-68.5	0	0	0	0	112.6	P133 R137 T433 L434 F441	P133-S437 WeakPolarHBondContact CG-O 3.49Å; R137-S437 VanDerWaalsContact CZ-O 3.31Å; R137-S437 PolarHBondContact NH1-O 3.25Å; R137-S437 PolarHBondContact NH2-O 3.43Å; T433-S437 PolarHBondContact O-N 3.06Å; T433-S437 PolarHBondContact O-OG 3.34Å; L434-S437 PolarHBondContact O-N 2.7Å; S437-F441 WeakPolarHBondContact OG-CD1 3.28Å
438	T	88.7	Confident	86.2	Confident	55 Å²	55	53 Å²	53	34%	0.337	26%	0.256	S	S	.	.			trans	-70.2	159.3	171.8	60.1	0	0	0	0	111.3	M130 E440 F441 L442	M130-T438 HydrophobicContact CE-CG2 4.13Å; T438-E440 VanDerWaalsContact C-N 3.35Å; T438-E440 PolarHBondContact O-N 3.29Å; T438-F441 WeakPolarHBondContact O-CB 3.47Å; T438-F441 PolarHBondContact O-N 3.12Å; T438-F441 WeakPolarHBondContact OG1-CB 3.49Å; T438-F441 PolarHBondContact OG1-N 3.05Å; T438-L442 PolarHBondContact O-N 3.2Å; T438-L442 VanDerWaalsContact O-N 3.16Å
439	I	86.9	Confident	86.2	Confident	18 Å²	18	47.3 Å²	47.3	9%	0.092	23%	0.232	C	C	.	.	H	α-helix	trans	-58.3	-48.1	176.7	-65.9	171.1	0	0	0	110.9	K131 P164 E197 F441 L442 I443	K131-I439 HydrophobicContact CB-CD1 3.99Å; K131-I439 HydrophobicContact CD-CD1 4.09Å; P164-I439 HydrophobicContact CB-CG2 3.51Å; P164-I439 HydrophobicContact CG-CD1 4.49Å; P164-I439 HydrophobicContact CG-CG2 3.77Å; E197-I439 HydrophobicContact CB-CD1 4.22Å; E197-I439 HydrophobicContact CG-CD1 3.76Å; E197-I439 HydrophobicContact CG-CG1 3.84Å; E197-I439 WeakPolarHBondContact OE1-CG1 3.44Å; I439-F441 PolarHBondContact O-N 3.05Å; I439-L442 PolarHBondContact O-N 3.26Å; I439-I443 HydrophobicContact CG2-CD1 3.83Å; I439-I443 HydrophobicContact CG2-CG1 4.37Å; I439-I443 WeakPolarHBondContact O-CG1 3.12Å; I439-I443 PolarHBondContact O-N 3.32Å
440	E	87.1	Confident	85.5	Confident	138 Å²	138	48.2 Å²	48.2	65%	0.645	24%	0.241	S	C	*	.	H	α-helix	trans	-56.2	-40.2	179.1	-169.8	65.1	-168.6	0	0	112.1	T438 I443 N444	T438-E440 VanDerWaalsContact C-N 3.35Å; T438-E440 PolarHBondContact O-N 3.29Å; E440-I443 PolarHBondContact O-N 2.7Å; E440-N444 WeakPolarHBondContact O-CB 3.2Å; E440-N444 PolarHBondContact O-N 3.22Å
441	F	89.3	Confident	84.5	Confident	84 Å²	84	53 Å²	53	37%	0.368	26%	0.263	S	S	.	.	H	α-helix	trans	-65.7	-42.3	176.9	-179.2	-97.4	0	0	0	112.1	L360 S437 T438 I439 N444 L445	L360-F441 HydrophobicContact CD2-CE1 3.59Å; L360-F441 HydrophobicContact CD2-CZ 3.32Å; S437-F441 WeakPolarHBondContact OG-CD1 3.28Å; T438-F441 WeakPolarHBondContact O-CB 3.47Å; T438-F441 PolarHBondContact O-N 3.12Å; T438-F441 WeakPolarHBondContact OG1-CB 3.49Å; T438-F441 PolarHBondContact OG1-N 3.05Å; I439-F441 PolarHBondContact O-N 3.05Å; F441-N444 PolarHBondContact O-N 3.12Å; F441-L445 HydrophobicContact CE1-CD2 4.2Å; F441-L445 WeakPolarHBondContact O-CB 3.25Å; F441-L445 PolarHBondContact O-N 3.18Å
442	L	89.5	Confident	83.8	Confident	6 Å²	6	51.2 Å²	51.2	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-65.6	-39.7	177.9	-68.9	-179.6	0	0	0	112.1	L260 L434 T438 I439 L445 Q446	L260-L442 HydrophobicContact CD2-CD1 3.72Å; L434-L442 HydrophobicContact CB-CD2 4.49Å; L434-L442 HydrophobicContact CD2-CD2 3.69Å; T438-L442 PolarHBondContact O-N 3.2Å; T438-L442 VanDerWaalsContact O-N 3.16Å; I439-L442 PolarHBondContact O-N 3.26Å; L442-L445 PolarHBondContact O-N 3.46Å; L442-Q446 WeakPolarHBondContact O-CB 3.27Å; L442-Q446 PolarHBondContact O-N 3.26Å
443	I	88	Confident	83.1	Confident	18 Å²	18	47.1 Å²	47.1	9%	0.092	24%	0.237	C	C	.	.	H	α-helix	trans	-62.4	-51.1	175.8	-67.3	171.4	0	0	0	110.2	P164 P166 I439 E440 L445 Q446 E447	P164-I443 HydrophobicContact CB-CD1 4.13Å; P164-I443 HydrophobicContact CB-CG1 4.33Å; P166-I443 HydrophobicContact CB-CG2 4.45Å; P166-I443 HydrophobicContact CG-CG2 4.45Å; I439-I443 HydrophobicContact CG2-CD1 3.83Å; I439-I443 HydrophobicContact CG2-CG1 4.37Å; I439-I443 WeakPolarHBondContact O-CG1 3.12Å; I439-I443 PolarHBondContact O-N 3.32Å; E440-I443 PolarHBondContact O-N 2.7Å; I443-L445 VanDerWaalsContact C-N 3.3Å; I443-L445 PolarHBondContact O-N 3.19Å; I443-Q446 WeakPolarHBondContact O-CB 3.38Å; I443-Q446 PolarHBondContact O-N 3.47Å; I443-Q446 VanDerWaalsContact O-N 3.14Å; I443-E447 PolarHBondContact O-N 3.27Å
444	N	88.2	Confident	82.3	Confident	64 Å²	64	45.3 Å²	45.3	34%	0.342	23%	0.226	S	C	.	.	H	α-helix	trans	-61.4	-39.2	177.9	-173.6	-29.2	0	0	0	111.9	E440 F441 Q446 E447 K448	E440-N444 WeakPolarHBondContact O-CB 3.2Å; E440-N444 PolarHBondContact O-N 3.22Å; F441-N444 PolarHBondContact O-N 3.12Å; N444-Q446 VanDerWaalsContact C-N 3.35Å; N444-E447 PolarHBondContact O-N 2.96Å; N444-K448 WeakPolarHBondContact O-CG 3.45Å; N444-K448 PolarHBondContact O-N 2.99Å; N444-K448 VanDerWaalsContact O-N 3.16Å; N444-K448 WeakPolarHBondContact OD1-CE 3.35Å; N444-K448 PolarHBondContact OD1-NZ 3.16Å
445	L	88.7	Confident	81.5	Confident	6 Å²	6	46.2 Å²	46.2	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-63.2	-42.5	175.5	-174.5	65.1	0	0	0	111.4	L259 L356 Q359 L360 L434 F441 L442 I443 K448 L449	L259-L445 HydrophobicContact CD1-CD2 4.42Å; L356-L445 HydrophobicContact CD2-CD1 4.19Å; L356-L445 HydrophobicContact CD2-CD2 3.5Å; L356-L445 HydrophobicContact CD2-CG 3.7Å; Q359-L445 HydrophobicContact CB-CD1 3.63Å; Q359-L445 HydrophobicContact CG-CD1 4.28Å; L360-L445 HydrophobicContact CD1-CD2 4.4Å; L360-L445 HydrophobicContact CD2-CD1 4.31Å; L360-L445 HydrophobicContact CD2-CD2 4.26Å; L360-L445 HydrophobicContact CG-CD2 4.5Å; L434-L445 HydrophobicContact CD2-CD2 3.55Å; F441-L445 HydrophobicContact CE1-CD2 4.2Å; F441-L445 WeakPolarHBondContact O-CB 3.25Å; F441-L445 PolarHBondContact O-N 3.18Å; L442-L445 PolarHBondContact O-N 3.46Å; I443-L445 VanDerWaalsContact C-N 3.3Å; I443-L445 PolarHBondContact O-N 3.19Å; L445-K448 PolarHBondContact O-N 3.03Å; L445-L449 PolarHBondContact O-N 3.35Å
446	Q	88.2	Confident	81	Confident	10 Å²	10	44 Å²	44	5%	0.047	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-43.1	175.6	-178.3	171.5	-51.4	0	0	111.8	P166 L259 L442 I443 N444 K448 L449 L458	P166-Q446 HydrophobicContact CG-CG 4.17Å; P166-Q446 VanDerWaalsContact CG-NE2 3.3Å; L259-Q446 HydrophobicContact CD1-CB 3.98Å; L259-Q446 HydrophobicContact CG-CB 4.36Å; L442-Q446 WeakPolarHBondContact O-CB 3.27Å; L442-Q446 PolarHBondContact O-N 3.26Å; I443-Q446 WeakPolarHBondContact O-CB 3.38Å; I443-Q446 PolarHBondContact O-N 3.47Å; I443-Q446 VanDerWaalsContact O-N 3.14Å; N444-Q446 VanDerWaalsContact C-N 3.35Å; Q446-K448 PolarHBondContact O-N 3.47Å; Q446-L449 WeakPolarHBondContact O-CB 3.36Å; Q446-L449 PolarHBondContact O-N 3.35Å; Q446-L449 VanDerWaalsContact O-N 3.1Å; Q446-L458 HydrophobicContact CG-CD1 3.88Å
447	E	83.2	Confident	80.6	Confident	75 Å²	75	43 Å²	43	35%	0.35	21%	0.213	S	C	.	.	H	α-helix	trans	-61.5	-27.2	176.2	-72.9	-178.8	169.1	0	0	113.1	P166 S167 H169 I443 N444	P166-E447 HydrophobicContact CB-CG 3.74Å; P166-E447 HydrophobicContact CG-CG 4.08Å; S167-E447 PolarHBondContact N-OE1 2.88Å; H169-E447 IonicContact CE1-OE1 3.7Å; I443-E447 PolarHBondContact O-N 3.27Å; N444-E447 PolarHBondContact O-N 2.96Å
448	K	84.3	Confident	80.6	Confident	110 Å²	110	42.6 Å²	42.6	48%	0.478	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-14	176.8	-74.4	171.8	178.3	159.2	0	114.2	N444 L445 Q446 T450	N444-K448 WeakPolarHBondContact O-CG 3.45Å; N444-K448 PolarHBondContact O-N 2.99Å; N444-K448 VanDerWaalsContact O-N 3.16Å; N444-K448 WeakPolarHBondContact OD1-CE 3.35Å; N444-K448 PolarHBondContact OD1-NZ 3.16Å; L445-K448 PolarHBondContact O-N 3.03Å; Q446-K448 PolarHBondContact O-N 3.47Å; K448-T450 PolarHBondContact O-N 2.74Å
449	L	81.3	Confident	80.7	Confident	13 Å²	13	40 Å²	40	7%	0.068	19%	0.194	C	C	.	.	S	Bend	trans	-66.6	134	175.9	-66.2	176.4	0	0	0	109	L259 I352 E355 L356 L445 Q446 Q451 L458	L259-L449 HydrophobicContact CD1-CD1 4.43Å; L259-L449 HydrophobicContact CD2-CD1 4.09Å; L259-L449 HydrophobicContact CG-CD1 4.39Å; I352-L449 HydrophobicContact CG2-CD1 4.12Å; E355-L449 HydrophobicContact CB-CD2 4.11Å; E355-L449 HydrophobicContact CG-CD2 3.79Å; L356-L449 HydrophobicContact CD2-CD1 4.34Å; L356-L449 HydrophobicContact CD2-CD2 3.84Å; L356-L449 HydrophobicContact CD2-CG 4.49Å; L356-L449 HydrophobicContact CG-CD2 4.02Å; L445-L449 PolarHBondContact O-N 3.35Å; Q446-L449 WeakPolarHBondContact O-CB 3.36Å; Q446-L449 PolarHBondContact O-N 3.35Å; Q446-L449 VanDerWaalsContact O-N 3.1Å; L449-Q451 PolarHBondContact O-N 2.88Å; L449-L458 HydrophobicContact CD1-CD1 4.26Å
450	T	66	Low	80.9	Confident	75 Å²	75	39.2 Å²	39.2	46%	0.46	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-56.3	117.1	175.5	44	0	0	0	0	108.6	E355 K448 R457	E355-T450 VanDerWaalsContact CD-N 3.28Å; E355-T450 WeakPolarHBondContact OE1-CG2 3.39Å; E355-T450 PolarHBondContact OE1-N 2.89Å; E355-T450 PolarHBondContact OE1-OG1 3.02Å; E355-T450 PolarHBondContact OE2-N 3.37Å; E355-T450 VanDerWaalsContact OE2-N 3.15Å; E355-T450 PolarHBondContact OE2-OG1 3.43Å; K448-T450 PolarHBondContact O-N 2.74Å; T450-R457 WeakPolarHBondContact O-CD 3.2Å; T450-R457 PolarHBondContact O-NE 3.21Å; T450-R457 PolarHBondContact O-NH1 3.39Å; T450-R457 PolarHBondContact OG1-NH1 3.15Å; T450-R457 PolarHBondContact OG1-NH2 3.21Å
451	Q	65.9	Low	80.9	Confident	103 Å²	103	33.1 Å²	33.1	48%	0.481	16%	0.162	S	C	.	.	P	Polyproline II helix	trans	-82.8	135.8	178.9	-68.9	177.7	-25.4	0	0	109.4	L449	L449-Q451 PolarHBondContact O-N 2.88Å
452	S	68.5	Low	80.6	Confident	11 Å²	11	30.3 Å²	30.3	8%	0.077	15%	0.151	C	C	.	.	P	Polyproline II helix	trans	-83.2	147.2	159.4	158	0	0	0	0	107.6	L454 I455 E565	S452-L454 PolarHBondContact OG-N 2.88Å; S452-I455 VanDerWaalsContact CB-O 3.31Å; S452-I455 WeakPolarHBondContact CB-O 2.84Å; S452-I455 PolarHBondContact OG-N 2.75Å; S452-I455 PolarHBondContact OG-O 2.94Å; S452-E565 PolarHBondContact OG-OE2 3.5Å
453	F	66.9	Low	80.1	Confident	13 Å²	13	31.4 Å²	31.4	6%	0.057	16%	0.156	C	C	.	.	S	Bend	trans	-90.1	-12.5	-178.2	77.8	-76.2	0	0	0	112.9	L543 I550 L558 K561 L562 E565	F453-L543 WeakPolarHBondContact O-CD1 3.4Å; F453-I550 HydrophobicContact CB-CD1 4Å; F453-I550 HydrophobicContact CB-CG1 4.34Å; F453-I550 HydrophobicContact CD2-CD1 3.83Å; F453-I550 HydrophobicContact CD2-CG1 4.13Å; F453-I550 HydrophobicContact CG-CD1 4.41Å; F453-L558 HydrophobicContact CD2-CD1 4.31Å; F453-L558 HydrophobicContact CE2-CD1 3.61Å; F453-L558 HydrophobicContact CZ-CD1 4.32Å; F453-K561 HydrophobicContact CE1-CB 3.5Å; F453-K561 VanDerWaalsContact CE1-CB 3.5Å; F453-K561 HydrophobicContact CE1-CD 4.2Å; F453-K561 HydrophobicContact CE1-CG 4.42Å; F453-K561 HydrophobicContact CZ-CB 3.53Å; F453-L562 HydrophobicContact CZ-CB 4.39Å; F453-E565 VanDerWaalsContact CD1-OE1 3.25Å; F453-E565 WeakPolarHBondContact CD1-OE1 3.32Å; F453-E565 WeakPolarHBondContact CD1-OE2 3.44Å; F453-E565 HydrophobicContact CE1-CG 4.17Å; F453-E565 WeakPolarHBondContact CE1-OE1 3.36Å; F453-E565 WeakPolarHBondContact CE1-OE2 3.4Å
454	L	70.8	Confident	79.3	Confident	5 Å²	5	40.1 Å²	40.1	3%	0.026	19%	0.188	C	C	.	.	S	Bend	trans	-125.1	-27.2	179.6	-61.1	-179.5	0	0	0	114.7	W343 S452 L543 L562 L620 L624	W343-L454 WeakPolarHBondContact CB-O 3.38Å; S452-L454 PolarHBondContact OG-N 2.88Å; L454-L543 HydrophobicContact CD2-CD2 3.89Å; L454-L562 HydrophobicContact CD1-CB 3.72Å; L454-L562 HydrophobicContact CD1-CD1 3.74Å; L454-L562 HydrophobicContact CD1-CG 3.64Å; L454-L620 HydrophobicContact CD2-CD2 3.74Å; L454-L624 HydrophobicContact CD2-CD1 3.87Å
455	I	72.2	Confident	78.7	Confident	19 Å²	19	42.3 Å²	42.3	10%	0.097	20%	0.2	C	C	.	.	S	Bend	trans	-110.9	132.2	-174.5	-58.2	175.7	0	0	0	108.3	S452 R457 E565	S452-I455 VanDerWaalsContact CB-O 3.31Å; S452-I455 WeakPolarHBondContact CB-O 2.84Å; S452-I455 PolarHBondContact OG-N 2.75Å; S452-I455 PolarHBondContact OG-O 2.94Å; I455-R457 PolarHBondContact O-N 3.13Å; I455-E565 HydrophobicContact CD1-CB 4.06Å; I455-E565 VanDerWaalsContact CD1-O 3.26Å; I455-E565 WeakPolarHBondContact CD1-O 3.48Å
456	T	74.2	Confident	78.3	Confident	18 Å²	18	42.4 Å²	42.4	11%	0.11	20%	0.201	C	C	.	.			trans	-69	118	172.8	48.5	0	0	0	0	109.3	Y229 W343	Y229-T456 HydrophobicContact CD2-CG2 3.89Å; Y229-T456 HydrophobicContact CE2-CG2 4.47Å; W343-T456 HydrophobicContact CB-CG2 4.36Å; W343-T456 WeakPolarHBondContact O-CB 3.3Å; W343-T456 WeakPolarHBondContact O-CG2 3.35Å; W343-T456 PolarHBondContact O-OG1 3.06Å
457	R	78.4	Confident	77.7	Confident	47 Å²	47	42 Å²	42	18%	0.177	20%	0.199	C	C	.	.	S	Bend	trans	-77.3	-42.2	172.5	-74.7	-170.2	177.6	-153.4	13.2	110.6	S346 I352 E355 T450 I455	S346-R457 VanDerWaalsContact CB-O 3.27Å; S346-R457 WeakPolarHBondContact CB-O 3.29Å; S346-R457 PolarHBondContact OG-O 3.2Å; I352-R457 HydrophobicContact CD1-CB 3.74Å; I352-R457 WeakPolarHBondContact CD1-O 3.44Å; I352-R457 HydrophobicContact CG1-CB 4.28Å; E355-R457 IonicContact OE2-NH1 3.68Å; T450-R457 WeakPolarHBondContact O-CD 3.2Å; T450-R457 PolarHBondContact O-NE 3.21Å; T450-R457 PolarHBondContact O-NH1 3.39Å; T450-R457 PolarHBondContact OG1-NH1 3.15Å; T450-R457 PolarHBondContact OG1-NH2 3.21Å; I455-R457 PolarHBondContact O-N 3.13Å
458	L	86.8	Confident	76.7	Confident	7 Å²	7	40.5 Å²	40.5	4%	0.037	20%	0.195	C	C	.	.	S	Bend	trans	-100.9	108	172.4	-62.1	170.1	0	0	0	108	Y229 L259 F262 I352 Q446 L449	Y229-L458 VanDerWaalsContact CB-O 3.27Å; Y229-L458 WeakPolarHBondContact CB-O 3.5Å; L259-L458 HydrophobicContact CD2-CD1 4.32Å; L259-L458 HydrophobicContact CD2-CD2 3.88Å; L259-L458 HydrophobicContact CG-CD1 4.11Å; L259-L458 HydrophobicContact CG-CD2 4.48Å; F262-L458 HydrophobicContact CB-CB 4.45Å; I352-L458 HydrophobicContact CD1-CD2 4.19Å; I352-L458 HydrophobicContact CG2-CD2 4.37Å; Q446-L458 HydrophobicContact CG-CD1 3.88Å; L449-L458 HydrophobicContact CD1-CD1 4.26Å
459	G	89.9	Confident	75.3	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.01	18%	0.179	C	C	.	.	S	Bend	trans	-174.6	178	-177.2	0	0	0	0	0	111	F262 V461	F262-G459 WeakPolarHBondContact CD1-O 3Å; G459-V461 PolarHBondContact O-N 3Å
460	P	91.4	Very high	74.3	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.			trans	-52.2	132.9	179	-27.8	34.4	0	0	0	113	Y229 F262 N273 L276 L311 L314 S344 T345 S346	Y229-P460 HydrophobicContact CE1-CG 4.46Å; Y229-P460 HydrophobicContact CE2-CG 4.09Å; F262-P460 HydrophobicContact CD1-CG 4.48Å; F262-P460 VanDerWaalsContact CE1-CD 3.5Å; F262-P460 HydrophobicContact CE1-CG 3.85Å; N273-P460 VanDerWaalsContact OD1-CA 3.29Å; N273-P460 WeakPolarHBondContact OD1-CA 3.21Å; L276-P460 HydrophobicContact CD1-CB 4.42Å; L311-P460 HydrophobicContact CD1-CG 4.03Å; L314-P460 HydrophobicContact CD1-CB 3.66Å; L314-P460 HydrophobicContact CD1-CG 3.75Å; S344-P460 WeakPolarHBondContact O-CD 3.39Å; T345-P460 CarbonylContact C-O 3.56Å; T345-P460 WeakPolarHBondContact CA-O 3.49Å; T345-P460 VanDerWaalsContact CB-O 3.32Å; T345-P460 WeakPolarHBondContact CB-O 3.31Å; S346-P460 PolarHBondContact N-O 3.1Å
461	V	88.2	Confident	73.4	Confident	11 Å²	11	40 Å²	40	7%	0.067	19%	0.19	C	C	.	.			trans	-102.9	125.8	175.2	-176.7	0	0	0	0	108.5	F264 N273 T349 G459 L463	F264-V461 HydrophobicContact CB-CG2 3.9Å; F264-V461 HydrophobicContact CD1-CG1 4.03Å; F264-V461 HydrophobicContact CD1-CG2 4.38Å; F264-V461 HydrophobicContact CE1-CG1 4.21Å; F264-V461 HydrophobicContact CG-CB 4.43Å; F264-V461 HydrophobicContact CG-CG1 4.28Å; F264-V461 HydrophobicContact CG-CG2 4.14Å; N273-V461 PolarHBondContact ND2-O 3.13Å; N273-V461 PolarHBondContact OD1-N 3.32Å; T349-V461 HydrophobicContact CG2-CG1 4.24Å; T349-V461 HydrophobicContact CG2-CG2 3.59Å; G459-V461 PolarHBondContact O-N 3Å; V461-L463 HydrophobicContact CB-CD2 4.48Å; V461-L463 HydrophobicContact CG1-CD2 3.76Å; V461-L463 HydrophobicContact CG1-CG 4.37Å; V461-L463 PolarHBondContact O-N 3.25Å; V461-L463 VanDerWaalsContact O-N 3.12Å
462	I	81.8	Confident	72	Confident	25 Å²	25	40.1 Å²	40.1	13%	0.128	19%	0.193	C	C	.	.			trans	-76.9	101	177.9	-57.4	-57.7	0	0	0	109.6	L314 T345 F467 Y470 L471	L314-I462 HydrophobicContact CD2-CD1 3.88Å; T345-I462 HydrophobicContact CG2-CD1 3.57Å; T345-I462 HydrophobicContact CG2-CG1 3.65Å; I462-F467 HydrophobicContact CD1-CD1 4.25Å; I462-F467 HydrophobicContact CD1-CD2 3.94Å; I462-F467 HydrophobicContact CD1-CE1 4.28Å; I462-F467 HydrophobicContact CD1-CE2 3.99Å; I462-F467 HydrophobicContact CD1-CG 4.07Å; I462-F467 HydrophobicContact CD1-CZ 4.17Å; I462-F467 HydrophobicContact CG2-CB 3.89Å; I462-F467 HydrophobicContact CG2-CD2 4.35Å; I462-F467 HydrophobicContact CG2-CG 4.31Å; I462-Y470 HydrophobicContact CB-CD1 4.36Å; I462-Y470 HydrophobicContact CD1-CD1 3.98Å; I462-Y470 HydrophobicContact CD1-CD2 4.39Å; I462-Y470 HydrophobicContact CD1-CE1 4.02Å; I462-Y470 HydrophobicContact CD1-CE2 4.42Å; I462-Y470 HydrophobicContact CD1-CG 4.16Å; I462-Y470 HydrophobicContact CG1-CD1 3.83Å; I462-Y470 HydrophobicContact CG1-CE1 3.79Å; I462-Y470 HydrophobicContact CG1-CG 4.48Å; I462-Y470 HydrophobicContact CG2-CD1 3.68Å; I462-Y470 HydrophobicContact CG2-CE1 4.46Å; I462-Y470 HydrophobicContact CG2-CG 4.13Å; I462-L471 HydrophobicContact CG2-CD1 3.96Å; I462-L471 HydrophobicContact CG2-CD2 3.85Å; I462-L471 HydrophobicContact CG2-CG 3.69Å
463	L	78.7	Confident	70.3	Confident	28 Å²	28	43.3 Å²	43.3	15%	0.147	21%	0.209	C	C	.	.			trans	-99.5	136.3	176.2	-53.7	175.9	0	0	0	110.5	F264 S271 V461 N465 L466 F467	F264-L463 HydrophobicContact CD2-CD1 4.41Å; F264-L463 HydrophobicContact CD2-CD2 4.25Å; F264-L463 HydrophobicContact CE1-CD2 4.09Å; F264-L463 HydrophobicContact CE2-CD1 3.87Å; F264-L463 HydrophobicContact CE2-CD2 3.44Å; F264-L463 VanDerWaalsContact CE2-CD2 3.44Å; F264-L463 HydrophobicContact CE2-CG 4.27Å; F264-L463 HydrophobicContact CZ-CD2 3.33Å; S271-L463 WeakPolarHBondContact O-CD1 3.42Å; V461-L463 HydrophobicContact CB-CD2 4.48Å; V461-L463 HydrophobicContact CG1-CD2 3.76Å; V461-L463 HydrophobicContact CG1-CG 4.37Å; V461-L463 PolarHBondContact O-N 3.25Å; V461-L463 VanDerWaalsContact O-N 3.12Å; L463-N465 WeakPolarHBondContact CB-OD1 3.35Å; L463-N465 PolarHBondContact O-N 3.49Å; L463-N465 VanDerWaalsContact O-N 3.14Å; L463-L466 HydrophobicContact CB-CB 4.34Å; L463-L466 PolarHBondContact O-N 3.44Å; L463-F467 PolarHBondContact O-N 2.86Å
464	R	71.9	Confident	68.5	Low	202 Å²	202	51.4 Å²	51.4	76%	0.762	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-31.3	-178.8	-172.3	177.7	-179.4	-173.7	0.2	113.5	P468	R464-P468 VanDerWaalsContact O-CA 3.3Å; R464-P468 WeakPolarHBondContact O-CA 3.46Å
465	N	76.1	Confident	66.5	Low	109 Å²	109	53.2 Å²	53.2	58%	0.583	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-38.5	177.8	61.5	-19.8	0	0	0	112.6	K319 L463	K319-N465 WeakPolarHBondContact CD-O 3.47Å; K319-N465 WeakPolarHBondContact CE-O 3.37Å; L463-N465 WeakPolarHBondContact CB-OD1 3.35Å; L463-N465 PolarHBondContact O-N 3.49Å; L463-N465 VanDerWaalsContact O-N 3.14Å
466	L	79.5	Confident	64.3	Low	9 Å²	9	55.1 Å²	55.1	5%	0.047	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-36.2	-177.2	-178.6	56.7	0	0	0	112.4	N273 L276 S318 K319 M320 L463 P468	N273-L466 HydrophobicContact CB-CD2 4.44Å; L276-L466 HydrophobicContact CD1-CD2 4.29Å; S318-L466 CarbonylContact C-O 3.49Å; S318-L466 WeakPolarHBondContact CA-O 3.41Å; K319-L466 PolarHBondContact N-O 3.44Å; M320-L466 HydrophobicContact CB-CD1 4.37Å; M320-L466 HydrophobicContact CG-CD1 3.42Å; M320-L466 VanDerWaalsContact CG-CD1 3.42Å; M320-L466 HydrophobicContact SD-CD1 3.37Å; M320-L466 WeakPolarHBondContact SD-CD1 3.27Å; M320-L466 HydrophobicContact SD-CD2 4.06Å; M320-L466 HydrophobicContact SD-CG 4.36Å; L463-L466 HydrophobicContact CB-CB 4.34Å; L463-L466 PolarHBondContact O-N 3.44Å; L466-P468 WeakPolarHBondContact O-CD 3.37Å
467	F	76.7	Confident	62.2	Low	1 Å²	1	58.8 Å²	58.8	0%	0.004	28%	0.282	C	S	.	.			trans	-126	67.1	-177.5	-60.9	-86.2	0	0	0	110.4	L276 L314 I462 L463 N469	L276-F467 HydrophobicContact CD1-CE2 4.29Å; L276-F467 HydrophobicContact CD1-CZ 3.84Å; L314-F467 HydrophobicContact CB-CE1 4.01Å; L314-F467 HydrophobicContact CB-CZ 4.14Å; L314-F467 HydrophobicContact CD2-CE1 4.07Å; L314-F467 HydrophobicContact CD2-CZ 4.45Å; L314-F467 VanDerWaalsContact O-CE1 3.24Å; L314-F467 WeakPolarHBondContact O-CE1 3.31Å; I462-F467 HydrophobicContact CD1-CD1 4.25Å; I462-F467 HydrophobicContact CD1-CD2 3.94Å; I462-F467 HydrophobicContact CD1-CE1 4.28Å; I462-F467 HydrophobicContact CD1-CE2 3.99Å; I462-F467 HydrophobicContact CD1-CG 4.07Å; I462-F467 HydrophobicContact CD1-CZ 4.17Å; I462-F467 HydrophobicContact CG2-CB 3.89Å; I462-F467 HydrophobicContact CG2-CD2 4.35Å; I462-F467 HydrophobicContact CG2-CG 4.31Å; L463-F467 PolarHBondContact O-N 2.86Å; F467-N469 PolarHBondContact O-N 3.49Å; F467-N469 VanDerWaalsContact O-N 3.09Å
468	P	61.1	Low	59.8	Low	43 Å²	43	61.4 Å²	61.4	28%	0.279	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.9	-177.1	28.4	-39.2	0	0	0	112.7	K319 R464 L466	K319-P468 HydrophobicContact CD-CG 4.43Å; K319-P468 VanDerWaalsContact CE-CG 3.41Å; K319-P468 HydrophobicContact CG-CG 4.18Å; R464-P468 VanDerWaalsContact O-CA 3.3Å; R464-P468 WeakPolarHBondContact O-CA 3.46Å; L466-P468 WeakPolarHBondContact O-CD 3.37Å
469	N	55.9	Low	57	Low	28 Å²	28	67.5 Å²	67.5	15%	0.15	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-11.2	-167	-60.9	-20.9	0	0	0	114.6	F467 L471 S520 I521	F467-N469 PolarHBondContact O-N 3.49Å; F467-N469 VanDerWaalsContact O-N 3.09Å; N469-L471 VanDerWaalsContact C-N 3.27Å; N469-L471 PolarHBondContact O-N 3.25Å; N469-S520 VanDerWaalsContact ND2-C 3.33Å; N469-S520 PolarHBondContact ND2-O 3.27Å; N469-S520 PolarHBondContact ND2-OG 2.87Å; N469-S520 PolarHBondContact OD1-OG 3.45Å; N469-I521 HydrophobicContact CB-CD1 3.87Å; N469-I521 HydrophobicContact CB-CG1 3.44Å; N469-I521 VanDerWaalsContact CB-CG1 3.44Å; N469-I521 WeakPolarHBondContact ND2-CG1 3.42Å; N469-I521 PolarHBondContact ND2-N 3.45Å
470	Y	59.8	Low	54	Low	63 Å²	63	70.1 Å²	70.1	25%	0.247	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-25.8	-179	-167.9	-84.5	0	0	0	111.5	L314 L317 G339 F340 I462	L314-Y470 HydrophobicContact CD2-CD2 4.35Å; L314-Y470 HydrophobicContact CD2-CE2 3.84Å; L317-Y470 HydrophobicContact CD1-CD2 4.15Å; L317-Y470 HydrophobicContact CD1-CE2 4.4Å; G339-Y470 PolarHBondContact O-OH 2.85Å; F340-Y470 AromaticContact CD1-CE2 3.84Å; F340-Y470 HydrophobicContact CD1-CE2 3.84Å; F340-Y470 HydrophobicContact CE1-CD2 4.22Å; F340-Y470 AromaticContact CE1-CE2 3.71Å; F340-Y470 HydrophobicContact CE1-CE2 3.71Å; I462-Y470 HydrophobicContact CB-CD1 4.36Å; I462-Y470 HydrophobicContact CD1-CD1 3.98Å; I462-Y470 HydrophobicContact CD1-CD2 4.39Å; I462-Y470 HydrophobicContact CD1-CE1 4.02Å; I462-Y470 HydrophobicContact CD1-CE2 4.42Å; I462-Y470 HydrophobicContact CD1-CG 4.16Å; I462-Y470 HydrophobicContact CG1-CD1 3.83Å; I462-Y470 HydrophobicContact CG1-CE1 3.79Å; I462-Y470 HydrophobicContact CG1-CG 4.48Å; I462-Y470 HydrophobicContact CG2-CD1 3.68Å; I462-Y470 HydrophobicContact CG2-CE1 4.46Å; I462-Y470 HydrophobicContact CG2-CG 4.13Å
471	L	46.3	Very low	51.2	Low	97 Å²	97	77 Å²	77	51%	0.508	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	37.4	-172.7	-64.7	173.3	0	0	0	113.7	I462 N469 D473	I462-L471 HydrophobicContact CG2-CD1 3.96Å; I462-L471 HydrophobicContact CG2-CD2 3.85Å; I462-L471 HydrophobicContact CG2-CG 3.69Å; N469-L471 VanDerWaalsContact C-N 3.27Å; N469-L471 PolarHBondContact O-N 3.25Å; L471-D473 PolarHBondContact O-N 3.36Å
472	I	37.4	Very low	48.4	Very low	106 Å²	106	84.6 Å²	84.6	54%	0.544	40%	0.397	S	S	.	.			trans	-62.5	88.7	172.8	-59.8	173.8	0	0	0	108.8	R474 I477 I521	I472-R474 PolarHBondContact O-N 3.11Å; I472-R474 VanDerWaalsContact O-N 3.1Å; I472-I477 HydrophobicContact CG2-CD1 4.29Å; I472-I521 HydrophobicContact CD1-CD1 3.95Å
473	D	32.7	Very low	45.9	Very low	78 Å²	78	89.5 Å²	89.5	42%	0.417	42%	0.424	S	S	.	.			trans	-70.3	103.8	172.4	-172.6	1.8	0	0	0	106.9	L471 N475 S476	L471-D473 PolarHBondContact O-N 3.36Å; D473-N475 PolarHBondContact O-N 3.47Å; D473-N475 VanDerWaalsContact OD1-CB 3.27Å; D473-N475 WeakPolarHBondContact OD1-CB 3.39Å; D473-N475 VanDerWaalsContact OD1-CG 3.29Å; D473-N475 PolarHBondContact OD1-N 3.38Å; D473-N475 PolarHBondContact OD1-ND2 2.97Å; D473-S476 PolarHBondContact O-N 3.12Å; D473-S476 VanDerWaalsContact O-N 3.09Å; D473-S476 PolarHBondContact O-OG 2.93Å
474	R	28.4	Very low	43.8	Very low	182 Å²	182	96 Å²	96	69%	0.687	45%	0.453	S	S	*	.	H	α-helix	trans	-56.6	-10.7	174.8	-71.8	-170.1	-171.2	-171.2	4	112.9	I472 I477 K478	I472-R474 PolarHBondContact O-N 3.11Å; I472-R474 VanDerWaalsContact O-N 3.1Å; R474-I477 PolarHBondContact O-N 3.41Å; R474-K478 PolarHBondContact O-N 3.45Å
475	N	28.6	Very low	41.8	Very low	44 Å²	44	88.3 Å²	88.3	24%	0.235	44%	0.436	C	S	.	.	H	α-helix	trans	-73.5	-28.2	175.8	-61.7	-45.8	0	0	0	113.4	D473 I477 K478 Q479 R851	D473-N475 PolarHBondContact O-N 3.47Å; D473-N475 VanDerWaalsContact OD1-CB 3.27Å; D473-N475 WeakPolarHBondContact OD1-CB 3.39Å; D473-N475 VanDerWaalsContact OD1-CG 3.29Å; D473-N475 PolarHBondContact OD1-N 3.38Å; D473-N475 PolarHBondContact OD1-ND2 2.97Å; N475-I477 VanDerWaalsContact C-N 3.3Å; N475-I477 PolarHBondContact O-N 3.07Å; N475-K478 PolarHBondContact O-N 2.88Å; N475-Q479 PolarHBondContact O-N 3.24Å; N475-R851 PolarHBondContact ND2-NH1 3.26Å
476	S	26.8	Very low	39.5	Very low	58 Å²	58	87.5 Å²	87.5	41%	0.406	43%	0.426	S	S	.	.	H	α-helix	trans	-72.9	-25.9	172.9	58.1	0	0	0	0	112.4	D473 K478	D473-S476 PolarHBondContact O-N 3.12Å; D473-S476 VanDerWaalsContact O-N 3.09Å; D473-S476 PolarHBondContact O-OG 2.93Å; S476-K478 VanDerWaalsContact C-N 3.32Å
477	I	30.7	Very low	37.2	Very low	96 Å²	96	94.6 Å²	94.6	49%	0.492	46%	0.458	S	S	.	.	H	α-helix	trans	-69.7	-30.9	171	-59.3	176.5	0	0	0	111.1	I472 R474 N475	I472-I477 HydrophobicContact CG2-CD1 4.29Å; R474-I477 PolarHBondContact O-N 3.41Å; N475-I477 VanDerWaalsContact C-N 3.3Å; N475-I477 PolarHBondContact O-N 3.07Å
478	K	27.9	Very low	35.1	Very low	102 Å²	102	103 Å²	103	44%	0.443	50%	0.495	S	S	.	.	H	α-helix	trans	-82.4	-32.7	177.9	-76.6	179.6	177.2	172.2	0	113.8	R474 N475 S476 I480 Q481 Y482	R474-K478 PolarHBondContact O-N 3.45Å; N475-K478 PolarHBondContact O-N 2.88Å; S476-K478 VanDerWaalsContact C-N 3.32Å; K478-I480 VanDerWaalsContact C-N 3.3Å; K478-I480 PolarHBondContact O-N 2.86Å; K478-Q481 PolarHBondContact O-N 2.84Å; K478-Y482 PolarHBondContact O-N 2.02Å; K478-Y482 VanDerWaalsContact O-N 3.09Å
479	Q	27.2	Very low	33.6	Very low	134 Å²	134	105.9 Å²	105.9	63%	0.626	51%	0.514	S	S	*	.	H	α-helix	trans	-65.4	-33.4	177.8	-104.6	175.8	-28.6	0	0	112.3	N475 Y482 D483	N475-Q479 PolarHBondContact O-N 3.24Å; Q479-Y482 PolarHBondContact O-N 3.18Å; Q479-D483 WeakPolarHBondContact O-CB 3.32Å; Q479-D483 PolarHBondContact O-N 2.86Å
480	I	27.9	Very low	32.6	Very low	56 Å²	56	110.1 Å²	110.1	29%	0.287	54%	0.542	S	S	.	.	H	α-helix	trans	-76.9	-31.1	178.9	-63.5	167.5	0	0	0	112.1	K478 Y482 Q484	K478-I480 VanDerWaalsContact C-N 3.3Å; K478-I480 PolarHBondContact O-N 2.86Å; I480-Y482 VanDerWaalsContact C-N 3.29Å; I480-Q484 HydrophobicContact CG2-CG 4.27Å; I480-Q484 VanDerWaalsContact O-CB 3.25Å; I480-Q484 WeakPolarHBondContact O-CB 3.32Å; I480-Q484 VanDerWaalsContact O-CG 3.27Å; I480-Q484 WeakPolarHBondContact O-CG 3.18Å; I480-Q484 PolarHBondContact O-N 3.41Å
481	Q	32	Very low	31.1	Very low	144 Å²	144	115.4 Å²	115.4	67%	0.673	57%	0.574	S	S	*	*	H	α-helix	trans	-70.7	-25.7	169.8	-80.6	-175.8	-38.6	0	0	112.7	K478 G485	K478-Q481 PolarHBondContact O-N 2.84Å; Q481-G485 PolarHBondContact O-N 3.2Å
482	Y	28.7	Very low	30.4	Very low	172 Å²	172	116.5 Å²	116.5	68%	0.675	59%	0.587	S	S	*	*	H	α-helix	trans	-78.3	-42.3	172.6	-114.6	-92.7	0	0	0	112	K478 Q479 I480 Q484 G485 Y486	K478-Y482 PolarHBondContact O-N 2.02Å; K478-Y482 VanDerWaalsContact O-N 3.09Å; Q479-Y482 PolarHBondContact O-N 3.18Å; I480-Y482 VanDerWaalsContact C-N 3.29Å; Y482-Q484 VanDerWaalsContact C-N 3.32Å; Y482-Q484 PolarHBondContact O-N 3.46Å; Y482-G485 PolarHBondContact O-N 3.16Å; Y482-Y486 PolarHBondContact O-N 2.94Å
483	D	30.7	Very low	30.1	Very low	128 Å²	128	120.4 Å²	120.4	68%	0.684	60%	0.603	S	S	*	*	H	α-helix	trans	-73.9	-19.7	178.7	-74.1	-15.8	0	0	0	113.6	Q479	Q479-D483 WeakPolarHBondContact O-CB 3.32Å; Q479-D483 PolarHBondContact O-N 2.86Å
484	Q	33.6	Very low	29.9	Very low	165 Å²	165	125.5 Å²	125.5	77%	0.771	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	-7.8	172.4	-70.5	-172.2	-13.5	0	0	113.8	I480 Y482	I480-Q484 HydrophobicContact CG2-CG 4.27Å; I480-Q484 VanDerWaalsContact O-CB 3.25Å; I480-Q484 WeakPolarHBondContact O-CB 3.32Å; I480-Q484 VanDerWaalsContact O-CG 3.27Å; I480-Q484 WeakPolarHBondContact O-CG 3.18Å; I480-Q484 PolarHBondContact O-N 3.41Å; Y482-Q484 VanDerWaalsContact C-N 3.32Å; Y482-Q484 PolarHBondContact O-N 3.46Å
485	G	29.9	Very low	30	Very low	39 Å²	39	125.5 Å²	125.5	40%	0.402	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.1	-32.2	-172.2	0	0	0	0	0	115.7	Q481 Y482	Q481-G485 PolarHBondContact O-N 3.2Å; Y482-G485 PolarHBondContact O-N 3.16Å
486	Y	27.1	Very low	30.1	Very low	92 Å²	92	126.9 Å²	126.9	36%	0.361	64%	0.637	S	S	.	*	S	Bend	trans	-151.6	71.8	-166.8	-80.1	-98.8	0	0	0	112.2	Y482 N934	Y482-Y486 PolarHBondContact O-N 2.94Å; Y486-N934 HydrophobicContact CD1-CB 3.51Å; Y486-N934 HydrophobicContact CE1-CB 3.67Å; Y486-N934 WeakPolarHBondContact CE1-O 2.92Å; Y486-N934 HydrophobicContact CG-CB 4.4Å; Y486-N934 VanDerWaalsContact CZ-O 3.28Å; Y486-N934 PolarHBondContact OH-O 2.9Å
487	H	32.9	Very low	30.3	Very low	159 Å²	159	128.3 Å²	128.3	74%	0.736	65%	0.645	S	S	*	*			trans	-164.3	103.2	145.9	-86.9	-56.3	0	0	0	107.7	P489	H487-P489 VanDerWaalsContact O-CD 3.24Å; H487-P489 WeakPolarHBondContact O-CD 3.37Å
488	K	30.6	Very low	30.3	Very low	177 Å²	177	128.2 Å²	128.2	77%	0.77	64%	0.643	S	S	*	*			trans	-70.2	110.9	158	-122.9	177.5	-178.9	177.6	0	104.1
489	P	31.2	Very low	30.4	Very low	104 Å²	104	131.1 Å²	131.1	68%	0.675	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-64.5	136.7	170.9	-2.7	19.2	0	0	0	106.7	H487 L491	H487-P489 VanDerWaalsContact O-CD 3.24Å; H487-P489 WeakPolarHBondContact O-CD 3.37Å; P489-L491 PolarHBondContact O-N 2.78Å
490	P	34.8	Very low	30.5	Very low	116 Å²	116	133.3 Å²	133.3	75%	0.753	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-59.2	133.4	174.6	26.5	-32.5	0	0	0	108.3	P492	P490-P492 WeakPolarHBondContact O-CD 3.47Å; P490-P492 VanDerWaalsContact O-N 3.15Å
491	L	28.6	Very low	30.4	Very low	175 Å²	175	138.8 Å²	138.8	92%	0.916	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-53.2	116.7	178.4	-86.7	104.6	0	0	0	110.3	P489	P489-L491 PolarHBondContact O-N 2.78Å
492	P	31.6	Very low	30.3	Very low	119 Å²	119	135.6 Å²	135.6	77%	0.773	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-88.7	129.5	161.5	-0.2	22.5	0	0	0	108	P490 Q494	P490-P492 WeakPolarHBondContact O-CD 3.47Å; P490-P492 VanDerWaalsContact O-N 3.15Å; P492-Q494 PolarHBondContact O-N 3.36Å
493	Q	29.5	Very low	30.4	Very low	189 Å²	189	133.2 Å²	133.2	88%	0.883	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-53.9	132.2	172.6	-69.2	167.1	-18.7	0	0	110.7	Q495	Q493-Q495 PolarHBondContact O-N 2.83Å
494	Q	29	Very low	30.3	Very low	184 Å²	184	132.2 Å²	132.2	86%	0.86	66%	0.657	S	S	*	*	S	Bend	trans	28.5	88.1	155.4	-65.7	179.4	-16.4	0	0	117.2	P492	P492-Q494 PolarHBondContact O-N 3.36Å
495	Q	31.3	Very low	30.1	Very low	183 Å²	183	128.3 Å²	128.3	86%	0.855	64%	0.64	S	S	*	*			trans	-169.6	107.1	144.8	-102.9	158.2	30.3	0	0	112.6	Q493	Q493-Q495 PolarHBondContact O-N 2.83Å
496	Q	31.2	Very low	30.1	Very low	72 Å²	72	128.2 Å²	128.2	34%	0.336	64%	0.64	S	S	.	*			trans	71.7	104.6	148.8	-69	169	33.8	0	0	123.2	Q498 M971 H972	Q496-Q498 VanDerWaalsContact C-N 3.31Å; Q496-Q498 PolarHBondContact O-N 2.93Å; Q496-Q498 VanDerWaalsContact O-N 3.16Å; Q496-M971 VanDerWaalsContact CD-C 3.46Å; Q496-H972 VanDerWaalsContact CD-CA 3.44Å; Q496-H972 VanDerWaalsContact NE2-CA 3.28Å; Q496-H972 PolarHBondContact NE2-O 3.25Å; Q496-H972 VanDerWaalsContact OE1-CA 3.26Å
497	P	29.5	Very low	30.3	Very low	88 Å²	88	130.2 Å²	130.2	57%	0.571	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-4.7	177.8	-19.7	31.6	0	0	0	118.1	W500	P497-W500 PolarHBondContact O-N 3.12Å
498	Q	30.6	Very low	30.1	Very low	95 Å²	95	125.4 Å²	125.4	44%	0.444	63%	0.634	S	S	.	*	H	α-helix	trans	-78.9	-25.4	-169.2	-77.6	-178.1	-50.4	0	0	114.9	Q496 M971	Q496-Q498 VanDerWaalsContact C-N 3.31Å; Q496-Q498 PolarHBondContact O-N 2.93Å; Q496-Q498 VanDerWaalsContact O-N 3.16Å; Q498-M971 PolarHBondContact NE2-SD 3.34Å
499	Q	31.3	Very low	30	Very low	162 Å²	162	121.1 Å²	121.1	76%	0.757	62%	0.62	S	S	*	*	H	α-helix	trans	-75.3	-25.7	173	-80.8	-176	-18.6	0	0	112.9	S502 Q503	Q499-S502 PolarHBondContact O-OG 2.9Å; Q499-S502 VanDerWaalsContact O-OG 3.05Å; Q499-Q503 PolarHBondContact O-N 3.2Å
500	W	28.6	Very low	30.2	Very low	180 Å²	180	120.5 Å²	120.5	68%	0.682	61%	0.608	S	S	*	*	H	α-helix	trans	-72.2	-35.6	177.9	-139.5	59.1	0	0	0	111.4	P497 Q503 F504	P497-W500 PolarHBondContact O-N 3.12Å; W500-Q503 PolarHBondContact O-N 3.39Å; W500-F504 HydrophobicContact CD2-CD2 4.5Å; W500-F504 HydrophobicContact CE3-CD2 4.22Å; W500-F504 HydrophobicContact CE3-CE2 4.43Å; W500-F504 AromaticContact CH2-CE2 3.96Å; W500-F504 HydrophobicContact CH2-CE2 3.96Å; W500-F504 HydrophobicContact CZ2-CE2 4.38Å; W500-F504 HydrophobicContact CZ3-CD2 4.22Å; W500-F504 AromaticContact CZ3-CE2 3.98Å; W500-F504 HydrophobicContact CZ3-CE2 3.98Å; W500-F504 WeakPolarHBondContact O-CB 3.46Å; W500-F504 PolarHBondContact O-N 3.02Å
501	Y	26.4	Very low	30	Very low	171 Å²	171	120.3 Å²	120.3	67%	0.671	60%	0.6	S	S	*	*	H	α-helix	trans	-67.5	-38.2	179.7	-147.7	-98.4	0	0	0	112.7	F504 I505	Y501-F504 PolarHBondContact O-N 2.94Å; Y501-I505 HydrophobicContact CD1-CD1 3.58Å; Y501-I505 HydrophobicContact CD1-CG1 4.22Å; Y501-I505 HydrophobicContact CE1-CD1 3.67Å; Y501-I505 HydrophobicContact CE1-CG1 4.3Å; Y501-I505 WeakPolarHBondContact O-CG1 3.23Å; Y501-I505 PolarHBondContact O-N 3.42Å
502	S	29.3	Very low	30	Very low	77 Å²	77	116.1 Å²	116.1	54%	0.538	58%	0.579	S	S	.	*	H	α-helix	trans	-70.5	-35	175.3	57.7	0	0	0	0	112.6	Q499 G506	Q499-S502 PolarHBondContact O-OG 2.9Å; Q499-S502 VanDerWaalsContact O-OG 3.05Å; S502-G506 PolarHBondContact O-N 3.41Å
503	Q	31.7	Very low	30.1	Very low	123 Å²	123	114.6 Å²	114.6	58%	0.575	56%	0.564	S	S	*	*	H	α-helix	trans	-68.4	-35.2	171.5	-74.6	-177.2	-11.2	0	0	112.6	Q499 W500 G506 K507	Q499-Q503 PolarHBondContact O-N 3.2Å; W500-Q503 PolarHBondContact O-N 3.39Å; Q503-G506 PolarHBondContact O-N 3.32Å; Q503-K507 WeakPolarHBondContact O-CG 3.3Å; Q503-K507 PolarHBondContact O-N 3.27Å
504	F	28.9	Very low	30.6	Very low	107 Å²	107	109.9 Å²	109.9	47%	0.469	54%	0.538	S	S	.	.	H	α-helix	trans	-73.7	-38.8	177.2	-123.6	-86.2	0	0	0	112.9	W500 Y501 G506 K507 S508	W500-F504 HydrophobicContact CD2-CD2 4.5Å; W500-F504 HydrophobicContact CE3-CD2 4.22Å; W500-F504 HydrophobicContact CE3-CE2 4.43Å; W500-F504 AromaticContact CH2-CE2 3.96Å; W500-F504 HydrophobicContact CH2-CE2 3.96Å; W500-F504 HydrophobicContact CZ2-CE2 4.38Å; W500-F504 HydrophobicContact CZ3-CD2 4.22Å; W500-F504 AromaticContact CZ3-CE2 3.98Å; W500-F504 HydrophobicContact CZ3-CE2 3.98Å; W500-F504 WeakPolarHBondContact O-CB 3.46Å; W500-F504 PolarHBondContact O-N 3.02Å; Y501-F504 PolarHBondContact O-N 2.94Å; F504-G506 VanDerWaalsContact C-N 3.3Å; F504-K507 PolarHBondContact O-N 3.04Å; F504-S508 PolarHBondContact O-N 2.92Å
505	I	29.1	Very low	30.9	Very low	82 Å²	82	104.4 Å²	104.4	42%	0.421	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-36.8	170.4	-68.2	172.7	0	0	0	110.5	Y501 K507 S508 N509	Y501-I505 HydrophobicContact CD1-CD1 3.58Å; Y501-I505 HydrophobicContact CD1-CG1 4.22Å; Y501-I505 HydrophobicContact CE1-CD1 3.67Å; Y501-I505 HydrophobicContact CE1-CG1 4.3Å; Y501-I505 WeakPolarHBondContact O-CG1 3.23Å; Y501-I505 PolarHBondContact O-N 3.42Å; I505-K507 VanDerWaalsContact C-N 3.33Å; I505-K507 PolarHBondContact O-N 3.04Å; I505-S508 PolarHBondContact O-N 2.58Å; I505-S508 PolarHBondContact O-OG 2.97Å; I505-N509 WeakPolarHBondContact O-CB 3.38Å; I505-N509 PolarHBondContact O-N 3.33Å
506	G	29.9	Very low	30.9	Very low	38 Å²	38	100.7 Å²	100.7	39%	0.392	50%	0.5	S	S	.	.	H	α-helix	trans	-57.5	-44.6	170.1	0	0	0	0	0	112.3	S502 Q503 F504 E510	S502-G506 PolarHBondContact O-N 3.41Å; Q503-G506 PolarHBondContact O-N 3.32Å; F504-G506 VanDerWaalsContact C-N 3.3Å; G506-E510 WeakPolarHBondContact O-CB 3.43Å; G506-E510 PolarHBondContact O-N 3.45Å
507	K	30.8	Very low	31.2	Very low	134 Å²	134	102.2 Å²	102.2	58%	0.583	51%	0.507	S	S	*	.	H	α-helix	trans	-71.4	-33.6	177.8	-78.1	178.3	176.3	179.5	0	114	Q503 F504 I505 E510 L511	Q503-K507 WeakPolarHBondContact O-CG 3.3Å; Q503-K507 PolarHBondContact O-N 3.27Å; F504-K507 PolarHBondContact O-N 3.04Å; I505-K507 VanDerWaalsContact C-N 3.33Å; I505-K507 PolarHBondContact O-N 3.04Å; K507-E510 WeakPolarHBondContact O-CB 3.43Å; K507-E510 PolarHBondContact O-N 2.98Å; K507-L511 PolarHBondContact O-N 2.82Å
508	S	27.4	Very low	31.7	Very low	57 Å²	57	102.1 Å²	102.1	40%	0.399	50%	0.504	S	S	.	.	H	α-helix	trans	-72.7	-37	174.8	81.5	0	0	0	0	111.8	F504 I505 E510 L511 N512	F504-S508 PolarHBondContact O-N 2.92Å; I505-S508 PolarHBondContact O-N 2.58Å; I505-S508 PolarHBondContact O-OG 2.97Å; S508-E510 VanDerWaalsContact C-N 3.3Å; S508-L511 PolarHBondContact O-N 3.07Å; S508-N512 WeakPolarHBondContact O-CB 3.47Å; S508-N512 PolarHBondContact O-N 2.98Å
509	N	29.8	Very low	32.1	Very low	87 Å²	87	99.7 Å²	99.7	47%	0.465	49%	0.494	S	S	.	.	H	α-helix	trans	-64.2	-36.8	168.8	-80.9	-18.5	0	0	0	111.3	I505 N512 N513	I505-N509 WeakPolarHBondContact O-CB 3.38Å; I505-N509 PolarHBondContact O-N 3.33Å; N509-N512 PolarHBondContact O-N 3.07Å; N509-N513 WeakPolarHBondContact O-CB 3.32Å; N509-N513 PolarHBondContact O-N 3.39Å; N509-N513 PolarHBondContact O-ND2 2.96Å; N509-N513 VanDerWaalsContact O-ND2 3.17Å
510	E	34.1	Very low	32.7	Very low	91 Å²	91	93.2 Å²	93.2	43%	0.425	47%	0.467	S	S	.	.	H	α-helix	trans	-63.4	-42.4	173.4	-126.1	-174.4	150.1	0	0	112.1	G506 K507 S508 R514	G506-E510 WeakPolarHBondContact O-CB 3.43Å; G506-E510 PolarHBondContact O-N 3.45Å; K507-E510 WeakPolarHBondContact O-CB 3.43Å; K507-E510 PolarHBondContact O-N 2.98Å; S508-E510 VanDerWaalsContact C-N 3.3Å; E510-R514 VanDerWaalsContact O-CB 3.27Å; E510-R514 WeakPolarHBondContact O-CB 3.02Å; E510-R514 WeakPolarHBondContact O-CD 3.35Å; E510-R514 WeakPolarHBondContact O-CG 3.38Å; E510-R514 PolarHBondContact O-N 3.46Å; E510-R514 IonicContact OE1-CZ 3.61Å; E510-R514 IonicContact OE1-NE 3.94Å; E510-R514 IonicContact OE1-NH2 2.73Å; E510-R514 PolarHBondContact OE1-NH2 3.11Å; E510-R514 IonicContact OE2-NH2 3.92Å
511	L	31.1	Very low	33.8	Very low	112 Å²	112	86.4 Å²	86.4	59%	0.586	44%	0.443	S	S	*	.	H	α-helix	trans	-67.8	-42.2	177.1	-156	86.3	0	0	0	112.1	K507 S508 R514 I515	K507-L511 PolarHBondContact O-N 2.82Å; S508-L511 PolarHBondContact O-N 3.07Å; L511-R514 PolarHBondContact O-N 3.22Å; L511-I515 WeakPolarHBondContact O-CG1 3.44Å; L511-I515 PolarHBondContact O-N 2.87Å
512	N	29.8	Very low	35	Very low	88 Å²	88	79.6 Å²	79.6	47%	0.471	42%	0.418	S	S	.	.	H	α-helix	trans	-64.8	-42.2	174.7	-81.1	-21	0	0	0	111.7	S508 N509 R514 I515 L516	S508-N512 WeakPolarHBondContact O-CB 3.47Å; S508-N512 PolarHBondContact O-N 2.98Å; N509-N512 PolarHBondContact O-N 3.07Å; N512-R514 VanDerWaalsContact C-N 3.29Å; N512-R514 PolarHBondContact O-N 3.43Å; N512-I515 PolarHBondContact O-N 2.95Å; N512-L516 WeakPolarHBondContact O-CB 3.45Å; N512-L516 WeakPolarHBondContact O-CD1 3.04Å; N512-L516 WeakPolarHBondContact O-CG 3.5Å; N512-L516 PolarHBondContact O-N 3.38Å
513	N	34	Very low	36.3	Very low	87 Å²	87	79.4 Å²	79.4	47%	0.465	41%	0.414	S	S	.	.	H	α-helix	trans	-63.1	-36.7	173.2	-72.5	-20.8	0	0	0	111.1	N509 L516 E517	N509-N513 WeakPolarHBondContact O-CB 3.32Å; N509-N513 PolarHBondContact O-N 3.39Å; N509-N513 PolarHBondContact O-ND2 2.96Å; N509-N513 VanDerWaalsContact O-ND2 3.17Å; N513-L516 CarbonylContact O-C 3.54Å; N513-L516 WeakPolarHBondContact O-CB 3.24Å; N513-L516 PolarHBondContact O-N 2.92Å; N513-E517 WeakPolarHBondContact O-CB 3.32Å; N513-E517 WeakPolarHBondContact O-CG 3.29Å; N513-E517 PolarHBondContact O-N 3.1Å
514	R	39.3	Very low	38.3	Very low	89 Å²	89	73.9 Å²	73.9	34%	0.336	39%	0.388	S	S	.	.	H	α-helix	trans	-70.5	-37.2	176.7	-73.9	160.6	-171.6	-129.9	8.1	113	E510 L511 N512 E517 T518	E510-R514 VanDerWaalsContact O-CB 3.27Å; E510-R514 WeakPolarHBondContact O-CB 3.02Å; E510-R514 WeakPolarHBondContact O-CD 3.35Å; E510-R514 WeakPolarHBondContact O-CG 3.38Å; E510-R514 PolarHBondContact O-N 3.46Å; E510-R514 IonicContact OE1-CZ 3.61Å; E510-R514 IonicContact OE1-NE 3.94Å; E510-R514 IonicContact OE1-NH2 2.73Å; E510-R514 PolarHBondContact OE1-NH2 3.11Å; E510-R514 IonicContact OE2-NH2 3.92Å; L511-R514 PolarHBondContact O-N 3.22Å; N512-R514 VanDerWaalsContact C-N 3.29Å; N512-R514 PolarHBondContact O-N 3.43Å; R514-E517 PolarHBondContact O-N 3.1Å; R514-T518 PolarHBondContact O-N 3.47Å; R514-T518 PolarHBondContact O-OG1 3.22Å
515	I	35.6	Very low	41	Very low	69 Å²	69	69.3 Å²	69.3	35%	0.354	37%	0.369	S	S	.	.	H	α-helix	trans	-62.5	-46.3	170.9	-69.4	167.3	0	0	0	109.6	L511 N512 E517 T518 L519	L511-I515 WeakPolarHBondContact O-CG1 3.44Å; L511-I515 PolarHBondContact O-N 2.87Å; N512-I515 PolarHBondContact O-N 2.95Å; I515-E517 VanDerWaalsContact C-N 3.31Å; I515-E517 PolarHBondContact O-N 2.97Å; I515-T518 WeakPolarHBondContact CA-OG1 3.34Å; I515-T518 PolarHBondContact O-N 3.45Å; I515-T518 PolarHBondContact O-OG1 3.1Å; I515-L519 HydrophobicContact CG2-CD1 3.86Å; I515-L519 WeakPolarHBondContact O-CB 3.46Å; I515-L519 WeakPolarHBondContact O-CD1 3.38Å; I515-L519 VanDerWaalsContact O-CG 3.25Å; I515-L519 WeakPolarHBondContact O-CG 3.37Å; I515-L519 PolarHBondContact O-N 2.89Å
516	L	31.1	Very low	43.8	Very low	106 Å²	106	65.4 Å²	65.4	56%	0.555	35%	0.349	S	S	*	.	H	α-helix	trans	-61.4	-34.6	173.8	-75.9	161.5	0	0	0	112.9	N512 N513 L519 S520	N512-L516 WeakPolarHBondContact O-CB 3.45Å; N512-L516 WeakPolarHBondContact O-CD1 3.04Å; N512-L516 WeakPolarHBondContact O-CG 3.5Å; N512-L516 PolarHBondContact O-N 3.38Å; N513-L516 CarbonylContact O-C 3.54Å; N513-L516 WeakPolarHBondContact O-CB 3.24Å; N513-L516 PolarHBondContact O-N 2.92Å; L516-L519 HydrophobicContact CD2-CD1 4.44Å; L516-L519 WeakPolarHBondContact O-CB 3.4Å; L516-L519 PolarHBondContact O-N 3.45Å; L516-S520 WeakPolarHBondContact O-CB 3.24Å; L516-S520 PolarHBondContact O-N 3.16Å
517	E	36.2	Very low	46.4	Very low	104 Å²	104	64.7 Å²	64.7	49%	0.486	34%	0.336	S	S	.	.	H	α-helix	trans	-71.9	-41.4	176.6	-78.4	169.9	-179.8	0	0	111.8	N513 R514 I515 S520	N513-E517 WeakPolarHBondContact O-CB 3.32Å; N513-E517 WeakPolarHBondContact O-CG 3.29Å; N513-E517 PolarHBondContact O-N 3.1Å; R514-E517 PolarHBondContact O-N 3.1Å; I515-E517 VanDerWaalsContact C-N 3.31Å; I515-E517 PolarHBondContact O-N 2.97Å; E517-S520 WeakPolarHBondContact O-CB 3.35Å; E517-S520 PolarHBondContact O-N 3.5Å; E517-S520 VanDerWaalsContact O-N 3.08Å; E517-S520 PolarHBondContact O-OG 2.93Å
518	T	39.8	Very low	48.9	Very low	85 Å²	85	61.2 Å²	61.2	52%	0.521	32%	0.323	S	S	.	.	H	α-helix	trans	-60.4	-46.2	168.9	20	0	0	0	0	111.6	R514 I515 S520 I521 E522	R514-T518 PolarHBondContact O-N 3.47Å; R514-T518 PolarHBondContact O-OG1 3.22Å; I515-T518 WeakPolarHBondContact CA-OG1 3.34Å; I515-T518 PolarHBondContact O-N 3.45Å; I515-T518 PolarHBondContact O-OG1 3.1Å; T518-S520 PolarHBondContact O-N 2.99Å; T518-S520 VanDerWaalsContact O-N 3.1Å; T518-I521 PolarHBondContact O-N 2.91Å; T518-E522 WeakPolarHBondContact O-CG 3.4Å
519	L	39.9	Very low	52	Low	44 Å²	44	58.5 Å²	58.5	23%	0.23	30%	0.304	C	S	.	.	H	α-helix	trans	-57.6	-23.4	173.5	-72.6	161.5	0	0	0	112.5	I515 L516 E522 T523	I515-L519 HydrophobicContact CG2-CD1 3.86Å; I515-L519 WeakPolarHBondContact O-CB 3.46Å; I515-L519 WeakPolarHBondContact O-CD1 3.38Å; I515-L519 VanDerWaalsContact O-CG 3.25Å; I515-L519 WeakPolarHBondContact O-CG 3.37Å; I515-L519 PolarHBondContact O-N 2.89Å; L516-L519 HydrophobicContact CD2-CD1 4.44Å; L516-L519 WeakPolarHBondContact O-CB 3.4Å; L516-L519 PolarHBondContact O-N 3.45Å; L519-E522 WeakPolarHBondContact CD2-OE2 3.43Å; L519-E522 WeakPolarHBondContact O-CB 3.37Å; L519-E522 PolarHBondContact O-N 3.15Å; L519-T523 WeakPolarHBondContact O-CG2 3.36Å; L519-T523 PolarHBondContact O-N 3.24Å; L519-T523 VanDerWaalsContact O-N 3.1Å; L519-T523 PolarHBondContact O-OG1 2.03Å; L519-T523 VanDerWaalsContact O-OG1 3.13Å
520	S	43.7	Very low	55.1	Low	26 Å²	26	55.2 Å²	55.2	18%	0.182	29%	0.287	C	S	.	.	H	α-helix	trans	-78.9	-22.7	-178.4	79.8	0	0	0	0	114.5	N469 L516 E517 T518 T523	N469-S520 VanDerWaalsContact ND2-C 3.33Å; N469-S520 PolarHBondContact ND2-O 3.27Å; N469-S520 PolarHBondContact ND2-OG 2.87Å; N469-S520 PolarHBondContact OD1-OG 3.45Å; L516-S520 WeakPolarHBondContact O-CB 3.24Å; L516-S520 PolarHBondContact O-N 3.16Å; E517-S520 WeakPolarHBondContact O-CB 3.35Å; E517-S520 PolarHBondContact O-N 3.5Å; E517-S520 VanDerWaalsContact O-N 3.08Å; E517-S520 PolarHBondContact O-OG 2.93Å; T518-S520 PolarHBondContact O-N 2.99Å; T518-S520 VanDerWaalsContact O-N 3.1Å; S520-T523 WeakPolarHBondContact CA-OG1 3.4Å; S520-T523 PolarHBondContact O-OG1 2.95Å
521	I	51.2	Low	58	Low	37 Å²	37	50.9 Å²	50.9	19%	0.19	27%	0.266	C	S	.	.	H	α-helix	trans	-72.1	-40.7	165.4	-65.3	177	0	0	0	109.4	N469 I472 T518 T523 S524 M527 M635	N469-I521 HydrophobicContact CB-CD1 3.87Å; N469-I521 HydrophobicContact CB-CG1 3.44Å; N469-I521 VanDerWaalsContact CB-CG1 3.44Å; N469-I521 WeakPolarHBondContact ND2-CG1 3.42Å; N469-I521 PolarHBondContact ND2-N 3.45Å; I472-I521 HydrophobicContact CD1-CD1 3.95Å; T518-I521 PolarHBondContact O-N 2.91Å; I521-T523 PolarHBondContact O-N 3.12Å; I521-S524 VanDerWaalsContact O-CB 3.3Å; I521-S524 WeakPolarHBondContact O-CB 3.4Å; I521-S524 PolarHBondContact O-N 3.05Å; I521-S524 PolarHBondContact O-OG 3.21Å; I521-M527 HydrophobicContact CG2-CG 4.47Å; I521-M635 HydrophobicContact CG2-CE 4.01Å
522	E	52.2	Low	61.2	Low	28 Å²	28	45.9 Å²	45.9	13%	0.131	24%	0.241	C	C	.	.	H	α-helix	trans	-60.6	-31.3	-179.1	-47.8	-170.3	153.6	0	0	110.6	T518 L519 F639 S642 Y680	T518-E522 WeakPolarHBondContact O-CG 3.4Å; L519-E522 WeakPolarHBondContact CD2-OE2 3.43Å; L519-E522 WeakPolarHBondContact O-CB 3.37Å; L519-E522 PolarHBondContact O-N 3.15Å; E522-F639 HydrophobicContact CB-CE2 3.9Å; E522-F639 HydrophobicContact CB-CZ 4.19Å; E522-F639 VanDerWaalsContact CD-CZ 3.49Å; E522-F639 HydrophobicContact CG-CE2 3.59Å; E522-F639 HydrophobicContact CG-CZ 3.89Å; E522-F639 WeakPolarHBondContact OE1-CZ 3.33Å; E522-S642 PolarHBondContact OE1-OG 3.28Å; E522-Y680 HydrophobicContact CB-CE1 4.28Å; E522-Y680 WeakPolarHBondContact O-CE1 3.37Å; E522-Y680 PolarHBondContact O-OH 2.85Å
523	T	56.2	Low	64.3	Low	74 Å²	74	41.7 Å²	41.7	45%	0.454	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	3.6	176.8	52.7	0	0	0	0	115.4	L519 S520 I521	L519-T523 WeakPolarHBondContact O-CG2 3.36Å; L519-T523 PolarHBondContact O-N 3.24Å; L519-T523 VanDerWaalsContact O-N 3.1Å; L519-T523 PolarHBondContact O-OG1 2.03Å; L519-T523 VanDerWaalsContact O-OG1 3.13Å; S520-T523 WeakPolarHBondContact CA-OG1 3.4Å; S520-T523 PolarHBondContact O-OG1 2.95Å; I521-T523 PolarHBondContact O-N 3.12Å
524	S	73.1	Confident	67.2	Low	6 Å²	6	37.6 Å²	37.6	4%	0.042	20%	0.196	C	C	.	.	S	Bend	trans	-63.3	155.2	176	66.1	0	0	0	0	111.5	I521 F526 M527 N528	I521-S524 VanDerWaalsContact O-CB 3.3Å; I521-S524 WeakPolarHBondContact O-CB 3.4Å; I521-S524 PolarHBondContact O-N 3.05Å; I521-S524 PolarHBondContact O-OG 3.21Å; S524-F526 PolarHBondContact O-N 2.86Å; S524-M527 PolarHBondContact O-N 3.46Å; S524-M527 PolarHBondContact OG-N 3.36Å; S524-N528 PolarHBondContact O-N 3.01Å; S524-N528 PolarHBondContact O-ND2 2.85Å; S524-N528 VanDerWaalsContact O-ND2 3.16Å
525	L	86.4	Confident	69.8	Low	12 Å²	12	33.7 Å²	33.7	6%	0.063	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-38.7	175	177.5	66.4	0	0	0	110	F315 S316 S321 I329 M527 N528 T529	F315-L525 HydrophobicContact CE1-CD2 4.24Å; S316-L525 PolarHBondContact O-N 3.44Å; S321-L525 WeakPolarHBondContact OG-CB 3.3Å; I329-L525 HydrophobicContact CB-CD1 4.01Å; I329-L525 HydrophobicContact CB-CD2 4.21Å; I329-L525 HydrophobicContact CD1-CD2 3.67Å; I329-L525 HydrophobicContact CG2-CD1 4.26Å; I329-L525 HydrophobicContact CG2-CD2 4.09Å; L525-M527 PolarHBondContact O-N 3.01Å; L525-N528 CarbonylContact O-C 3.59Å; L525-N528 PolarHBondContact O-N 2.94Å; L525-T529 HydrophobicContact CD1-CG2 3.52Å; L525-T529 HydrophobicContact CG-CG2 3.87Å; L525-T529 WeakPolarHBondContact O-CG2 3.42Å; L525-T529 PolarHBondContact O-N 3.24Å; L525-T529 VanDerWaalsContact O-N 3.15Å; L525-T529 PolarHBondContact O-OG1 2.93Å
526	F	87.8	Confident	72.4	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-50.5	-50.3	178.8	-178.3	-113.1	0	0	0	113.2	H313 S316 L317 S524 N528 T529 L531 T632 M635 H636	H313-F526 AromaticContact CD2-CD2 3.83Å; H313-F526 AromaticContact CD2-CE2 3.76Å; H313-F526 AromaticContact NE2-CD2 3.95Å; H313-F526 AromaticContact NE2-CE2 3.56Å; H313-F526 AromaticContact NE2-CZ 3.76Å; S316-F526 PolarHBondContact O-N 3.12Å; S316-F526 VanDerWaalsContact O-N 3.16Å; L317-F526 HydrophobicContact CD2-CB 3.8Å; L317-F526 HydrophobicContact CD2-CD1 3.9Å; L317-F526 HydrophobicContact CD2-CG 3.91Å; S524-F526 PolarHBondContact O-N 2.86Å; F526-N528 VanDerWaalsContact C-N 3.27Å; F526-N528 PolarHBondContact O-N 3.29Å; F526-T529 PolarHBondContact O-OG1 3.46Å; F526-L531 HydrophobicContact CE2-CD1 4.47Å; F526-L531 HydrophobicContact CE2-CD2 3.95Å; F526-L531 HydrophobicContact CZ-CD2 4.13Å; F526-T632 HydrophobicContact CE2-CG2 4.18Å; F526-T632 HydrophobicContact CZ-CG2 3.92Å; F526-M635 HydrophobicContact CE1-CG 4.21Å; F526-H636 HydrophobicContact CE1-CB 3.88Å; F526-H636 AromaticContact CE1-CD2 3.84Å; F526-H636 AromaticContact CE2-CD2 3.94Å; F526-H636 HydrophobicContact CZ-CB 3.66Å; F526-H636 AromaticContact CZ-CD2 3.76Å; F526-H636 PolarHBondContact O-CD2 2.91Å; F526-H636 VanDerWaalsContact O-CD2 3.25Å; F526-H636 PolarHBondContact O-NE2 3.07Å
527	M	83.9	Confident	75	Confident	23 Å²	23	27.9 Å²	27.9	11%	0.113	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-75.7	-16.6	-179.1	-61.1	-56.9	-75.1	0	0	113.4	I521 S524 L525 F639	I521-M527 HydrophobicContact CG2-CG 4.47Å; S524-M527 PolarHBondContact O-N 3.46Å; S524-M527 PolarHBondContact OG-N 3.36Å; L525-M527 PolarHBondContact O-N 3.01Å; M527-F639 HydrophobicContact CE-CB 4.33Å; M527-F639 HydrophobicContact CE-CD2 3.72Å; M527-F639 HydrophobicContact CE-CG 4.49Å
528	N	85.2	Confident	77.4	Confident	60 Å²	60	23 Å²	23	32%	0.321	13%	0.127	S	C	.	.	G	3₁₀ helix	trans	-101.8	7.7	-176.2	-72.5	-34.6	0	0	0	113.6	S524 L525 F526 K685	S524-N528 PolarHBondContact O-N 3.01Å; S524-N528 PolarHBondContact O-ND2 2.85Å; S524-N528 VanDerWaalsContact O-ND2 3.16Å; L525-N528 CarbonylContact O-C 3.59Å; L525-N528 PolarHBondContact O-N 2.94Å; F526-N528 VanDerWaalsContact C-N 3.27Å; F526-N528 PolarHBondContact O-N 3.29Å; N528-K685 VanDerWaalsContact O-CE 3.26Å; N528-K685 WeakPolarHBondContact O-CE 3.27Å
529	T	91.3	Very high	79.7	Confident	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.102	C	C	.	.	S	Bend	trans	-120.2	148.1	176	52.2	0	0	0	0	112.3	I329 K330 I332 L525 F526 H636 K685	I329-T529 HydrophobicContact CG2-CG2 4Å; K330-T529 CarbonylContact O-C 3.57Å; K330-T529 WeakPolarHBondContact O-CA 3.16Å; I332-T529 HydrophobicContact CD1-CG2 4.37Å; I332-T529 WeakPolarHBondContact CD1-OG1 3.07Å; I332-T529 HydrophobicContact CG1-CG2 4.32Å; L525-T529 HydrophobicContact CD1-CG2 3.52Å; L525-T529 HydrophobicContact CG-CG2 3.87Å; L525-T529 WeakPolarHBondContact O-CG2 3.42Å; L525-T529 PolarHBondContact O-N 3.24Å; L525-T529 VanDerWaalsContact O-N 3.15Å; L525-T529 PolarHBondContact O-OG1 2.93Å; F526-T529 PolarHBondContact O-OG1 3.46Å; T529-H636 PolarHBondContact O-CE1 3.21Å; T529-H636 PolarHBondContact O-NE2 2.8Å; T529-K685 WeakPolarHBondContact O-CB 3.46Å
530	D	94.9	Very high	82	Confident	18 Å²	18	16.8 Å²	16.8	10%	0.096	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	135.9	168.3	-59.9	-60.6	0	0	0	109.9	K330 R331 I332 K685 S686 F761	K330-D530 PolarHBondContact O-N 3.01Å; R331-D530 CarbonylContact C-O 3.37Å; R331-D530 VanDerWaalsContact CA-O 3.28Å; R331-D530 WeakPolarHBondContact CA-O 3.3Å; R331-D530 HydrophobicContact CG-CB 4.3Å; I332-D530 PolarHBondContact N-O 3.36Å; D530-K685 WeakPolarHBondContact OD1-CD 3.28Å; D530-S686 WeakPolarHBondContact CA-O 3.35Å; D530-S686 PolarHBondContact OD1-N 3.31Å; D530-S686 PolarHBondContact OD1-OG 2.94Å; D530-F761 HydrophobicContact CB-CE2 4.11Å; D530-F761 HydrophobicContact CB-CZ 4.01Å
531	L	95.9	Very high	83.7	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.5	-173.6	179.1	65.4	0	0	0	111.3	I332 L334 F526 H636 S686 T687 Y688	I332-L531 HydrophobicContact CB-CD1 4.23Å; I332-L531 HydrophobicContact CG2-CD1 4.09Å; I332-L531 WeakPolarHBondContact O-CA 3.39Å; L334-L531 HydrophobicContact CD1-CD1 3.99Å; L334-L531 HydrophobicContact CG-CD1 4.03Å; F526-L531 HydrophobicContact CE2-CD1 4.47Å; F526-L531 HydrophobicContact CE2-CD2 3.95Å; F526-L531 HydrophobicContact CZ-CD2 4.13Å; L531-H636 VanDerWaalsContact CB-CE1 3.47Å; L531-H636 WeakPolarHBondContact CB-CE1 3.43Å; L531-H636 HydrophobicContact CD2-CB 3.61Å; L531-H636 VanDerWaalsContact CD2-CG 3.5Å; L531-S686 PolarHBondContact N-O 3.44Å; L531-T687 HydrophobicContact CB-CG2 4.47Å; L531-T687 HydrophobicContact CD2-CG2 4.24Å; L531-T687 CarbonylContact O-C 3.38Å; L531-T687 VanDerWaalsContact O-CA 3.31Å; L531-T687 WeakPolarHBondContact O-CA 3.34Å; L531-Y688 PolarHBondContact O-N 3.3Å
532	L	97.1	Very high	84.8	Confident	8 Å²	8	14.8 Å²	14.8	4%	0.042	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.6	162.8	-169.2	156.5	0	0	0	108.7	I332 I333 L334 Y688 F761 W783	I332-L532 PolarHBondContact O-N 3.4Å; I333-L532 CarbonylContact C-O 3.5Å; I333-L532 VanDerWaalsContact CA-O 3.25Å; I333-L532 WeakPolarHBondContact CA-O 3.45Å; I333-L532 HydrophobicContact CG1-CB 4.16Å; I333-L532 HydrophobicContact CG2-CB 4.36Å; I333-L532 HydrophobicContact CG2-CD2 3.82Å; L334-L532 PolarHBondContact N-O 3.39Å; L532-Y688 CarbonylContact C-O 3.45Å; L532-Y688 WeakPolarHBondContact CA-O 3.29Å; L532-F761 HydrophobicContact CB-CD1 4.26Å; L532-F761 HydrophobicContact CB-CE1 3.82Å; L532-F761 HydrophobicContact CB-CE2 4.18Å; L532-F761 HydrophobicContact CB-CZ 3.77Å; L532-F761 HydrophobicContact CD1-CB 4.41Å; L532-F761 HydrophobicContact CD1-CD1 4.2Å; L532-F761 HydrophobicContact CD1-CD2 4.3Å; L532-F761 HydrophobicContact CD1-CG 4.04Å; L532-W783 HydrophobicContact CD1-CH2 3.64Å; L532-W783 HydrophobicContact CD1-CZ2 4.44Å; L532-W783 HydrophobicContact CD1-CZ3 4.1Å; L532-W783 HydrophobicContact CD2-CH2 4.25Å; L532-W783 HydrophobicContact CG-CH2 3.94Å; L532-W783 HydrophobicContact CG-CZ2 4.39Å
533	I	95.6	Very high	86	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	129.7	177.1	-169.9	162.9	0	0	0	110.7	L334 I629 T632 L633 Y688 A689 L690	L334-I533 HydrophobicContact CB-CB 4.47Å; L334-I533 HydrophobicContact CB-CD1 4.31Å; L334-I533 HydrophobicContact CB-CG1 4.05Å; L334-I533 HydrophobicContact CD1-CD1 4.42Å; L334-I533 CarbonylContact O-C 3.45Å; L334-I533 VanDerWaalsContact O-CA 3.29Å; L334-I533 WeakPolarHBondContact O-CA 2.92Å; L334-I533 WeakPolarHBondContact O-CG1 3.43Å; I533-I629 HydrophobicContact CD1-CB 4.27Å; I533-I629 HydrophobicContact CD1-CG1 4.15Å; I533-I629 HydrophobicContact CD1-CG2 3.78Å; I533-I629 HydrophobicContact CG1-CG2 3.98Å; I533-T632 HydrophobicContact CD1-CG2 3.94Å; I533-L633 HydrophobicContact CG2-CD1 4.04Å; I533-L633 HydrophobicContact CG2-CD2 3.23Å; I533-L633 HydrophobicContact CG2-CG 3.55Å; I533-Y688 PolarHBondContact N-O 2.92Å; I533-A689 CarbonylContact O-C 3.5Å; I533-A689 WeakPolarHBondContact O-CA 3.42Å; I533-L690 PolarHBondContact O-N 3.48Å
534	G	94	Very high	87	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	144.4	-176.2	0	0	0	0	0	112.2	L334 N336 L690	L334-G534 PolarHBondContact O-N 3.44Å; N336-G534 PolarHBondContact N-O 3.48Å; G534-L690 CarbonylContact C-O 3.56Å; G534-L690 VanDerWaalsContact CA-O 3.26Å; G534-L690 WeakPolarHBondContact CA-O 3.26Å
535	W	94	Very high	87	Confident	7 Å²	7	12.5 Å²	12.5	3%	0.027	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	157.7	170.3	71.9	101.1	0	0	0	113.5	N336 I629 L633 A689 L690 F691 F692 L830	N336-W535 VanDerWaalsContact OD1-CA 3.28Å; N336-W535 WeakPolarHBondContact OD1-CA 3.41Å; W535-I629 HydrophobicContact CB-CD1 3.56Å; W535-I629 HydrophobicContact CD2-CG2 4.06Å; W535-I629 HydrophobicContact CE3-CG2 3.62Å; W535-I629 HydrophobicContact CG-CD1 4.12Å; W535-I629 HydrophobicContact CZ3-CG2 4.04Å; W535-L633 HydrophobicContact CH2-CD1 4.36Å; W535-L633 HydrophobicContact CZ3-CD1 4.13Å; W535-A689 HydrophobicContact CH2-CB 4.41Å; W535-A689 HydrophobicContact CZ3-CB 4.13Å; W535-L690 VanDerWaalsContact CE3-O 3.23Å; W535-L690 PolarHBondContact N-O 2.82Å; W535-F691 AromaticContact CD1-CD2 3.56Å; W535-F691 AromaticContact CD1-CE2 3.8Å; W535-F691 HydrophobicContact CD2-CD2 4.22Å; W535-F691 AromaticContact CE2-CD2 3.61Å; W535-F691 HydrophobicContact CG-CD2 4.18Å; W535-F691 HydrophobicContact CZ2-CB 4.3Å; W535-F691 HydrophobicContact CZ2-CD2 4.15Å; W535-F691 AromaticContact NE1-CD2 3.2Å; W535-F691 AromaticContact NE1-CE2 3.56Å; W535-F691 WeakPolarHBondContact O-CA 3.31Å; W535-F692 PolarHBondContact O-N 2.74Å; W535-L830 HydrophobicContact CZ2-CD1 4.11Å
536	T	91.4	Very high	85.9	Confident	1 Å²	1	13.4 Å²	13.4	1%	0.006	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	175.5	-178.4	60.1	0	0	0	0	113.6	N336 A538 P539 F691 F692 I716 G717 D721	N336-T536 PolarHBondContact OD1-N 2.63Å; N336-T536 PolarHBondContact OD1-OG1 2.98Å; T536-A538 VanDerWaalsContact C-N 3.35Å; T536-A538 PolarHBondContact O-N 3.09Å; T536-P539 WeakPolarHBondContact O-CD 3.25Å; T536-F691 WeakPolarHBondContact O-CE2 3.38Å; T536-F692 VanDerWaalsContact CA-O 3.32Å; T536-F692 WeakPolarHBondContact CA-O 3.21Å; T536-F692 HydrophobicContact CG2-CB 4.3Å; T536-F692 HydrophobicContact CG2-CD1 4.26Å; T536-I716 HydrophobicContact CG2-CG2 4.05Å; T536-G717 VanDerWaalsContact CB-O 3.31Å; T536-G717 WeakPolarHBondContact CB-O 3.42Å; T536-G717 VanDerWaalsContact CG2-O 3.28Å; T536-G717 WeakPolarHBondContact CG2-O 3.26Å; T536-G717 PolarHBondContact OG1-O 2.72Å; T536-D721 HydrophobicContact CG2-CB 4.21Å
537	E	85.8	Confident	84.8	Confident	53 Å²	53	15.4 Å²	15.4	25%	0.248	8%	0.079	C	C	.	.	S	Bend	trans	-62.2	-38.7	178.8	-177.8	178.3	-142.3	0	0	112.8	F691 F692 N693 K695 K715 I716	E537-F691 HydrophobicContact CB-CZ 4.23Å; E537-F692 PolarHBondContact N-O 3.12Å; E537-N693 HydrophobicContact CB-CB 4.29Å; E537-N693 VanDerWaalsContact CD-ND2 3.29Å; E537-N693 PolarHBondContact OE1-ND2 3Å; E537-N693 VanDerWaalsContact OE1-ND2 3.16Å; E537-N693 PolarHBondContact OE2-OD1 3.2Å; E537-N693 VanDerWaalsContact OE2-OD1 3.04Å; E537-K695 IonicContact OE2-NZ 2.72Å; E537-K695 PolarHBondContact OE2-NZ 2.69Å; E537-K715 HydrophobicContact CG-CB 4.42Å; E537-K715 HydrophobicContact CG-CD 4.33Å; E537-K715 HydrophobicContact CG-CG 4.33Å; E537-K715 WeakPolarHBondContact OE2-CA 3.38Å; E537-K715 WeakPolarHBondContact OE2-CG 3.38Å; E537-I716 HydrophobicContact CB-CB 4.31Å; E537-I716 PolarHBondContact N-O 3.07Å; E537-I716 PolarHBondContact OE2-N 3.4Å
538	A	86	Confident	83.5	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.096	C	C	.	.			trans	-140.1	65.6	-176.9	0	0	0	0	0	111.9	T536 A540 S541 L617 S621 K715 I716	T536-A538 VanDerWaalsContact C-N 3.35Å; T536-A538 PolarHBondContact O-N 3.09Å; A538-A540 PolarHBondContact O-N 3.47Å; A538-S541 VanDerWaalsContact O-CB 3.27Å; A538-S541 WeakPolarHBondContact O-CB 3.45Å; A538-S541 PolarHBondContact O-N 3.4Å; A538-S541 PolarHBondContact O-OG 2.87Å; A538-L617 HydrophobicContact CB-CD1 4.33Å; A538-L617 HydrophobicContact CB-CD2 3.76Å; A538-L617 HydrophobicContact CB-CG 3.91Å; A538-S621 WeakPolarHBondContact CA-OG 3.39Å; A538-K715 HydrophobicContact CB-CB 3.73Å; A538-K715 HydrophobicContact CB-CD 4.03Å; A538-I716 PolarHBondContact N-O 3.33Å
539	P	88.5	Confident	82.5	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-18.3	-176	26.9	-38.3	0	0	0	113.6	T536 S541 Y625 F718	T536-P539 WeakPolarHBondContact O-CD 3.25Å; P539-S541 PolarHBondContact O-N 2.9Å; P539-Y625 HydrophobicContact CB-CD1 3.82Å; P539-Y625 HydrophobicContact CB-CD2 4.11Å; P539-Y625 HydrophobicContact CB-CE1 4.34Å; P539-Y625 HydrophobicContact CB-CG 3.7Å; P539-Y625 VanDerWaalsContact CG-CB 3.43Å; P539-Y625 HydrophobicContact CG-CD1 4.28Å; P539-Y625 HydrophobicContact CG-CD2 4.03Å; P539-Y625 HydrophobicContact CG-CG 3.67Å; P539-F718 WeakPolarHBondContact O-CB 3.32Å; P539-F718 WeakPolarHBondContact O-CD2 3.49Å
540	A	87.4	Confident	81.6	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	2	173.6	0	0	0	0	0	114.1	A538 N542 L543 Y544 L617 L620 S621 Y625	A538-A540 PolarHBondContact O-N 3.47Å; A540-N542 VanDerWaalsContact C-N 3.34Å; A540-N542 PolarHBondContact O-N 3.4Å; A540-L543 PolarHBondContact O-N 2.88Å; A540-Y544 WeakPolarHBondContact O-CB 3.19Å; A540-Y544 PolarHBondContact O-N 2.91Å; A540-L617 HydrophobicContact CB-CD1 4.16Å; A540-L620 HydrophobicContact CB-CB 3.55Å; A540-S621 PolarHBondContact N-OG 3.35Å; A540-Y625 HydrophobicContact CB-CD2 4.13Å; A540-Y625 HydrophobicContact CB-CE2 3.92Å
541	S	80.3	Confident	80.7	Confident	4 Å²	4	17.1 Å²	17.1	3%	0.028	9%	0.093	C	C	.	.	H	α-helix	trans	-57.1	-46.2	-176	65.4	0	0	0	0	112.1	A538 P539 Y544 Y545 G717 F718	A538-S541 VanDerWaalsContact O-CB 3.27Å; A538-S541 WeakPolarHBondContact O-CB 3.45Å; A538-S541 PolarHBondContact O-N 3.4Å; A538-S541 PolarHBondContact O-OG 2.87Å; P539-S541 PolarHBondContact O-N 2.9Å; S541-Y544 PolarHBondContact O-N 3.25Å; S541-Y545 WeakPolarHBondContact O-CD2 3.32Å; S541-Y545 PolarHBondContact O-N 2.85Å; S541-G717 WeakPolarHBondContact OG-CA 3.39Å; S541-F718 PolarHBondContact OG-N 3.12Å
542	N	73.3	Confident	79.7	Confident	16 Å²	16	21.8 Å²	21.8	9%	0.086	11%	0.114	C	C	.	.	H	α-helix	trans	-70.6	-40.6	-175.4	-71.6	12.8	0	0	0	110.4	V181 R184 A540 Y544 Y545 S546 F718	V181-N542 WeakPolarHBondContact CG2-OD1 3.3Å; R184-N542 PolarHBondContact NH1-ND2 3.01Å; A540-N542 VanDerWaalsContact C-N 3.34Å; A540-N542 PolarHBondContact O-N 3.4Å; N542-Y544 VanDerWaalsContact C-N 3.3Å; N542-Y544 PolarHBondContact O-N 3.4Å; N542-Y545 PolarHBondContact O-N 3.35Å; N542-S546 WeakPolarHBondContact O-CA 3.5Å; N542-S546 WeakPolarHBondContact O-CB 3.29Å; N542-S546 PolarHBondContact O-N 3.05Å; N542-S546 PolarHBondContact O-OG 2.83Å; N542-F718 HydrophobicContact CB-CB 3.85Å; N542-F718 HydrophobicContact CB-CD1 3.8Å; N542-F718 HydrophobicContact CB-CG 4.16Å; N542-F718 PolarHBondContact ND2-O 3.41Å
543	L	77.7	Confident	78.8	Confident	26 Å²	26	23 Å²	23	14%	0.136	12%	0.12	C	C	.	.	H	α-helix	trans	-56.2	-47.3	172.2	-175.8	66.8	0	0	0	111.1	F453 L454 A540 Y545 H547 L624	F453-L543 WeakPolarHBondContact O-CD1 3.4Å; L454-L543 HydrophobicContact CD2-CD2 3.89Å; A540-L543 PolarHBondContact O-N 2.88Å; L543-Y545 PolarHBondContact O-N 2.99Å; L543-H547 PolarHBondContact O-N 3.35Å; L543-L624 HydrophobicContact CD2-CD1 3.72Å
544	Y	77.8	Confident	78.2	Confident	18 Å²	18	26.7 Å²	26.7	7%	0.071	14%	0.144	C	C	.	.	H	α-helix	trans	-65.3	-34.3	-177.1	-176.6	-111.9	0	0	0	114	A540 S541 N542 I550 H551 L558 V616 L620	A540-Y544 WeakPolarHBondContact O-CB 3.19Å; A540-Y544 PolarHBondContact O-N 2.91Å; S541-Y544 PolarHBondContact O-N 3.25Å; N542-Y544 VanDerWaalsContact C-N 3.3Å; N542-Y544 PolarHBondContact O-N 3.4Å; Y544-I550 HydrophobicContact CD2-CB 4.48Å; Y544-I550 HydrophobicContact CD2-CG2 3.57Å; Y544-I550 HydrophobicContact CE2-CG2 3.88Å; Y544-H551 HydrophobicContact CD1-CB 4.08Å; Y544-H551 HydrophobicContact CE1-CB 3.59Å; Y544-H551 HydrophobicContact CE2-CB 4.22Å; Y544-H551 VanDerWaalsContact CZ-CA 3.48Å; Y544-H551 PolarHBondContact O-N 3.48Å; Y544-L558 HydrophobicContact CE2-CD2 4.07Å; Y544-V616 HydrophobicContact CD2-CG1 3.98Å; Y544-V616 HydrophobicContact CE2-CB 4.41Å; Y544-V616 HydrophobicContact CE2-CG1 3.51Å; Y544-L620 HydrophobicContact CD2-CD1 3.77Å; Y544-L620 HydrophobicContact CG-CD1 4.39Å
545	Y	72.4	Confident	77.6	Confident	16 Å²	16	27.4 Å²	27.4	6%	0.063	15%	0.146	C	C	.	.	H	α-helix	trans	-99.7	-21.6	-178.3	-64.8	-64.3	0	0	0	114.5	P178 S541 N542 L543 H551	P178-Y545 VanDerWaalsContact CD-CD2 3.49Å; P178-Y545 HydrophobicContact CG-CD2 3.77Å; P178-Y545 HydrophobicContact CG-CE1 4.32Å; P178-Y545 HydrophobicContact CG-CE2 3.42Å; P178-Y545 VanDerWaalsContact CG-CE2 3.42Å; P178-Y545 HydrophobicContact CG-CG 4.39Å; S541-Y545 WeakPolarHBondContact O-CD2 3.32Å; S541-Y545 PolarHBondContact O-N 2.85Å; N542-Y545 PolarHBondContact O-N 3.35Å; L543-Y545 PolarHBondContact O-N 2.99Å; Y545-H551 HydrophobicContact CD1-CB 4.02Å; Y545-H551 HydrophobicContact CE1-CB 4.19Å
546	S	63	Low	77	Confident	32 Å²	32	29.4 Å²	29.4	22%	0.224	16%	0.161	C	C	.	.	H	α-helix	trans	-88.5	-34.1	-176.3	75.8	0	0	0	0	113.5	N542	N542-S546 WeakPolarHBondContact O-CA 3.5Å; N542-S546 WeakPolarHBondContact O-CB 3.29Å; N542-S546 PolarHBondContact O-N 3.05Å; N542-S546 PolarHBondContact O-OG 2.83Å
547	H	64.6	Low	76.7	Confident	42 Å²	42	32.7 Å²	32.7	19%	0.194	18%	0.178	C	C	.	.	S	Bend	trans	-88.8	127.8	-175.7	-86.5	62.4	0	0	0	112.1	L543 N549 I550	L543-H547 PolarHBondContact O-N 3.35Å; H547-N549 PolarHBondContact O-N 3.26Å; H547-I550 HydrophobicContact CB-CD1 3.44Å; H547-I550 VanDerWaalsContact CB-CD1 3.44Å; H547-I550 HydrophobicContact CB-CG1 4.15Å; H547-I550 WeakPolarHBondContact O-CG1 3.44Å; H547-I550 PolarHBondContact O-N 2.92Å
548	S	57.8	Low	76.6	Confident	69 Å²	69	30.3 Å²	30.3	48%	0.483	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	35.8	41.6	152.2	61.6	0	0	0	0	117.3	I550	S548-I550 PolarHBondContact O-N 2.63Å
549	N	63.8	Low	76.6	Confident	57 Å²	57	30.3 Å²	30.3	31%	0.305	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	32.8	-179.9	-59.9	-62.9	0	0	0	113.9	H547 H551 K552 M553	H547-N549 PolarHBondContact O-N 3.26Å; N549-H551 PolarHBondContact O-N 2.61Å; N549-K552 HydrophobicContact CB-CB 4.06Å; N549-K552 HydrophobicContact CB-CD 3.94Å; N549-K552 HydrophobicContact CB-CG 4.07Å; N549-K552 WeakPolarHBondContact O-CA 3.38Å; N549-K552 WeakPolarHBondContact O-CB 3.33Å; N549-K552 PolarHBondContact O-N 3.35Å; N549-K552 PolarHBondContact OD1-NZ 3.22Å; N549-M553 PolarHBondContact O-N 3.44Å
550	I	73.4	Confident	76.6	Confident	1 Å²	1	35 Å²	35	1%	0.005	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-51.6	-44.3	176.6	-68.6	169.1	0	0	0	110.4	F453 Y544 H547 S548 K552 M553 L558	F453-I550 HydrophobicContact CB-CD1 4Å; F453-I550 HydrophobicContact CB-CG1 4.34Å; F453-I550 HydrophobicContact CD2-CD1 3.83Å; F453-I550 HydrophobicContact CD2-CG1 4.13Å; F453-I550 HydrophobicContact CG-CD1 4.41Å; Y544-I550 HydrophobicContact CD2-CB 4.48Å; Y544-I550 HydrophobicContact CD2-CG2 3.57Å; Y544-I550 HydrophobicContact CE2-CG2 3.88Å; H547-I550 HydrophobicContact CB-CD1 3.44Å; H547-I550 VanDerWaalsContact CB-CD1 3.44Å; H547-I550 HydrophobicContact CB-CG1 4.15Å; H547-I550 WeakPolarHBondContact O-CG1 3.44Å; H547-I550 PolarHBondContact O-N 2.92Å; S548-I550 PolarHBondContact O-N 2.63Å; I550-K552 PolarHBondContact O-N 3.38Å; I550-K552 VanDerWaalsContact O-N 3.12Å; I550-M553 WeakPolarHBondContact O-CB 3.46Å; I550-M553 PolarHBondContact O-N 3.02Å; I550-L558 HydrophobicContact CG2-CD1 3.63Å; I550-L558 HydrophobicContact CG2-CD2 4.11Å
551	H	74.3	Confident	76.4	Confident	9 Å²	9	38.7 Å²	38.7	4%	0.042	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-62.4	-18	177.6	64.4	-69.2	0	0	0	114.7	D174 Y544 Y545 N549 R613	D174-H551 IonicContact OD2-CD2 3.66Å; D174-H551 IonicContact OD2-CE1 3.37Å; D174-H551 PolarHBondContact OD2-CE1 3.2Å; D174-H551 IonicContact OD2-NE2 3.71Å; D174-H551 PolarHBondContact OD2-NE2 2.86Å; Y544-H551 HydrophobicContact CD1-CB 4.08Å; Y544-H551 HydrophobicContact CE1-CB 3.59Å; Y544-H551 HydrophobicContact CE2-CB 4.22Å; Y544-H551 VanDerWaalsContact CZ-CA 3.48Å; Y544-H551 PolarHBondContact O-N 3.48Å; Y545-H551 HydrophobicContact CD1-CB 4.02Å; Y545-H551 HydrophobicContact CE1-CB 4.19Å; N549-H551 PolarHBondContact O-N 2.61Å; H551-R613 PolarHBondContact O-NH2 2.85Å
552	K	76.6	Confident	76.7	Confident	98 Å²	98	38.6 Å²	38.6	43%	0.426	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-93.2	-12.8	174.2	-54.1	-173.8	178.3	140.2	0	113.1	D174 N549 I550	D174-K552 WeakPolarHBondContact OD2-CE 3.36Å; D174-K552 IonicContact OD2-NZ 2.7Å; D174-K552 PolarHBondContact OD2-NZ 3.43Å; N549-K552 HydrophobicContact CB-CB 4.06Å; N549-K552 HydrophobicContact CB-CD 3.94Å; N549-K552 HydrophobicContact CB-CG 4.07Å; N549-K552 WeakPolarHBondContact O-CA 3.38Å; N549-K552 WeakPolarHBondContact O-CB 3.33Å; N549-K552 PolarHBondContact O-N 3.35Å; N549-K552 PolarHBondContact OD1-NZ 3.22Å; I550-K552 PolarHBondContact O-N 3.38Å; I550-K552 VanDerWaalsContact O-N 3.12Å
553	M	77.6	Confident	77.4	Confident	35 Å²	35	37.9 Å²	37.9	17%	0.172	20%	0.201	C	C	.	.	S	Bend	trans	-67.1	144.1	178.6	-64.9	-167.4	-171.6	0	0	111.2	N549 I550 L558 K561	N549-M553 PolarHBondContact O-N 3.44Å; I550-M553 WeakPolarHBondContact O-CB 3.46Å; I550-M553 PolarHBondContact O-N 3.02Å; M553-L558 HydrophobicContact CB-CB 4.48Å; M553-K561 HydrophobicContact SD-CD 4.29Å
554	P	82.2	Confident	77.7	Confident	77 Å²	77	41.7 Å²	41.7	50%	0.5	21%	0.214	S	C	.	.			trans	-57.7	141.7	169.2	-22.9	33.4	0	0	0	111	S556 L557 L558	P554-S556 VanDerWaalsContact C-N 3.33Å; P554-S556 PolarHBondContact O-N 2.93Å; P554-L557 HydrophobicContact CB-CB 4.4Å; P554-L557 PolarHBondContact O-N 3.33Å; P554-L558 PolarHBondContact O-N 3.46Å
555	Y	82.6	Confident	77.7	Confident	15 Å²	15	43.2 Å²	43.2	6%	0.059	22%	0.222	C	C	.	.	H	α-helix	trans	-51.8	-49.4	-178.2	173.4	-98	0	0	0	112.5	L557 L558 I559 E579 C583 C612 V616 I619	Y555-L557 VanDerWaalsContact C-N 3.35Å; Y555-L557 PolarHBondContact O-N 3.27Å; Y555-L558 WeakPolarHBondContact O-CB 2.96Å; Y555-L558 PolarHBondContact O-N 3.46Å; Y555-L558 VanDerWaalsContact O-N 3.14Å; Y555-I559 HydrophobicContact CD1-CG1 4.36Å; Y555-I559 HydrophobicContact CD2-CG1 4.13Å; Y555-I559 HydrophobicContact CE1-CG1 3.88Å; Y555-I559 HydrophobicContact CE2-CD1 3.87Å; Y555-I559 HydrophobicContact CE2-CG1 3.63Å; Y555-I559 HydrophobicContact CG-CG1 4.46Å; Y555-I559 VanDerWaalsContact CZ-CG1 3.48Å; Y555-I559 WeakPolarHBondContact O-CG1 3.38Å; Y555-I559 PolarHBondContact O-N 2.67Å; Y555-E579 HydrophobicContact CE1-CG 4.07Å; Y555-C583 PolarHBondContact OH-SG 3.19Å; Y555-C612 HydrophobicContact CD1-CB 3.92Å; Y555-C612 HydrophobicContact CD2-CB 4Å; Y555-C612 HydrophobicContact CE1-CB 3.79Å; Y555-C612 HydrophobicContact CE2-CB 3.88Å; Y555-C612 WeakPolarHBondContact CE2-O 3.26Å; Y555-C612 HydrophobicContact CG-CB 4.03Å; Y555-V616 HydrophobicContact CD2-CG2 3.37Å; Y555-V616 HydrophobicContact CE2-CG2 3.66Å; Y555-I619 HydrophobicContact CE2-CD1 4.2Å
556	S	81.4	Confident	77.9	Confident	49 Å²	49	44 Å²	44	34%	0.343	23%	0.226	S	C	.	.	H	α-helix	trans	-60.5	-41.5	-177.8	54.9	0	0	0	0	112.9	P554 Q560	P554-S556 VanDerWaalsContact C-N 3.33Å; P554-S556 PolarHBondContact O-N 2.93Å; S556-Q560 WeakPolarHBondContact O-CB 3.41Å; S556-Q560 PolarHBondContact O-N 3.45Å
557	L	84	Confident	78.7	Confident	69 Å²	69	43.5 Å²	43.5	36%	0.361	22%	0.22	S	C	.	.	H	α-helix	trans	-68.2	-39.5	176.5	-177.7	63.3	0	0	0	111.1	P554 Y555 Q560 K561	P554-L557 HydrophobicContact CB-CB 4.4Å; P554-L557 PolarHBondContact O-N 3.33Å; Y555-L557 VanDerWaalsContact C-N 3.35Å; Y555-L557 PolarHBondContact O-N 3.27Å; L557-Q560 PolarHBondContact O-N 3.47Å; L557-K561 HydrophobicContact CD1-CG 4.37Å; L557-K561 HydrophobicContact CG-CD 4.43Å; L557-K561 WeakPolarHBondContact O-CB 3.37Å; L557-K561 VanDerWaalsContact O-CG 3.32Å; L557-K561 WeakPolarHBondContact O-CG 3.46Å; L557-K561 PolarHBondContact O-N 3.06Å
558	L	84	Confident	79	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-48.3	179.7	-178.5	60.8	0	0	0	112	F453 Y544 I550 M553 P554 Y555 K561 L562 V616	F453-L558 HydrophobicContact CD2-CD1 4.31Å; F453-L558 HydrophobicContact CE2-CD1 3.61Å; F453-L558 HydrophobicContact CZ-CD1 4.32Å; Y544-L558 HydrophobicContact CE2-CD2 4.07Å; I550-L558 HydrophobicContact CG2-CD1 3.63Å; I550-L558 HydrophobicContact CG2-CD2 4.11Å; M553-L558 HydrophobicContact CB-CB 4.48Å; P554-L558 PolarHBondContact O-N 3.46Å; Y555-L558 WeakPolarHBondContact O-CB 2.96Å; Y555-L558 PolarHBondContact O-N 3.46Å; Y555-L558 VanDerWaalsContact O-N 3.14Å; L558-K561 PolarHBondContact O-N 3.49Å; L558-L562 WeakPolarHBondContact O-CB 3.47Å; L558-L562 PolarHBondContact O-N 3.24Å; L558-V616 HydrophobicContact CD2-CB 4.32Å; L558-V616 HydrophobicContact CD2-CG1 3.26Å; L558-V616 HydrophobicContact CD2-CG2 4.08Å; L558-V616 HydrophobicContact CG-CG1 4.42Å
559	I	86.8	Confident	79.8	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-41.8	176.9	-59.8	-54.8	0	0	0	110.7	Y555 K561 L562 V563 K575 I578 E579 I619	Y555-I559 HydrophobicContact CD1-CG1 4.36Å; Y555-I559 HydrophobicContact CD2-CG1 4.13Å; Y555-I559 HydrophobicContact CE1-CG1 3.88Å; Y555-I559 HydrophobicContact CE2-CD1 3.87Å; Y555-I559 HydrophobicContact CE2-CG1 3.63Å; Y555-I559 HydrophobicContact CG-CG1 4.46Å; Y555-I559 VanDerWaalsContact CZ-CG1 3.48Å; Y555-I559 WeakPolarHBondContact O-CG1 3.38Å; Y555-I559 PolarHBondContact O-N 2.67Å; I559-K561 PolarHBondContact O-N 3.01Å; I559-L562 WeakPolarHBondContact O-CB 2.99Å; I559-L562 PolarHBondContact O-N 3.28Å; I559-V563 HydrophobicContact CG2-CG2 4.27Å; I559-V563 WeakPolarHBondContact O-CG2 3.43Å; I559-V563 PolarHBondContact O-N 3.08Å; I559-K575 HydrophobicContact CG2-CG 3.98Å; I559-I578 HydrophobicContact CD1-CG2 4.45Å; I559-I578 HydrophobicContact CG2-CG2 4.19Å; I559-E579 HydrophobicContact CG2-CG 4.46Å; I559-I619 HydrophobicContact CD1-CD1 3.73Å; I559-I619 HydrophobicContact CD1-CG2 4.18Å
560	Q	86.6	Confident	80.7	Confident	99 Å²	99	42 Å²	42	46%	0.463	21%	0.206	S	C	.	.	H	α-helix	trans	-58.5	-48.9	176.2	-178.3	178.6	5.6	0	0	111.5	S556 L557 L562 V563 Y564 K575	S556-Q560 WeakPolarHBondContact O-CB 3.41Å; S556-Q560 PolarHBondContact O-N 3.45Å; L557-Q560 PolarHBondContact O-N 3.47Å; Q560-L562 VanDerWaalsContact C-N 3.31Å; Q560-L562 PolarHBondContact O-N 3.19Å; Q560-V563 PolarHBondContact O-N 3.07Å; Q560-Y564 VanDerWaalsContact O-CB 3.23Å; Q560-Y564 WeakPolarHBondContact O-CB 3.24Å; Q560-Y564 PolarHBondContact O-N 3.44Å; Q560-K575 HydrophobicContact CB-CD 4.38Å
561	K	84.7	Confident	81.2	Confident	77 Å²	77	44 Å²	44	34%	0.335	22%	0.215	S	C	.	.	H	α-helix	trans	-61.3	-40.6	176.3	-77.3	-174.2	174.2	-173.8	0	111.9	F453 M553 L557 L558 I559 Y564 E565	F453-K561 HydrophobicContact CE1-CB 3.5Å; F453-K561 VanDerWaalsContact CE1-CB 3.5Å; F453-K561 HydrophobicContact CE1-CD 4.2Å; F453-K561 HydrophobicContact CE1-CG 4.42Å; F453-K561 HydrophobicContact CZ-CB 3.53Å; M553-K561 HydrophobicContact SD-CD 4.29Å; L557-K561 HydrophobicContact CD1-CG 4.37Å; L557-K561 HydrophobicContact CG-CD 4.43Å; L557-K561 WeakPolarHBondContact O-CB 3.37Å; L557-K561 VanDerWaalsContact O-CG 3.32Å; L557-K561 WeakPolarHBondContact O-CG 3.46Å; L557-K561 PolarHBondContact O-N 3.06Å; L558-K561 PolarHBondContact O-N 3.49Å; I559-K561 PolarHBondContact O-N 3.01Å; K561-Y564 PolarHBondContact O-N 3.46Å; K561-E565 WeakPolarHBondContact O-CB 3.46Å; K561-E565 WeakPolarHBondContact O-CG 3.36Å; K561-E565 PolarHBondContact O-N 3Å
562	L	86.2	Confident	81.6	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.01	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-50.3	178.9	173.2	140.5	0	0	0	111.3	F453 L454 L558 I559 Q560 Y564 E565 M566 I578 I619 L620 W839	F453-L562 HydrophobicContact CZ-CB 4.39Å; L454-L562 HydrophobicContact CD1-CB 3.72Å; L454-L562 HydrophobicContact CD1-CD1 3.74Å; L454-L562 HydrophobicContact CD1-CG 3.64Å; L558-L562 WeakPolarHBondContact O-CB 3.47Å; L558-L562 PolarHBondContact O-N 3.24Å; I559-L562 WeakPolarHBondContact O-CB 2.99Å; I559-L562 PolarHBondContact O-N 3.28Å; Q560-L562 VanDerWaalsContact C-N 3.31Å; Q560-L562 PolarHBondContact O-N 3.19Å; L562-Y564 VanDerWaalsContact C-N 3.32Å; L562-Y564 PolarHBondContact O-N 2.95Å; L562-E565 PolarHBondContact O-N 3.46Å; L562-M566 HydrophobicContact CD1-SD 4.31Å; L562-M566 HydrophobicContact CD2-SD 3.97Å; L562-M566 HydrophobicContact CG-SD 3.84Å; L562-M566 WeakPolarHBondContact O-CB 3.45Å; L562-M566 VanDerWaalsContact O-CG 3.28Å; L562-M566 WeakPolarHBondContact O-CG 2.89Å; L562-M566 PolarHBondContact O-N 3.22Å; L562-I578 HydrophobicContact CD2-CD1 4.11Å; L562-I619 HydrophobicContact CD1-CG2 4.44Å; L562-L620 HydrophobicContact CD1-CD2 3.34Å; L562-L620 HydrophobicContact CD1-CG 4.42Å; L562-W839 HydrophobicContact CD2-CH2 4.03Å
563	V	87.1	Confident	81.8	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	24%	0.235	C	C	.	.	H	α-helix	trans	-68.1	-37.6	-178.5	176.8	0	0	0	0	110.8	I559 Q560 Y567 Q571 I574 K575 I578	I559-V563 HydrophobicContact CG2-CG2 4.27Å; I559-V563 WeakPolarHBondContact O-CG2 3.43Å; I559-V563 PolarHBondContact O-N 3.08Å; Q560-V563 PolarHBondContact O-N 3.07Å; V563-Y567 HydrophobicContact CG1-CD2 4.16Å; V563-Y567 PolarHBondContact O-N 3.13Å; V563-Q571 HydrophobicContact CG1-CB 3.85Å; V563-Q571 HydrophobicContact CG1-CG 4.18Å; V563-Q571 VanDerWaalsContact CG1-O 3.23Å; V563-Q571 WeakPolarHBondContact CG1-O 3.45Å; V563-I574 HydrophobicContact CG1-CB 3.87Å; V563-I574 HydrophobicContact CG1-CG2 3.78Å; V563-I574 HydrophobicContact CG2-CG2 4.05Å; V563-K575 HydrophobicContact CG2-CB 4.16Å; V563-I578 HydrophobicContact CG2-CD1 3.69Å
564	Y	84.9	Confident	82.2	Confident	106 Å²	106	45 Å²	45	42%	0.416	23%	0.227	S	C	.	.	H	α-helix	trans	-64.5	-40.8	178.8	-169.2	-90	0	0	0	112.9	P415 Q560 K561 L562 Q571	P415-Y564 WeakPolarHBondContact CB-OH 3.19Å; P415-Y564 WeakPolarHBondContact CG-OH 3.47Å; Q560-Y564 VanDerWaalsContact O-CB 3.23Å; Q560-Y564 WeakPolarHBondContact O-CB 3.24Å; Q560-Y564 PolarHBondContact O-N 3.44Å; K561-Y564 PolarHBondContact O-N 3.46Å; L562-Y564 VanDerWaalsContact C-N 3.32Å; L562-Y564 PolarHBondContact O-N 2.95Å; Y564-Q571 VanDerWaalsContact CD2-CD 3.47Å; Y564-Q571 VanDerWaalsContact CD2-NE2 3.32Å; Y564-Q571 PolarHBondContact O-NE2 3.16Å
565	E	76.8	Confident	82.4	Confident	50 Å²	50	43.4 Å²	43.4	23%	0.234	21%	0.213	C	C	.	.	H	α-helix	trans	-74.3	-40.5	177.7	-71.7	-168.5	-177.7	0	0	112.1	S452 F453 I455 K561 L562	S452-E565 PolarHBondContact OG-OE2 3.5Å; F453-E565 VanDerWaalsContact CD1-OE1 3.25Å; F453-E565 WeakPolarHBondContact CD1-OE1 3.32Å; F453-E565 WeakPolarHBondContact CD1-OE2 3.44Å; F453-E565 HydrophobicContact CE1-CG 4.17Å; F453-E565 WeakPolarHBondContact CE1-OE1 3.36Å; F453-E565 WeakPolarHBondContact CE1-OE2 3.4Å; I455-E565 HydrophobicContact CD1-CB 4.06Å; I455-E565 VanDerWaalsContact CD1-O 3.26Å; I455-E565 WeakPolarHBondContact CD1-O 3.48Å; K561-E565 WeakPolarHBondContact O-CB 3.46Å; K561-E565 WeakPolarHBondContact O-CG 3.36Å; K561-E565 PolarHBondContact O-N 3Å; L562-E565 PolarHBondContact O-N 3.46Å
566	M	77.1	Confident	82.3	Confident	32 Å²	32	48.4 Å²	48.4	16%	0.158	24%	0.236	C	C	.	.	H	α-helix	trans	-79.4	-32.6	-175.3	-69.4	-176.3	65.4	0	0	114.1	P342 L562 L624 W839	P342-M566 HydrophobicContact CG-CE 3.95Å; L562-M566 HydrophobicContact CD1-SD 4.31Å; L562-M566 HydrophobicContact CD2-SD 3.97Å; L562-M566 HydrophobicContact CG-SD 3.84Å; L562-M566 WeakPolarHBondContact O-CB 3.45Å; L562-M566 VanDerWaalsContact O-CG 3.28Å; L562-M566 WeakPolarHBondContact O-CG 2.89Å; L562-M566 PolarHBondContact O-N 3.22Å; M566-L624 HydrophobicContact CE-CD2 4.19Å; M566-L624 HydrophobicContact SD-CD2 3.99Å; M566-W839 HydrophobicContact CE-CE3 4.17Å; M566-W839 HydrophobicContact CE-CZ3 3.62Å; M566-W839 HydrophobicContact SD-CZ3 4.02Å
567	Y	79.5	Confident	82.4	Confident	22 Å²	22	47.8 Å²	47.8	9%	0.086	23%	0.229	C	C	.	.			trans	-127.3	120.8	-170.2	-58.7	-69.5	0	0	0	111.3	V563 Y569 Q571 I574 W839 F843 T847	V563-Y567 HydrophobicContact CG1-CD2 4.16Å; V563-Y567 PolarHBondContact O-N 3.13Å; Y567-Y569 VanDerWaalsContact C-N 3.31Å; Y567-Y569 PolarHBondContact O-N 3.02Å; Y567-Q571 WeakPolarHBondContact O-CG 3.29Å; Y567-Q571 PolarHBondContact O-NE2 3.38Å; Y567-I574 HydrophobicContact CD1-CD1 4.09Å; Y567-I574 HydrophobicContact CD2-CD1 3.94Å; Y567-I574 HydrophobicContact CD2-CG2 3.82Å; Y567-I574 HydrophobicContact CE2-CG2 3.89Å; Y567-I574 HydrophobicContact CG-CD1 3.65Å; Y567-W839 HydrophobicContact CE2-CZ3 4.27Å; Y567-W839 VanDerWaalsContact OH-CE3 3.3Å; Y567-F843 HydrophobicContact CE1-CB 3.72Å; Y567-F843 HydrophobicContact CE2-CB 4.35Å; Y567-F843 HydrophobicContact CE2-CD2 4.28Å; Y567-F843 AromaticContact CZ-CD2 3.95Å; Y567-F843 WeakPolarHBondContact OH-CD2 3.29Å; Y567-T847 HydrophobicContact CD1-CG2 3.54Å; Y567-T847 HydrophobicContact CE1-CG2 4.48Å; Y567-T847 HydrophobicContact CG-CG2 4.14Å
568	P	71	Confident	82.5	Confident	46 Å²	46	44.5 Å²	44.5	30%	0.299	21%	0.212	S	C	.	.	S	Bend	trans	-75.2	-17.7	-178.6	26.6	-33.2	0	0	0	114.1	F416	F416-P568 HydrophobicContact CD1-CB 4.16Å; F416-P568 HydrophobicContact CD2-CB 4.04Å; F416-P568 HydrophobicContact CE1-CB 3.91Å; F416-P568 HydrophobicContact CE2-CB 3.79Å; F416-P568 HydrophobicContact CG-CB 4.22Å; F416-P568 HydrophobicContact CZ-CB 3.72Å
569	Y	76	Confident	82.4	Confident	66 Å²	66	47.1 Å²	47.1	26%	0.259	22%	0.224	S	C	.	.	S	Bend	trans	-139	155.7	-173.6	-54.3	-68.7	0	0	0	110.9	Y567 Q571	Y567-Y569 VanDerWaalsContact C-N 3.31Å; Y567-Y569 PolarHBondContact O-N 3.02Å; Y569-Q571 PolarHBondContact O-N 3.46Å
570	N	80.9	Confident	82	Confident	23 Å²	23	49.5 Å²	49.5	12%	0.123	23%	0.233	C	C	.	.			trans	56.8	34.2	177.5	-64.4	-37.4	0	0	0	114.1	D572 V573 I574 L846	N570-D572 PolarHBondContact O-N 3.15Å; N570-V573 PolarHBondContact O-N 3.29Å; N570-I574 WeakPolarHBondContact O-CG1 3.04Å; N570-I574 PolarHBondContact O-N 3.11Å; N570-L846 PolarHBondContact ND2-O 2.92Å
571	Q	84.8	Confident	81.8	Confident	45 Å²	45	45.3 Å²	45.3	21%	0.21	22%	0.215	C	C	.	.	H	α-helix	trans	-60.5	-46.1	-174.8	-67.9	168.9	-16.7	0	0	112.2	V563 Y564 Y567 Y569 V573 I574 K575	V563-Q571 HydrophobicContact CG1-CB 3.85Å; V563-Q571 HydrophobicContact CG1-CG 4.18Å; V563-Q571 VanDerWaalsContact CG1-O 3.23Å; V563-Q571 WeakPolarHBondContact CG1-O 3.45Å; Y564-Q571 VanDerWaalsContact CD2-CD 3.47Å; Y564-Q571 VanDerWaalsContact CD2-NE2 3.32Å; Y564-Q571 PolarHBondContact O-NE2 3.16Å; Y567-Q571 WeakPolarHBondContact O-CG 3.29Å; Y567-Q571 PolarHBondContact O-NE2 3.38Å; Y569-Q571 PolarHBondContact O-N 3.46Å; Q571-V573 VanDerWaalsContact C-N 3.3Å; Q571-V573 PolarHBondContact O-N 3.33Å; Q571-I574 PolarHBondContact O-N 2.8Å; Q571-K575 WeakPolarHBondContact O-CB 3.46Å; Q571-K575 PolarHBondContact O-N 3.34Å
572	D	82.6	Confident	81.6	Confident	129 Å²	129	41.7 Å²	41.7	69%	0.69	20%	0.199	S	C	*	.	H	α-helix	trans	-61.2	-40.7	-178.6	-62.3	-42.6	0	0	0	112.2	N570 K575 E576	N570-D572 PolarHBondContact O-N 3.15Å; D572-K575 WeakPolarHBondContact O-CB 3.49Å; D572-K575 PolarHBondContact O-N 3.15Å; D572-E576 PolarHBondContact O-N 3.02Å
573	V	81.6	Confident	81.1	Confident	33 Å²	33	42.3 Å²	42.3	20%	0.2	20%	0.204	C	C	.	.	H	α-helix	trans	-71.6	-41.2	-179.9	-170.1	0	0	0	0	111.5	N570 Q571 K575 E576 I577 Y879	N570-V573 PolarHBondContact O-N 3.29Å; Q571-V573 VanDerWaalsContact C-N 3.3Å; Q571-V573 PolarHBondContact O-N 3.33Å; V573-K575 VanDerWaalsContact C-N 3.3Å; V573-K575 PolarHBondContact O-N 3.16Å; V573-E576 PolarHBondContact O-N 3.44Å; V573-I577 HydrophobicContact CG1-CD1 3.97Å; V573-I577 HydrophobicContact CG1-CG1 4.49Å; V573-I577 WeakPolarHBondContact O-CD1 2.69Å; V573-I577 VanDerWaalsContact O-CG1 3.24Å; V573-I577 WeakPolarHBondContact O-CG1 3.49Å; V573-I577 PolarHBondContact O-N 3.2Å; V573-Y879 HydrophobicContact CB-CE1 4.16Å; V573-Y879 HydrophobicContact CB-CE2 4.15Å; V573-Y879 WeakPolarHBondContact CB-OH 3.36Å; V573-Y879 HydrophobicContact CG1-CD1 3.79Å; V573-Y879 HydrophobicContact CG1-CD2 4.4Å; V573-Y879 HydrophobicContact CG1-CE1 3.19Å; V573-Y879 HydrophobicContact CG1-CE2 3.89Å; V573-Y879 HydrophobicContact CG1-CG 4.34Å; V573-Y879 WeakPolarHBondContact CG1-OH 3.35Å; V573-Y879 HydrophobicContact CG2-CE2 3.88Å
574	I	84.5	Confident	80	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.9	-42.9	175.4	-68.8	170.3	0	0	0	110.1	V563 Y567 N570 Q571 I577 I578 F843 L846 T847	V563-I574 HydrophobicContact CG1-CB 3.87Å; V563-I574 HydrophobicContact CG1-CG2 3.78Å; V563-I574 HydrophobicContact CG2-CG2 4.05Å; Y567-I574 HydrophobicContact CD1-CD1 4.09Å; Y567-I574 HydrophobicContact CD2-CD1 3.94Å; Y567-I574 HydrophobicContact CD2-CG2 3.82Å; Y567-I574 HydrophobicContact CE2-CG2 3.89Å; Y567-I574 HydrophobicContact CG-CD1 3.65Å; N570-I574 WeakPolarHBondContact O-CG1 3.04Å; N570-I574 PolarHBondContact O-N 3.11Å; Q571-I574 PolarHBondContact O-N 2.8Å; I574-I577 PolarHBondContact O-N 3.08Å; I574-I578 HydrophobicContact CG2-CD1 3.96Å; I574-I578 WeakPolarHBondContact O-CG1 3.04Å; I574-I578 PolarHBondContact O-N 3.23Å; I574-F843 HydrophobicContact CB-CD1 4.37Å; I574-F843 HydrophobicContact CD1-CB 4.46Å; I574-F843 HydrophobicContact CG1-CD1 4Å; I574-F843 HydrophobicContact CG2-CD1 3.84Å; I574-F843 HydrophobicContact CG2-CD2 4.38Å; I574-F843 HydrophobicContact CG2-CE1 3.92Å; I574-F843 HydrophobicContact CG2-CE2 4.46Å; I574-F843 HydrophobicContact CG2-CG 4.09Å; I574-F843 HydrophobicContact CG2-CZ 4.23Å; I574-L846 HydrophobicContact CG1-CB 4.49Å; I574-L846 HydrophobicContact CG1-CD1 4.07Å; I574-T847 HydrophobicContact CD1-CG2 4.25Å
575	K	86.7	Confident	78.6	Confident	44 Å²	44	41.2 Å²	41.2	19%	0.191	21%	0.208	C	C	.	.	H	α-helix	trans	-57.5	-50.5	175.3	171.6	179.1	174.7	-170.5	0	111.4	I559 Q560 V563 Q571 D572 V573 I577 I578 E579	I559-K575 HydrophobicContact CG2-CG 3.98Å; Q560-K575 HydrophobicContact CB-CD 4.38Å; V563-K575 HydrophobicContact CG2-CB 4.16Å; Q571-K575 WeakPolarHBondContact O-CB 3.46Å; Q571-K575 PolarHBondContact O-N 3.34Å; D572-K575 WeakPolarHBondContact O-CB 3.49Å; D572-K575 PolarHBondContact O-N 3.15Å; V573-K575 VanDerWaalsContact C-N 3.3Å; V573-K575 PolarHBondContact O-N 3.16Å; K575-I577 VanDerWaalsContact C-N 3.3Å; K575-I577 PolarHBondContact O-N 2.91Å; K575-I578 PolarHBondContact O-N 2.81Å; K575-I578 VanDerWaalsContact O-N 3.17Å; K575-E579 WeakPolarHBondContact CE-OE1 3.38Å; K575-E579 HydrophobicContact CG-CG 4.48Å; K575-E579 WeakPolarHBondContact O-CG 3.37Å; K575-E579 PolarHBondContact O-N 2.66Å
576	E	80.8	Confident	77.3	Confident	120 Å²	120	42 Å²	42	56%	0.561	21%	0.214	S	C	*	.	H	α-helix	trans	-60.7	-40.2	179.9	-170.2	178.5	-178.2	0	0	111.9	D572 V573 E579 Y580	D572-E576 PolarHBondContact O-N 3.02Å; V573-E576 PolarHBondContact O-N 3.44Å; E576-E579 PolarHBondContact O-N 2.59Å; E576-Y580 WeakPolarHBondContact O-CB 3.21Å; E576-Y580 PolarHBondContact O-N 3.16Å
577	I	84.7	Confident	75.4	Confident	36 Å²	36	44.2 Å²	44.2	19%	0.185	23%	0.226	C	C	.	.	H	α-helix	trans	-64.1	-42.2	176.1	-66.8	163.5	0	0	0	111.3	V573 I574 K575 Y580 A581 L838 L842 F843 L846 Y879	V573-I577 HydrophobicContact CG1-CD1 3.97Å; V573-I577 HydrophobicContact CG1-CG1 4.49Å; V573-I577 WeakPolarHBondContact O-CD1 2.69Å; V573-I577 VanDerWaalsContact O-CG1 3.24Å; V573-I577 WeakPolarHBondContact O-CG1 3.49Å; V573-I577 PolarHBondContact O-N 3.2Å; I574-I577 PolarHBondContact O-N 3.08Å; K575-I577 VanDerWaalsContact C-N 3.3Å; K575-I577 PolarHBondContact O-N 2.91Å; I577-Y580 PolarHBondContact O-N 3.5Å; I577-A581 WeakPolarHBondContact O-CB 3.47Å; I577-A581 PolarHBondContact O-N 3.49Å; I577-L838 HydrophobicContact CG2-CD1 4.19Å; I577-L838 HydrophobicContact CG2-CD2 4.03Å; I577-L842 HydrophobicContact CD1-CD2 4.11Å; I577-L842 HydrophobicContact CG2-CD2 4.32Å; I577-F843 HydrophobicContact CB-CE1 4.08Å; I577-F843 HydrophobicContact CG2-CE1 3.71Å; I577-F843 HydrophobicContact CG2-CZ 4.09Å; I577-L846 HydrophobicContact CD1-CD1 3.79Å; I577-Y879 HydrophobicContact CD1-CE1 4.4Å
578	I	85.4	Confident	73	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.1	-48.8	177.4	-70.5	171.3	0	0	0	110.4	I559 L562 V563 I574 K575 Y580 A581 Y582 I619 W839 F843	I559-I578 HydrophobicContact CD1-CG2 4.45Å; I559-I578 HydrophobicContact CG2-CG2 4.19Å; L562-I578 HydrophobicContact CD2-CD1 4.11Å; V563-I578 HydrophobicContact CG2-CD1 3.69Å; I574-I578 HydrophobicContact CG2-CD1 3.96Å; I574-I578 WeakPolarHBondContact O-CG1 3.04Å; I574-I578 PolarHBondContact O-N 3.23Å; K575-I578 PolarHBondContact O-N 2.81Å; K575-I578 VanDerWaalsContact O-N 3.17Å; I578-Y580 VanDerWaalsContact C-N 3.32Å; I578-Y580 PolarHBondContact O-N 2.85Å; I578-A581 PolarHBondContact O-N 3.05Å; I578-Y582 HydrophobicContact CG2-CD2 4.24Å; I578-Y582 PolarHBondContact O-N 2.88Å; I578-I619 HydrophobicContact CG2-CD1 3.88Å; I578-I619 HydrophobicContact CG2-CG1 4.27Å; I578-I619 HydrophobicContact CG2-CG2 3.98Å; I578-W839 HydrophobicContact CD1-CH2 4.04Å; I578-W839 HydrophobicContact CD1-CZ2 4.42Å; I578-F843 HydrophobicContact CD1-CE2 4.12Å; I578-F843 HydrophobicContact CD1-CZ 4.14Å; I578-F843 HydrophobicContact CG1-CE1 4.45Å; I578-F843 HydrophobicContact CG1-CE2 3.89Å; I578-F843 HydrophobicContact CG1-CZ 3.51Å
579	E	82.1	Confident	71.2	Confident	57 Å²	57	52.1 Å²	52.1	27%	0.266	26%	0.258	S	S	.	.	H	α-helix	trans	-58.8	-45.4	178.8	-70.1	-179.9	173.5	0	0	110.4	Y555 I559 K575 E576 C583	Y555-E579 HydrophobicContact CE1-CG 4.07Å; I559-E579 HydrophobicContact CG2-CG 4.46Å; K575-E579 WeakPolarHBondContact CE-OE1 3.38Å; K575-E579 HydrophobicContact CG-CG 4.48Å; K575-E579 WeakPolarHBondContact O-CG 3.37Å; K575-E579 PolarHBondContact O-N 2.66Å; E576-E579 PolarHBondContact O-N 2.59Å; E579-C583 WeakPolarHBondContact O-CB 3.33Å; E579-C583 PolarHBondContact O-N 3.43Å
580	Y	78.5	Confident	69.1	Low	51 Å²	51	57 Å²	57	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-62.7	-50.1	176.1	-176	-90.5	0	0	0	112.5	E576 I577 I578 Y582 N584 Q894 M898	E576-Y580 WeakPolarHBondContact O-CB 3.21Å; E576-Y580 PolarHBondContact O-N 3.16Å; I577-Y580 PolarHBondContact O-N 3.5Å; I578-Y580 VanDerWaalsContact C-N 3.32Å; I578-Y580 PolarHBondContact O-N 2.85Å; Y580-Y582 PolarHBondContact O-N 3.47Å; Y580-N584 HydrophobicContact CD2-CB 4.34Å; Y580-N584 HydrophobicContact CE2-CB 4.45Å; Y580-N584 WeakPolarHBondContact O-CB 2.73Å; Y580-N584 PolarHBondContact O-N 2.84Å; Y580-Q894 PolarHBondContact OH-OE1 3.24Å; Y580-M898 HydrophobicContact CD1-CE 3.55Å; Y580-M898 HydrophobicContact CD2-CE 3.86Å; Y580-M898 HydrophobicContact CE1-CE 3.2Å; Y580-M898 HydrophobicContact CE2-CE 3.54Å; Y580-M898 HydrophobicContact CE2-CG 3.86Å; Y580-M898 HydrophobicContact CE2-SD 4.15Å; Y580-M898 HydrophobicContact CG-CE 3.88Å
581	A	81.1	Confident	66.7	Low	11 Å²	11	62.1 Å²	62.1	9%	0.091	31%	0.309	C	S	.	.	H	α-helix	trans	-69.2	-33.2	-172	0	0	0	0	0	113.5	I577 I578 K835 L838	I577-A581 WeakPolarHBondContact O-CB 3.47Å; I577-A581 PolarHBondContact O-N 3.49Å; I578-A581 PolarHBondContact O-N 3.05Å; A581-K835 VanDerWaalsContact O-CE 3.27Å; A581-K835 WeakPolarHBondContact O-CE 3.3Å; A581-L838 HydrophobicContact CB-CD1 3.44Å; A581-L838 VanDerWaalsContact CB-CD1 3.44Å
582	Y	80.8	Confident	64.2	Low	1 Å²	1	66.9 Å²	66.9	0%	0.004	34%	0.336	C	S	.	.	H	α-helix	trans	-98.2	-34.8	-176.9	-77	-96.5	0	0	0	113.8	I578 Y580 K615 D618 I619 D622 K835 W839	I578-Y582 HydrophobicContact CG2-CD2 4.24Å; I578-Y582 PolarHBondContact O-N 2.88Å; Y580-Y582 PolarHBondContact O-N 3.47Å; Y582-K615 WeakPolarHBondContact O-CG 3.29Å; Y582-D618 HydrophobicContact CD1-CB 4.46Å; Y582-D618 HydrophobicContact CE1-CB 4.28Å; Y582-I619 HydrophobicContact CD1-CB 4.48Å; Y582-I619 HydrophobicContact CD1-CD1 4.31Å; Y582-I619 HydrophobicContact CD1-CG1 3.37Å; Y582-I619 HydrophobicContact CD2-CD1 4.36Å; Y582-I619 HydrophobicContact CD2-CG1 3.73Å; Y582-I619 HydrophobicContact CE1-CB 4.46Å; Y582-I619 HydrophobicContact CE1-CG1 3.78Å; Y582-I619 HydrophobicContact CE2-CG1 4.1Å; Y582-I619 HydrophobicContact CG-CD1 3.92Å; Y582-I619 HydrophobicContact CG-CG1 3.35Å; Y582-D622 WeakPolarHBondContact CE1-OD2 3.25Å; Y582-D622 VanDerWaalsContact OH-CB 3.31Å; Y582-D622 WeakPolarHBondContact OH-CB 3.37Å; Y582-D622 PolarHBondContact OH-OD2 3.29Å; Y582-K835 HydrophobicContact CD1-CD 4.22Å; Y582-K835 HydrophobicContact CE1-CD 3.89Å; Y582-K835 HydrophobicContact CE2-CB 4.46Å; Y582-K835 HydrophobicContact CE2-CD 4.43Å; Y582-W839 AromaticContact CZ-NE1 3.9Å; Y582-W839 PolarHBondContact OH-NE1 2.91Å
583	C	76.8	Confident	61.7	Low	15 Å²	15	67.5 Å²	67.5	10%	0.101	34%	0.339	C	S	.	.	H	α-helix	trans	-90.1	-42.8	-177.5	-62.3	0	0	0	0	114	Y555 E579 S585 C612	Y555-C583 PolarHBondContact OH-SG 3.19Å; E579-C583 WeakPolarHBondContact O-CB 3.33Å; E579-C583 PolarHBondContact O-N 3.43Å; C583-S585 VanDerWaalsContact C-N 3.35Å; C583-C612 HydrophobicContact CB-CB 4.19Å; C583-C612 WeakPolarHBondContact CB-SG 3.49Å; C583-C612 WeakPolarHBondContact SG-CA 2.96Å; C583-C612 WeakPolarHBondContact SG-CB 3.24Å; C583-C612 CovalentContact SG-SG 2.02Å; C583-C612 PolarHBondContact SG-SG 2.73Å
584	N	64	Low	59.3	Low	45 Å²	45	72.6 Å²	72.6	24%	0.241	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-85.6	-9.2	-171.9	-67.2	-27.1	0	0	0	113.1	Y580 D586 I587 F588	Y580-N584 HydrophobicContact CD2-CB 4.34Å; Y580-N584 HydrophobicContact CE2-CB 4.45Å; Y580-N584 WeakPolarHBondContact O-CB 2.73Å; Y580-N584 PolarHBondContact O-N 2.84Å; N584-D586 PolarHBondContact O-N 3.5Å; N584-D586 VanDerWaalsContact O-N 3.12Å; N584-I587 PolarHBondContact O-N 3.04Å; N584-F588 WeakPolarHBondContact O-CD2 3.04Å
585	S	54.4	Low	56.8	Low	40 Å²	40	80.2 Å²	80.2	28%	0.28	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-59	-28.8	-176.7	66.7	0	0	0	0	113.4	C583	C583-S585 VanDerWaalsContact C-N 3.35Å
586	D	49.3	Very low	54.3	Low	65 Å²	65	85 Å²	85	35%	0.348	43%	0.433	S	S	.	.	G	3₁₀ helix	trans	-92.7	-19.1	-174	-61.4	-3.8	0	0	0	112.3	N584 F588 H589 K615	N584-D586 PolarHBondContact O-N 3.5Å; N584-D586 VanDerWaalsContact O-N 3.12Å; D586-F588 VanDerWaalsContact C-N 3.28Å; D586-F588 PolarHBondContact O-N 3.25Å; D586-H589 PolarHBondContact O-N 2.86Å; D586-K615 IonicContact OD1-NZ 3.24Å; D586-K615 WeakPolarHBondContact OD2-CE 3.48Å; D586-K615 IonicContact OD2-NZ 3.99Å; D586-K615 PolarHBondContact OD2-NZ 2.69Å
587	I	37.8	Very low	51.9	Low	79 Å²	79	86.2 Å²	86.2	41%	0.405	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-67.1	-32.5	177.2	-59.1	177.7	0	0	0	110.6	N584 H589 F590	N584-I587 PolarHBondContact O-N 3.04Å; I587-H589 PolarHBondContact O-N 3.07Å; I587-F590 PolarHBondContact O-N 2.91Å
588	F	30.1	Very low	49.3	Very low	69 Å²	69	92 Å²	92	30%	0.303	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-71.4	-12.2	179.6	-74.6	-74.7	0	0	0	114.7	N584 D586 K897	N584-F588 WeakPolarHBondContact O-CD2 3.04Å; D586-F588 VanDerWaalsContact C-N 3.28Å; D586-F588 PolarHBondContact O-N 3.25Å; F588-K897 HydrophobicContact CD1-CD 4.29Å; F588-K897 HydrophobicContact CE1-CB 4.36Å; F588-K897 HydrophobicContact CE1-CD 4.21Å
589	H	33.1	Very low	46.6	Very low	166 Å²	166	102.4 Å²	102.4	77%	0.769	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-91.9	-12.7	175.2	-89.9	-61.4	0	0	0	114.2	D586 I587	D586-H589 PolarHBondContact O-N 2.86Å; I587-H589 PolarHBondContact O-N 3.07Å
590	F	31.1	Very low	44.1	Very low	167 Å²	167	105.1 Å²	105.1	73%	0.732	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-17.6	-179.3	-89.4	-83.1	0	0	0	115.1	I587 N592	I587-F590 PolarHBondContact O-N 2.91Å; F590-N592 VanDerWaalsContact C-N 3.32Å; F590-N592 PolarHBondContact O-N 3.37Å
591	N	31.1	Very low	41.9	Very low	132 Å²	132	106 Å²	106	71%	0.706	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	18	-177.6	-95	14.2	0	0	0	116.2
592	N	32.7	Very low	39.5	Very low	145 Å²	145	112.9 Å²	112.9	78%	0.775	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	3.9	179.9	-112.8	8.1	0	0	0	115.3	F590	F590-N592 VanDerWaalsContact C-N 3.32Å; F590-N592 PolarHBondContact O-N 3.37Å
593	N	29.4	Very low	37.3	Very low	142 Å²	142	115 Å²	115	76%	0.759	61%	0.606	S	S	*	*	S	Bend	trans	-148.4	90.4	173.2	-78.2	-38	0	0	0	109.4
594	N	31.4	Very low	35.4	Very low	139 Å²	139	118.6 Å²	118.6	74%	0.743	62%	0.621	S	S	*	*			trans	155.4	107.1	144.5	-78.5	-17.3	0	0	0	108	N596	N594-N596 PolarHBondContact O-N 2.83Å
595	N	32.6	Very low	34.2	Very low	160 Å²	160	125 Å²	125	86%	0.856	65%	0.647	S	S	*	*			trans	-70.4	59.4	167.3	-69	-13.4	0	0	0	110.4
596	N	32.6	Very low	33.3	Very low	144 Å²	144	130.3 Å²	130.3	77%	0.77	67%	0.667	S	S	*	*			trans	-128.2	69.4	167.4	-75.2	-14.3	0	0	0	107	N594 D598	N594-N596 PolarHBondContact O-N 2.83Å; N596-D598 PolarHBondContact O-N 3.22Å
597	D	30.7	Very low	32.7	Very low	147 Å²	147	134.6 Å²	134.6	79%	0.786	68%	0.683	S	S	*	*			trans	-65.2	111.7	158.3	-67.9	-42.2	0	0	0	106.9
598	D	31.4	Very low	33.2	Very low	156 Å²	156	134.9 Å²	134.9	83%	0.834	68%	0.681	S	S	*	*	S	Bend	trans	-179.8	1.9	154.5	-97.3	-15.8	0	0	0	116.1	N596	N596-D598 PolarHBondContact O-N 3.22Å
599	Y	27.5	Very low	34.2	Very low	220 Å²	220	137 Å²	137	86%	0.863	69%	0.692	S	S	*	*	S	Bend	trans	-132.1	42.5	-175.1	-93.4	-82.2	0	0	0	116
600	I	30.8	Very low	35.2	Very low	113 Å²	113	133.4 Å²	133.4	58%	0.579	68%	0.682	S	S	*	*			trans	-141.4	58.4	175.8	-44.4	178.5	0	0	0	111.4	E604	I600-E604 HydrophobicContact CG2-CB 4.09Å; I600-E604 HydrophobicContact CG2-CG 3.79Å
601	G	32.4	Very low	36.7	Very low	70 Å²	70	128.1 Å²	128.1	72%	0.722	66%	0.661	S	S	*	*	S	Bend	trans	-99.8	-31.9	-179.8	0	0	0	0	0	115.8
602	N	30.4	Very low	38.6	Very low	156 Å²	156	122.4 Å²	122.4	83%	0.834	63%	0.631	S	S	*	*	S	Bend	trans	-127	-12.9	-176.9	-89	-26.6	0	0	0	114.2	E604	N602-E604 VanDerWaalsContact C-N 3.3Å
603	S	34.5	Very low	40.3	Very low	45 Å²	45	120.3 Å²	120.3	32%	0.315	61%	0.613	S	S	.	*	S	Bend	trans	-75.6	-20.1	171.8	49.4	0	0	0	0	112.4	K605 Q606 F607	S603-K605 PolarHBondContact O-N 2.95Å; S603-Q606 PolarHBondContact O-N 2.72Å; S603-F607 WeakPolarHBondContact O-CB 3.38Å; S603-F607 WeakPolarHBondContact O-CD2 3.16Å; S603-F607 PolarHBondContact O-N 2.77Å
604	E	36.5	Very low	42.2	Very low	90 Å²	90	116 Å²	116	42%	0.421	59%	0.586	S	S	.	*	H	α-helix	trans	-68.3	-32.1	-169	-135.3	-169.9	-138.4	0	0	114.1	I600 N602 K608	I600-E604 HydrophobicContact CG2-CB 4.09Å; I600-E604 HydrophobicContact CG2-CG 3.79Å; N602-E604 VanDerWaalsContact C-N 3.3Å; E604-K608 WeakPolarHBondContact O-CB 3.36Å; E604-K608 WeakPolarHBondContact O-CD 3.35Å; E604-K608 WeakPolarHBondContact O-CG 3.34Å; E604-K608 PolarHBondContact O-N 3.41Å; E604-K608 VanDerWaalsContact O-N 3.11Å; E604-K608 IonicContact OE2-NZ 2.88Å; E604-K608 PolarHBondContact OE2-NZ 2.97Å
605	K	38.7	Very low	44.5	Very low	181 Å²	181	111.1 Å²	111.1	79%	0.787	56%	0.558	S	S	*	*	H	α-helix	trans	-72.9	-41.7	176.4	-83.5	-176.2	177	178.2	0	112.8	S603 E609	S603-K605 PolarHBondContact O-N 2.95Å; K605-E609 PolarHBondContact O-N 3Å
606	Q	36.1	Very low	46.9	Very low	150 Å²	150	103.6 Å²	103.6	70%	0.701	52%	0.517	S	S	*	.	H	α-helix	trans	-72.2	-35.8	176.5	-80	-176.6	-15.8	0	0	111.9	S603 V610	S603-Q606 PolarHBondContact O-N 2.72Å; Q606-V610 WeakPolarHBondContact O-CG2 3.1Å; Q606-V610 PolarHBondContact O-N 2.77Å
607	F	36.7	Very low	49.3	Very low	156 Å²	156	97 Å²	97	68%	0.684	48%	0.482	S	S	*	.	H	α-helix	trans	-66.8	-35.6	175.5	-95.7	-93.9	0	0	0	112.7	S603 D611	S603-F607 WeakPolarHBondContact O-CB 3.38Å; S603-F607 WeakPolarHBondContact O-CD2 3.16Å; S603-F607 PolarHBondContact O-N 2.77Å; F607-D611 PolarHBondContact O-N 3.36Å
608	K	47.9	Very low	51.8	Low	84 Å²	84	91.8 Å²	91.8	37%	0.365	45%	0.454	S	S	.	.	H	α-helix	trans	-62.7	-46.3	177.3	-81.8	170	-177.8	164.1	0	112.8	E604 V610 C612	E604-K608 WeakPolarHBondContact O-CB 3.36Å; E604-K608 WeakPolarHBondContact O-CD 3.35Å; E604-K608 WeakPolarHBondContact O-CG 3.34Å; E604-K608 PolarHBondContact O-N 3.41Å; E604-K608 VanDerWaalsContact O-N 3.11Å; E604-K608 IonicContact OE2-NZ 2.88Å; E604-K608 PolarHBondContact OE2-NZ 2.97Å; K608-V610 PolarHBondContact O-N 3.34Å; K608-C612 VanDerWaalsContact O-CB 3.3Å; K608-C612 WeakPolarHBondContact O-CB 2.9Å; K608-C612 PolarHBondContact O-N 3.11Å; K608-C612 PolarHBondContact O-SG 2.92Å
609	E	50.4	Low	54.5	Low	113 Å²	113	84.4 Å²	84.4	53%	0.528	42%	0.415	S	S	.	.	H	α-helix	trans	-66.3	-38.1	-179.3	-81.8	-167.9	149.4	0	0	113.3	K605 R613	K605-E609 PolarHBondContact O-N 3Å; E609-R613 WeakPolarHBondContact O-CB 3.14Å; E609-R613 PolarHBondContact O-N 3.18Å; E609-R613 VanDerWaalsContact O-N 3.07Å
610	V	53.8	Low	57.5	Low	91 Å²	91	74 Å²	74	55%	0.552	37%	0.374	S	S	*	.	H	α-helix	trans	-68.4	-41.6	-175.7	177.6	0	0	0	0	111.5	Q606 K608 W614	Q606-V610 WeakPolarHBondContact O-CG2 3.1Å; Q606-V610 PolarHBondContact O-N 2.77Å; K608-V610 PolarHBondContact O-N 3.34Å; V610-W614 PolarHBondContact O-NE1 3.23Å
611	D	62.5	Low	60.3	Low	56 Å²	56	68.8 Å²	68.8	30%	0.299	35%	0.347	S	S	.	.	H	α-helix	trans	-77.3	-34.5	179.4	-127.5	-1.1	0	0	0	112.3	F607 R613 W614 R708	F607-D611 PolarHBondContact O-N 3.36Å; D611-R613 PolarHBondContact O-N 3.41Å; D611-W614 PolarHBondContact O-N 3.17Å; D611-R708 VanDerWaalsContact CG-NH1 3.26Å; D611-R708 IonicContact OD1-NH1 2.69Å; D611-R708 PolarHBondContact OD1-NH1 3.28Å; D611-R708 IonicContact OD2-NH1 3.27Å; D611-R708 PolarHBondContact OD2-NH1 2.97Å
612	C	70.8	Confident	63	Low	12 Å²	12	66.5 Å²	66.5	8%	0.081	32%	0.319	C	S	.	.	H	α-helix	trans	-58.6	-44	172.8	-81.9	0	0	0	0	112.9	Y555 C583 K608 W614 K615	Y555-C612 HydrophobicContact CD1-CB 3.92Å; Y555-C612 HydrophobicContact CD2-CB 4Å; Y555-C612 HydrophobicContact CE1-CB 3.79Å; Y555-C612 HydrophobicContact CE2-CB 3.88Å; Y555-C612 WeakPolarHBondContact CE2-O 3.26Å; Y555-C612 HydrophobicContact CG-CB 4.03Å; C583-C612 HydrophobicContact CB-CB 4.19Å; C583-C612 WeakPolarHBondContact CB-SG 3.49Å; C583-C612 WeakPolarHBondContact SG-CA 2.96Å; C583-C612 WeakPolarHBondContact SG-CB 3.24Å; C583-C612 CovalentContact SG-SG 2.02Å; C583-C612 PolarHBondContact SG-SG 2.73Å; K608-C612 VanDerWaalsContact O-CB 3.3Å; K608-C612 WeakPolarHBondContact O-CB 2.9Å; K608-C612 PolarHBondContact O-N 3.11Å; K608-C612 PolarHBondContact O-SG 2.92Å; C612-W614 PolarHBondContact O-N 2.83Å; C612-W614 VanDerWaalsContact O-N 3.16Å; C612-K615 WeakPolarHBondContact O-CB 3.22Å; C612-K615 PolarHBondContact O-N 3.37Å
613	R	69.2	Low	65.7	Low	102 Å²	102	59.4 Å²	59.4	39%	0.385	28%	0.282	S	S	.	.	H	α-helix	trans	-57.2	-33.9	-176.9	-173.9	175.1	-178.5	179.5	-0.1	112.1	H551 E609 D611 K615 V616	H551-R613 PolarHBondContact O-NH2 2.85Å; E609-R613 WeakPolarHBondContact O-CB 3.14Å; E609-R613 PolarHBondContact O-N 3.18Å; E609-R613 VanDerWaalsContact O-N 3.07Å; D611-R613 PolarHBondContact O-N 3.41Å; R613-K615 VanDerWaalsContact C-N 3.33Å; R613-V616 WeakPolarHBondContact O-CB 3.41Å; R613-V616 VanDerWaalsContact O-CG2 3.31Å; R613-V616 WeakPolarHBondContact O-CG2 3.37Å
614	W	68.5	Low	68.2	Low	52 Å²	52	57.3 Å²	57.3	20%	0.197	27%	0.267	C	S	.	.	H	α-helix	trans	-71.2	-27.2	176.8	-64.3	126.4	0	0	0	112	V610 D611 C612 V616 K709 Q712	V610-W614 PolarHBondContact O-NE1 3.23Å; D611-W614 PolarHBondContact O-N 3.17Å; C612-W614 PolarHBondContact O-N 2.83Å; C612-W614 VanDerWaalsContact O-N 3.16Å; W614-V616 VanDerWaalsContact C-N 3.3Å; W614-V616 PolarHBondContact O-N 2.78Å; W614-K709 HydrophobicContact CH2-CB 3.27Å; W614-K709 HydrophobicContact CH2-CD 3.62Å; W614-K709 HydrophobicContact CH2-CG 3.25Å; W614-K709 HydrophobicContact CZ2-CB 3.65Å; W614-K709 HydrophobicContact CZ2-CD 4.39Å; W614-K709 HydrophobicContact CZ2-CG 4.12Å; W614-K709 HydrophobicContact CZ3-CB 3.8Å; W614-K709 HydrophobicContact CZ3-CD 4.42Å; W614-K709 HydrophobicContact CZ3-CG 3.68Å; W614-Q712 VanDerWaalsContact C-NE2 3.27Å; W614-Q712 VanDerWaalsContact C-OE1 3.24Å; W614-Q712 VanDerWaalsContact CB-CD 3.43Å; W614-Q712 HydrophobicContact CE3-CB 4.4Å; W614-Q712 HydrophobicContact CE3-CG 4.47Å; W614-Q712 PolarHBondContact O-NE2 3.29Å; W614-Q712 PolarHBondContact O-OE1 2.87Å
615	K	80.7	Confident	70.8	Confident	36 Å²	36	53.4 Å²	53.4	16%	0.157	25%	0.249	C	C	.	.	H	α-helix	trans	-79.9	-10	-179.5	-59.9	-72.3	-175.4	171.3	0	113.8	Y582 D586 C612 R613 L617 D618 I619	Y582-K615 WeakPolarHBondContact O-CG 3.29Å; D586-K615 IonicContact OD1-NZ 3.24Å; D586-K615 WeakPolarHBondContact OD2-CE 3.48Å; D586-K615 IonicContact OD2-NZ 3.99Å; D586-K615 PolarHBondContact OD2-NZ 2.69Å; C612-K615 WeakPolarHBondContact O-CB 3.22Å; C612-K615 PolarHBondContact O-N 3.37Å; R613-K615 VanDerWaalsContact C-N 3.33Å; K615-L617 VanDerWaalsContact C-N 3.28Å; K615-L617 PolarHBondContact O-N 3.3Å; K615-D618 WeakPolarHBondContact O-CB 3.5Å; K615-D618 PolarHBondContact O-N 3.41Å; K615-I619 WeakPolarHBondContact O-CG1 3.36Å; K615-I619 PolarHBondContact O-N 2.75Å
616	V	83.4	Confident	73.2	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-52.4	-45.8	179.4	170.6	0	0	0	0	112.5	Y544 Y555 L558 R613 W614 D618 I619 L620	Y544-V616 HydrophobicContact CD2-CG1 3.98Å; Y544-V616 HydrophobicContact CE2-CB 4.41Å; Y544-V616 HydrophobicContact CE2-CG1 3.51Å; Y555-V616 HydrophobicContact CD2-CG2 3.37Å; Y555-V616 HydrophobicContact CE2-CG2 3.66Å; L558-V616 HydrophobicContact CD2-CB 4.32Å; L558-V616 HydrophobicContact CD2-CG1 3.26Å; L558-V616 HydrophobicContact CD2-CG2 4.08Å; L558-V616 HydrophobicContact CG-CG1 4.42Å; R613-V616 WeakPolarHBondContact O-CB 3.41Å; R613-V616 VanDerWaalsContact O-CG2 3.31Å; R613-V616 WeakPolarHBondContact O-CG2 3.37Å; W614-V616 VanDerWaalsContact C-N 3.3Å; W614-V616 PolarHBondContact O-N 2.78Å; V616-D618 PolarHBondContact O-N 3.38Å; V616-I619 WeakPolarHBondContact O-CB 3.28Å; V616-I619 PolarHBondContact O-N 3Å; V616-L620 HydrophobicContact CG1-CD1 3.82Å; V616-L620 HydrophobicContact CG1-CG 4.29Å; V616-L620 WeakPolarHBondContact O-CG 3.37Å; V616-L620 PolarHBondContact O-N 3.41Å
617	L	81.8	Confident	75.7	Confident	6 Å²	6	38.5 Å²	38.5	3%	0.031	18%	0.183	C	C	.	.	H	α-helix	trans	-64.9	-32.4	-178.4	-175.6	58.6	0	0	0	111.9	A538 A540 K615 S621 K715	A538-L617 HydrophobicContact CB-CD1 4.33Å; A538-L617 HydrophobicContact CB-CD2 3.76Å; A538-L617 HydrophobicContact CB-CG 3.91Å; A540-L617 HydrophobicContact CB-CD1 4.16Å; K615-L617 VanDerWaalsContact C-N 3.28Å; K615-L617 PolarHBondContact O-N 3.3Å; L617-S621 WeakPolarHBondContact O-CB 3.43Å; L617-S621 PolarHBondContact O-N 2.69Å; L617-S621 PolarHBondContact O-OG 3.26Å; L617-K715 HydrophobicContact CD2-CD 4.35Å
618	D	84.5	Confident	78.2	Confident	38 Å²	38	31.2 Å²	31.2	20%	0.203	15%	0.152	C	C	.	.	H	α-helix	trans	-71.8	-43.1	174.1	-64.2	-28.5	0	0	0	111	Y582 K615 V616 L620 S621 D622 K715	Y582-D618 HydrophobicContact CD1-CB 4.46Å; Y582-D618 HydrophobicContact CE1-CB 4.28Å; K615-D618 WeakPolarHBondContact O-CB 3.5Å; K615-D618 PolarHBondContact O-N 3.41Å; V616-D618 PolarHBondContact O-N 3.38Å; D618-L620 PolarHBondContact O-N 3.12Å; D618-S621 PolarHBondContact O-N 3.4Å; D618-D622 WeakPolarHBondContact O-CB 3.37Å; D618-D622 VanDerWaalsContact O-CG 3.23Å; D618-D622 PolarHBondContact O-N 2.94Å; D618-K715 IonicContact OD1-NZ 2.87Å; D618-K715 PolarHBondContact OD1-NZ 2.81Å; D618-K715 IonicContact OD2-NZ 3.67Å; D618-K715 PolarHBondContact OD2-NZ 3.03Å; D618-K715 VanDerWaalsContact OD2-NZ 3.12Å
619	I	88.3	Confident	80.2	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-56.8	-49.6	175.4	-65.7	167.1	0	0	0	110.4	Y555 I559 L562 I578 Y582 K615 V616 G623 W839	Y555-I619 HydrophobicContact CE2-CD1 4.2Å; I559-I619 HydrophobicContact CD1-CD1 3.73Å; I559-I619 HydrophobicContact CD1-CG2 4.18Å; L562-I619 HydrophobicContact CD1-CG2 4.44Å; I578-I619 HydrophobicContact CG2-CD1 3.88Å; I578-I619 HydrophobicContact CG2-CG1 4.27Å; I578-I619 HydrophobicContact CG2-CG2 3.98Å; Y582-I619 HydrophobicContact CD1-CB 4.48Å; Y582-I619 HydrophobicContact CD1-CD1 4.31Å; Y582-I619 HydrophobicContact CD1-CG1 3.37Å; Y582-I619 HydrophobicContact CD2-CD1 4.36Å; Y582-I619 HydrophobicContact CD2-CG1 3.73Å; Y582-I619 HydrophobicContact CE1-CB 4.46Å; Y582-I619 HydrophobicContact CE1-CG1 3.78Å; Y582-I619 HydrophobicContact CE2-CG1 4.1Å; Y582-I619 HydrophobicContact CG-CD1 3.92Å; Y582-I619 HydrophobicContact CG-CG1 3.35Å; K615-I619 WeakPolarHBondContact O-CG1 3.36Å; K615-I619 PolarHBondContact O-N 2.75Å; V616-I619 WeakPolarHBondContact O-CB 3.28Å; V616-I619 PolarHBondContact O-N 3Å; I619-G623 PolarHBondContact O-N 3.28Å; I619-G623 VanDerWaalsContact O-N 3.07Å; I619-W839 HydrophobicContact CG2-CH2 4.18Å; I619-W839 HydrophobicContact CG2-CZ2 3.87Å; I619-W839 WeakPolarHBondContact O-CZ2 2.98Å
620	L	88.5	Confident	81.9	Confident	3 Å²	3	22.7 Å²	22.7	2%	0.016	11%	0.114	C	C	.	.	H	α-helix	trans	-65.7	-44.3	179.2	-68.5	172.4	0	0	0	111.7	L454 A540 Y544 L562 V616 D618 L624	L454-L620 HydrophobicContact CD2-CD2 3.74Å; A540-L620 HydrophobicContact CB-CB 3.55Å; Y544-L620 HydrophobicContact CD2-CD1 3.77Å; Y544-L620 HydrophobicContact CG-CD1 4.39Å; L562-L620 HydrophobicContact CD1-CD2 3.34Å; L562-L620 HydrophobicContact CD1-CG 4.42Å; V616-L620 HydrophobicContact CG1-CD1 3.82Å; V616-L620 HydrophobicContact CG1-CG 4.29Å; V616-L620 WeakPolarHBondContact O-CG 3.37Å; V616-L620 PolarHBondContact O-N 3.41Å; D618-L620 PolarHBondContact O-N 3.12Å; L620-L624 HydrophobicContact CB-CD1 4.32Å; L620-L624 HydrophobicContact CD2-CD1 3.88Å; L620-L624 WeakPolarHBondContact O-CB 3.3Å; L620-L624 VanDerWaalsContact O-CG 3.32Å; L620-L624 WeakPolarHBondContact O-CG 3.34Å; L620-L624 PolarHBondContact O-N 2.55Å
621	S	90.4	Very high	83.3	Confident	2 Å²	2	21.8 Å²	21.8	1%	0.014	10%	0.104	C	C	.	.	H	α-helix	trans	-64.2	-43.5	-179.7	-62.6	0	0	0	0	111.8	A538 A540 L617 D618 Y625 T626	A538-S621 WeakPolarHBondContact CA-OG 3.39Å; A540-S621 PolarHBondContact N-OG 3.35Å; L617-S621 WeakPolarHBondContact O-CB 3.43Å; L617-S621 PolarHBondContact O-N 2.69Å; L617-S621 PolarHBondContact O-OG 3.26Å; D618-S621 PolarHBondContact O-N 3.4Å; S621-Y625 WeakPolarHBondContact O-CB 3.12Å; S621-Y625 PolarHBondContact O-N 2.93Å; S621-Y625 VanDerWaalsContact O-N 3.1Å; S621-T626 PolarHBondContact O-N 3.4Å; S621-T626 PolarHBondContact O-OG1 3.33Å
622	D	89.5	Confident	84.6	Confident	23 Å²	23	19.1 Å²	19.1	12%	0.123	9%	0.089	C	C	.	.	I	π-helix	trans	-64.6	-52.2	178.9	-72.3	-11.8	0	0	0	111.6	Y582 D618 V627 H836	Y582-D622 WeakPolarHBondContact CE1-OD2 3.25Å; Y582-D622 VanDerWaalsContact OH-CB 3.31Å; Y582-D622 WeakPolarHBondContact OH-CB 3.37Å; Y582-D622 PolarHBondContact OH-OD2 3.29Å; D618-D622 WeakPolarHBondContact O-CB 3.37Å; D618-D622 VanDerWaalsContact O-CG 3.23Å; D618-D622 PolarHBondContact O-N 2.94Å; D622-V627 VanDerWaalsContact O-CB 3.3Å; D622-V627 WeakPolarHBondContact O-CB 3.5Å; D622-V627 VanDerWaalsContact O-CG2 3.23Å; D622-V627 WeakPolarHBondContact O-CG2 3.2Å; D622-V627 PolarHBondContact O-N 3.06Å; D622-H836 IonicContact OD1-CD2 3.26Å; D622-H836 IonicContact OD1-NE2 3.72Å
623	G	86	Confident	85.4	Confident	6 Å²	6	18.6 Å²	18.6	6%	0.062	9%	0.085	C	C	.	.	I	π-helix	trans	-72.5	-32.8	-174.3	0	0	0	0	0	114.5	I619	I619-G623 PolarHBondContact O-N 3.28Å; I619-G623 VanDerWaalsContact O-N 3.07Å
624	L	88	Confident	86	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.005	9%	0.085	C	C	.	.	I	π-helix	trans	-102.1	-19.9	-172.3	-56.1	174.7	0	0	0	114.2	A341 P342 W343 L454 L543 M566 L620	A341-L624 WeakPolarHBondContact CB-O 3.47Å; P342-L624 HydrophobicContact CB-CD2 4.34Å; P342-L624 HydrophobicContact CG-CD2 4.08Å; W343-L624 PolarHBondContact NE1-O 3.06Å; L454-L624 HydrophobicContact CD2-CD1 3.87Å; L543-L624 HydrophobicContact CD2-CD1 3.72Å; M566-L624 HydrophobicContact CE-CD2 4.19Å; M566-L624 HydrophobicContact SD-CD2 3.99Å; L620-L624 HydrophobicContact CB-CD1 4.32Å; L620-L624 HydrophobicContact CD2-CD1 3.88Å; L620-L624 WeakPolarHBondContact O-CB 3.3Å; L620-L624 VanDerWaalsContact O-CG 3.32Å; L620-L624 WeakPolarHBondContact O-CG 3.34Å; L620-L624 PolarHBondContact O-N 2.55Å
625	Y	90.3	Very high	86.5	Confident	8 Å²	8	18.2 Å²	18.2	3%	0.031	9%	0.09	C	C	.	.	I	π-helix	trans	-131	-63	-174.9	-66	-93.7	0	0	0	112.2	N336 W343 P539 A540 S621 V627 P628 I629 F718	N336-Y625 WeakPolarHBondContact O-CD1 3.02Å; N336-Y625 WeakPolarHBondContact O-CE1 3.37Å; W343-Y625 AromaticContact CE2-CE1 3.78Å; W343-Y625 AromaticContact CE2-CZ 3.93Å; W343-Y625 HydrophobicContact CH2-CE1 4.23Å; W343-Y625 AromaticContact CZ2-CD1 3.7Å; W343-Y625 HydrophobicContact CZ2-CD1 3.7Å; W343-Y625 AromaticContact CZ2-CE1 3.35Å; W343-Y625 HydrophobicContact CZ2-CE1 3.35Å; W343-Y625 AromaticContact CZ2-CZ 3.98Å; W343-Y625 AromaticContact NE1-CE1 3.91Å; W343-Y625 AromaticContact NE1-CE2 3.88Å; W343-Y625 AromaticContact NE1-CZ 3.7Å; P539-Y625 HydrophobicContact CB-CD1 3.82Å; P539-Y625 HydrophobicContact CB-CD2 4.11Å; P539-Y625 HydrophobicContact CB-CE1 4.34Å; P539-Y625 HydrophobicContact CB-CG 3.7Å; P539-Y625 VanDerWaalsContact CG-CB 3.43Å; P539-Y625 HydrophobicContact CG-CD1 4.28Å; P539-Y625 HydrophobicContact CG-CD2 4.03Å; P539-Y625 HydrophobicContact CG-CG 3.67Å; A540-Y625 HydrophobicContact CB-CD2 4.13Å; A540-Y625 HydrophobicContact CB-CE2 3.92Å; S621-Y625 WeakPolarHBondContact O-CB 3.12Å; S621-Y625 PolarHBondContact O-N 2.93Å; S621-Y625 VanDerWaalsContact O-N 3.1Å; Y625-V627 PolarHBondContact O-N 2.91Å; Y625-P628 WeakPolarHBondContact O-CD 3.47Å; Y625-I629 WeakPolarHBondContact O-CB 3.45Å; Y625-I629 WeakPolarHBondContact O-CD1 3.42Å; Y625-I629 VanDerWaalsContact O-CG1 3.29Å; Y625-I629 WeakPolarHBondContact O-CG1 3.18Å; Y625-I629 PolarHBondContact O-N 3.46Å; Y625-F718 HydrophobicContact CE1-CD2 4.18Å; Y625-F718 AromaticContact CE1-CE2 3.96Å; Y625-F718 HydrophobicContact CE1-CE2 3.96Å
626	T	90.3	Very high	86.7	Confident	12 Å²	12	16.9 Å²	16.9	7%	0.074	8%	0.084	C	C	.	.	I	π-helix	trans	-61.7	-49.1	-169.8	-56.9	0	0	0	0	111.2	S621 I629 I630	S621-T626 PolarHBondContact O-N 3.4Å; S621-T626 PolarHBondContact O-OG1 3.33Å; T626-I629 WeakPolarHBondContact O-CB 3.09Å; T626-I629 PolarHBondContact O-N 3.35Å; T626-I630 HydrophobicContact CG2-CD1 4Å; T626-I630 HydrophobicContact CG2-CG1 4.46Å; T626-I630 VanDerWaalsContact O-CG1 3.24Å; T626-I630 WeakPolarHBondContact O-CG1 3.4Å; T626-I630 PolarHBondContact O-N 3.06Å
627	V	88.4	Confident	86.7	Confident	6 Å²	6	17 Å²	17	4%	0.036	9%	0.085	C	C	.	.	H	α-helix	trans	-64.4	-46.6	179.9	172	0	0	0	0	112.4	D622 Y625 I629 I630 Q631 H836 W839	D622-V627 VanDerWaalsContact O-CB 3.3Å; D622-V627 WeakPolarHBondContact O-CB 3.5Å; D622-V627 VanDerWaalsContact O-CG2 3.23Å; D622-V627 WeakPolarHBondContact O-CG2 3.2Å; D622-V627 PolarHBondContact O-N 3.06Å; Y625-V627 PolarHBondContact O-N 2.91Å; V627-I629 VanDerWaalsContact C-N 3.3Å; V627-I629 PolarHBondContact O-N 2.74Å; V627-I630 PolarHBondContact O-N 2.8Å; V627-Q631 WeakPolarHBondContact O-CG 3.34Å; V627-Q631 PolarHBondContact O-N 2.71Å; V627-H836 HydrophobicContact CG2-CB 3.98Å; V627-W839 HydrophobicContact CB-CB 4.18Å; V627-W839 HydrophobicContact CG1-CB 3.93Å; V627-W839 HydrophobicContact CG2-CB 3.8Å; V627-W839 HydrophobicContact CG2-CG 4.2Å
628	P	88.9	Confident	85.9	Confident	4 Å²	4	18.5 Å²	18.5	3%	0.026	9%	0.093	C	C	.	.	H	α-helix	trans	-55.4	-38.6	170.6	-30.1	35.6	0	0	0	114.9	F340 A341 Y625 Q631 T632	F340-P628 HydrophobicContact CB-CB 4.3Å; A341-P628 HydrophobicContact CB-CB 4.14Å; A341-P628 HydrophobicContact CB-CG 4.21Å; Y625-P628 WeakPolarHBondContact O-CD 3.47Å; P628-Q631 PolarHBondContact O-N 3.31Å; P628-T632 PolarHBondContact O-N 3.27Å; P628-T632 PolarHBondContact O-OG1 3.27Å
629	I	90.2	Very high	84.4	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.5	-44.6	175.6	-76.4	158.4	0	0	0	111	I533 W535 Y625 T626 V627 Q631 T632 L633	I533-I629 HydrophobicContact CD1-CB 4.27Å; I533-I629 HydrophobicContact CD1-CG1 4.15Å; I533-I629 HydrophobicContact CD1-CG2 3.78Å; I533-I629 HydrophobicContact CG1-CG2 3.98Å; W535-I629 HydrophobicContact CB-CD1 3.56Å; W535-I629 HydrophobicContact CD2-CG2 4.06Å; W535-I629 HydrophobicContact CE3-CG2 3.62Å; W535-I629 HydrophobicContact CG-CD1 4.12Å; W535-I629 HydrophobicContact CZ3-CG2 4.04Å; Y625-I629 WeakPolarHBondContact O-CB 3.45Å; Y625-I629 WeakPolarHBondContact O-CD1 3.42Å; Y625-I629 VanDerWaalsContact O-CG1 3.29Å; Y625-I629 WeakPolarHBondContact O-CG1 3.18Å; Y625-I629 PolarHBondContact O-N 3.46Å; T626-I629 WeakPolarHBondContact O-CB 3.09Å; T626-I629 PolarHBondContact O-N 3.35Å; V627-I629 VanDerWaalsContact C-N 3.3Å; V627-I629 PolarHBondContact O-N 2.74Å; I629-Q631 VanDerWaalsContact C-N 3.3Å; I629-Q631 PolarHBondContact O-N 2.99Å; I629-T632 WeakPolarHBondContact O-CB 3.24Å; I629-T632 PolarHBondContact O-N 2.88Å; I629-T632 VanDerWaalsContact O-N 3.12Å; I629-L633 HydrophobicContact CG2-CD1 4.33Å; I629-L633 PolarHBondContact O-N 3.02Å
630	I	85.8	Confident	82.4	Confident	17 Å²	17	23.7 Å²	23.7	9%	0.087	11%	0.111	C	C	.	.	H	α-helix	trans	-60.5	-41.1	175.5	-64.3	176	0	0	0	110.8	T626 V627 T632 L633 K634 L830	T626-I630 HydrophobicContact CG2-CD1 4Å; T626-I630 HydrophobicContact CG2-CG1 4.46Å; T626-I630 VanDerWaalsContact O-CG1 3.24Å; T626-I630 WeakPolarHBondContact O-CG1 3.4Å; T626-I630 PolarHBondContact O-N 3.06Å; V627-I630 PolarHBondContact O-N 2.8Å; I630-T632 VanDerWaalsContact C-N 3.32Å; I630-T632 PolarHBondContact O-N 3.24Å; I630-L633 PolarHBondContact O-N 2.96Å; I630-K634 WeakPolarHBondContact O-CB 3.35Å; I630-K634 PolarHBondContact O-N 3.26Å; I630-L830 HydrophobicContact CD1-CD1 4.24Å; I630-L830 HydrophobicContact CD1-CD2 4.13Å; I630-L830 HydrophobicContact CD1-CG 4.47Å; I630-L830 HydrophobicContact CG1-CD2 3.78Å; I630-L830 HydrophobicContact CG2-CD2 4.41Å
631	Q	84.2	Confident	80.1	Confident	73 Å²	73	27.6 Å²	27.6	34%	0.341	14%	0.136	S	C	.	.	H	α-helix	trans	-63.3	-38.4	175.3	-72.1	174.3	-17.5	0	0	112.1	F340 V627 P628 I629 K634 M635	F340-Q631 HydrophobicContact CD2-CB 4.36Å; V627-Q631 WeakPolarHBondContact O-CG 3.34Å; V627-Q631 PolarHBondContact O-N 2.71Å; P628-Q631 PolarHBondContact O-N 3.31Å; I629-Q631 VanDerWaalsContact C-N 3.3Å; I629-Q631 PolarHBondContact O-N 2.99Å; Q631-K634 PolarHBondContact O-N 2.97Å; Q631-M635 WeakPolarHBondContact O-CB 3.38Å; Q631-M635 PolarHBondContact O-N 3.28Å
632	T	88.2	Confident	77.8	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-65.1	-47.9	176.5	-52.1	0	0	0	0	111.3	H313 L334 S338 F340 F526 I533 P628 I629 I630 K634 M635 H636	H313-T632 WeakPolarHBondContact CE1-CG2 3.49Å; L334-T632 HydrophobicContact CD1-CG2 4.3Å; S338-T632 WeakPolarHBondContact CB-OG1 3.43Å; S338-T632 PolarHBondContact OG-OG1 3.34Å; F340-T632 WeakPolarHBondContact CD2-OG1 3.37Å; F526-T632 HydrophobicContact CE2-CG2 4.18Å; F526-T632 HydrophobicContact CZ-CG2 3.92Å; I533-T632 HydrophobicContact CD1-CG2 3.94Å; P628-T632 PolarHBondContact O-N 3.27Å; P628-T632 PolarHBondContact O-OG1 3.27Å; I629-T632 WeakPolarHBondContact O-CB 3.24Å; I629-T632 PolarHBondContact O-N 2.88Å; I629-T632 VanDerWaalsContact O-N 3.12Å; I630-T632 VanDerWaalsContact C-N 3.32Å; I630-T632 PolarHBondContact O-N 3.24Å; T632-K634 VanDerWaalsContact C-N 3.32Å; T632-K634 PolarHBondContact O-N 2.99Å; T632-M635 PolarHBondContact O-N 3.17Å; T632-H636 PolarHBondContact O-N 3.21Å
633	L	88.4	Confident	75.4	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-56.1	-47	174.4	-83.7	170.9	0	0	0	111.7	I533 W535 I629 I630 S637 T687 A689 Y786 L830	I533-L633 HydrophobicContact CG2-CD1 4.04Å; I533-L633 HydrophobicContact CG2-CD2 3.23Å; I533-L633 HydrophobicContact CG2-CG 3.55Å; W535-L633 HydrophobicContact CH2-CD1 4.36Å; W535-L633 HydrophobicContact CZ3-CD1 4.13Å; I629-L633 HydrophobicContact CG2-CD1 4.33Å; I629-L633 PolarHBondContact O-N 3.02Å; I630-L633 PolarHBondContact O-N 2.96Å; L633-S637 WeakPolarHBondContact O-CB 3.18Å; L633-S637 PolarHBondContact O-N 2.74Å; L633-S637 PolarHBondContact O-OG 2.95Å; L633-T687 HydrophobicContact CD2-CG2 3.7Å; L633-A689 HydrophobicContact CD1-CB 4.06Å; L633-A689 HydrophobicContact CD2-CB 4.02Å; L633-Y786 HydrophobicContact CB-CD1 4.3Å; L633-Y786 HydrophobicContact CB-CE1 3.79Å; L633-Y786 HydrophobicContact CD1-CD2 4.39Å; L633-Y786 HydrophobicContact CD1-CE2 4.01Å; L633-Y786 HydrophobicContact CD2-CD1 3.87Å; L633-Y786 HydrophobicContact CD2-CD2 4.26Å; L633-Y786 HydrophobicContact CD2-CE1 4.17Å; L633-Y786 HydrophobicContact CD2-CG 3.93Å; L633-Y786 HydrophobicContact CG-CE1 4.41Å; L633-L830 HydrophobicContact CD1-CD2 4.4Å
634	K	81	Confident	73.2	Confident	85 Å²	85	32.9 Å²	32.9	37%	0.37	16%	0.158	S	C	.	.	H	α-helix	trans	-59.9	-49.6	176.8	-175.1	171.9	-177.9	164.6	0	110.7	I630 Q631 T632 H636 S637 D638 Y788	I630-K634 WeakPolarHBondContact O-CB 3.35Å; I630-K634 PolarHBondContact O-N 3.26Å; Q631-K634 PolarHBondContact O-N 2.97Å; T632-K634 VanDerWaalsContact C-N 3.32Å; T632-K634 PolarHBondContact O-N 2.99Å; K634-H636 PolarHBondContact O-N 3.38Å; K634-S637 PolarHBondContact O-N 3.14Å; K634-S637 PolarHBondContact O-OG 2.74Å; K634-D638 WeakPolarHBondContact CE-OD2 3.33Å; K634-D638 HydrophobicContact CG-CB 4.4Å; K634-D638 WeakPolarHBondContact CG-OD2 3.22Å; K634-D638 VanDerWaalsContact O-CB 3.25Å; K634-D638 WeakPolarHBondContact O-CB 3.4Å; K634-D638 PolarHBondContact O-N 3.02Å; K634-Y788 HydrophobicContact CD-CD2 4.13Å; K634-Y788 HydrophobicContact CD-CE2 3.67Å; K634-Y788 VanDerWaalsContact CE-CE2 3.44Å; K634-Y788 HydrophobicContact CG-CD2 3.91Å; K634-Y788 HydrophobicContact CG-CE2 3.99Å; K634-Y788 PolarHBondContact NZ-OH 2.98Å; K634-Y788 VanDerWaalsContact NZ-OH 3.12Å
635	M	80	Confident	70.7	Confident	62 Å²	62	39 Å²	39	31%	0.305	19%	0.187	S	C	.	.	H	α-helix	trans	-61.3	-41	-177.7	-175.8	169.4	169.4	0	0	113.3	L317 F340 I521 F526 Q631 T632	L317-M635 HydrophobicContact CD2-CE 4.37Å; F340-M635 HydrophobicContact CE2-CB 4.5Å; F340-M635 HydrophobicContact CE2-SD 3.79Å; F340-M635 HydrophobicContact CZ-SD 3.42Å; F340-M635 WeakPolarHBondContact CZ-SD 3.46Å; I521-M635 HydrophobicContact CG2-CE 4.01Å; F526-M635 HydrophobicContact CE1-CG 4.21Å; Q631-M635 WeakPolarHBondContact O-CB 3.38Å; Q631-M635 PolarHBondContact O-N 3.28Å; T632-M635 PolarHBondContact O-N 3.17Å
636	H	85.9	Confident	68.3	Low	8 Å²	8	40.4 Å²	40.4	4%	0.037	20%	0.195	C	C	.	.	H	α-helix	trans	-73.4	-36.8	179.5	-166.2	-92.6	0	0	0	112.7	F526 T529 L531 T632 K634 T687	F526-H636 HydrophobicContact CE1-CB 3.88Å; F526-H636 AromaticContact CE1-CD2 3.84Å; F526-H636 AromaticContact CE2-CD2 3.94Å; F526-H636 HydrophobicContact CZ-CB 3.66Å; F526-H636 AromaticContact CZ-CD2 3.76Å; F526-H636 PolarHBondContact O-CD2 2.91Å; F526-H636 VanDerWaalsContact O-CD2 3.25Å; F526-H636 PolarHBondContact O-NE2 3.07Å; T529-H636 PolarHBondContact O-CE1 3.21Å; T529-H636 PolarHBondContact O-NE2 2.8Å; L531-H636 VanDerWaalsContact CB-CE1 3.47Å; L531-H636 WeakPolarHBondContact CB-CE1 3.43Å; L531-H636 HydrophobicContact CD2-CB 3.61Å; L531-H636 VanDerWaalsContact CD2-CG 3.5Å; T632-H636 PolarHBondContact O-N 3.21Å; K634-H636 PolarHBondContact O-N 3.38Å; H636-T687 PolarHBondContact ND1-OG1 2.81Å
637	S	81.4	Confident	65.8	Low	3 Å²	3	44.2 Å²	44.2	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-84.4	-30.4	-177.7	61.5	0	0	0	0	114.7	L633 K634 F639	L633-S637 WeakPolarHBondContact O-CB 3.18Å; L633-S637 PolarHBondContact O-N 2.74Å; L633-S637 PolarHBondContact O-OG 2.95Å; K634-S637 PolarHBondContact O-N 3.14Å; K634-S637 PolarHBondContact O-OG 2.74Å; S637-F639 PolarHBondContact O-N 3.16Å
638	D	64.9	Low	63.2	Low	37 Å²	37	50.2 Å²	50.2	20%	0.198	24%	0.237	C	C	.	.			trans	-93	53.1	-175.2	-92.5	-19.2	0	0	0	114.2	K634 Y640 Y788	K634-D638 WeakPolarHBondContact CE-OD2 3.33Å; K634-D638 HydrophobicContact CG-CB 4.4Å; K634-D638 WeakPolarHBondContact CG-OD2 3.22Å; K634-D638 VanDerWaalsContact O-CB 3.25Å; K634-D638 WeakPolarHBondContact O-CB 3.4Å; K634-D638 PolarHBondContact O-N 3.02Å; D638-Y640 PolarHBondContact O-N 3.17Å; D638-Y788 VanDerWaalsContact CG-CB 3.44Å; D638-Y788 VanDerWaalsContact CG-CG 3.48Å; D638-Y788 WeakPolarHBondContact OD1-CB 3.02Å; D638-Y788 VanDerWaalsContact OD1-CG 3.3Å; D638-Y788 WeakPolarHBondContact OD2-CD1 3.48Å; D638-Y788 WeakPolarHBondContact OD2-CD2 3.35Å
639	F	53.2	Low	60.4	Low	38 Å²	38	56.8 Å²	56.8	17%	0.167	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-10	167.7	-166.2	-102.5	0	0	0	113.1	E522 M527 S637 T641 S642 Y680	E522-F639 HydrophobicContact CB-CE2 3.9Å; E522-F639 HydrophobicContact CB-CZ 4.19Å; E522-F639 VanDerWaalsContact CD-CZ 3.49Å; E522-F639 HydrophobicContact CG-CE2 3.59Å; E522-F639 HydrophobicContact CG-CZ 3.89Å; E522-F639 WeakPolarHBondContact OE1-CZ 3.33Å; M527-F639 HydrophobicContact CE-CB 4.33Å; M527-F639 HydrophobicContact CE-CD2 3.72Å; M527-F639 HydrophobicContact CE-CG 4.49Å; S637-F639 PolarHBondContact O-N 3.16Å; F639-T641 VanDerWaalsContact C-N 3.27Å; F639-T641 PolarHBondContact O-N 2.91Å; F639-T641 VanDerWaalsContact O-N 3.15Å; F639-S642 PolarHBondContact O-OG 2.62Å; F639-S642 VanDerWaalsContact O-OG 3.13Å; F639-Y680 HydrophobicContact CE1-CD1 4.25Å; F639-Y680 HydrophobicContact CE2-CD1 4.36Å; F639-Y680 AromaticContact CZ-CD1 3.87Å; F639-Y680 HydrophobicContact CZ-CD1 3.87Å; F639-Y680 HydrophobicContact CZ-CE1 4.41Å; F639-Y680 HydrophobicContact CZ-CG 4.29Å
640	Y	46.7	Very low	58	Low	109 Å²	109	60.2 Å²	60.2	43%	0.427	29%	0.285	S	S	.	.	H	α-helix	trans	-67.3	-12.3	-174.8	-104.6	-94.9	0	0	0	116.2	D638 R644	D638-Y640 PolarHBondContact O-N 3.17Å; Y640-R644 WeakPolarHBondContact O-CB 3.4Å; Y640-R644 PolarHBondContact O-N 3.37Å
641	T	41.4	Very low	55.5	Low	85 Å²	85	63.4 Å²	63.4	52%	0.521	30%	0.302	S	S	.	.	H	α-helix	trans	-72.7	-31	179.1	25.3	0	0	0	0	114.4	F639 M645	F639-T641 VanDerWaalsContact C-N 3.27Å; F639-T641 PolarHBondContact O-N 2.91Å; F639-T641 VanDerWaalsContact O-N 3.15Å; T641-M645 WeakPolarHBondContact O-CB 3.26Å; T641-M645 WeakPolarHBondContact O-CG 3.41Å; T641-M645 PolarHBondContact O-N 3.33Å
642	S	41	Very low	53.2	Low	29 Å²	29	63.2 Å²	63.2	20%	0.203	31%	0.307	C	S	.	.	H	α-helix	trans	-72.6	-41.1	174.4	26.5	0	0	0	0	111.1	E522 F639 R644 M645 I646	E522-S642 PolarHBondContact OE1-OG 3.28Å; F639-S642 PolarHBondContact O-OG 2.62Å; F639-S642 VanDerWaalsContact O-OG 3.13Å; S642-R644 PolarHBondContact O-N 2.97Å; S642-M645 PolarHBondContact O-N 3.41Å; S642-I646 WeakPolarHBondContact O-CB 3.43Å; S642-I646 VanDerWaalsContact O-CG1 3.27Å; S642-I646 WeakPolarHBondContact O-CG1 3.48Å; S642-I646 PolarHBondContact O-N 2.83Å
643	Q	39.5	Very low	50.7	Low	31 Å²	31	66.3 Å²	66.3	15%	0.145	33%	0.329	C	S	.	.	H	α-helix	trans	-57.5	-47.2	172.4	-146.6	82.3	-10.3	0	0	112.3	I646 N647	Q643-I646 PolarHBondContact O-N 2.94Å; Q643-N647 VanDerWaalsContact O-CB 3.28Å; Q643-N647 WeakPolarHBondContact O-CB 3.41Å; Q643-N647 PolarHBondContact O-N 2.6Å; Q643-N647 PolarHBondContact O-ND2 3.21Å
644	R	40.3	Very low	48	Very low	83 Å²	83	71.8 Å²	71.8	31%	0.313	36%	0.358	S	S	.	.	H	α-helix	trans	-69.8	-33.6	177.6	-78.2	-174.4	179.9	154.5	7.6	112.5	Y640 S642 R648 E949	Y640-R644 WeakPolarHBondContact O-CB 3.4Å; Y640-R644 PolarHBondContact O-N 3.37Å; S642-R644 PolarHBondContact O-N 2.97Å; R644-R648 WeakPolarHBondContact O-CB 3.18Å; R644-R648 WeakPolarHBondContact O-CD 3.33Å; R644-R648 WeakPolarHBondContact O-CG 3.44Å; R644-R648 PolarHBondContact O-N 2.9Å; R644-E949 IonicContact CZ-OE1 2.6Å; R644-E949 IonicContact NE-OE1 2.85Å; R644-E949 IonicContact NH2-OE1 3.68Å; R644-E949 PolarHBondContact NH2-OE1 3.47Å; R644-E949 IonicContact NH2-OE2 2.94Å; R644-E949 PolarHBondContact NH2-OE2 2.94Å
645	M	34	Very low	45.8	Very low	128 Å²	128	72.1 Å²	72.1	63%	0.631	37%	0.371	S	S	*	.	H	α-helix	trans	-64.9	-41.7	171.8	-84.8	-173.8	-178.2	0	0	111.2	T641 S642 R648 M649	T641-M645 WeakPolarHBondContact O-CB 3.26Å; T641-M645 WeakPolarHBondContact O-CG 3.41Å; T641-M645 PolarHBondContact O-N 3.33Å; S642-M645 PolarHBondContact O-N 3.41Å; M645-R648 CarbonylContact O-C 3.55Å; M645-R648 PolarHBondContact O-N 3.04Å; M645-M649 VanDerWaalsContact O-CG 3.31Å; M645-M649 WeakPolarHBondContact O-CG 3.35Å; M645-M649 PolarHBondContact O-N 3.31Å
646	I	40.3	Very low	43.7	Very low	39 Å²	39	72.9 Å²	72.9	20%	0.2	38%	0.382	C	S	.	.	H	α-helix	trans	-72.2	-40.1	179.6	-67.4	170.9	0	0	0	111.2	S642 Q643 R648 M649 Q650 I677	S642-I646 WeakPolarHBondContact O-CB 3.43Å; S642-I646 VanDerWaalsContact O-CG1 3.27Å; S642-I646 WeakPolarHBondContact O-CG1 3.48Å; S642-I646 PolarHBondContact O-N 2.83Å; Q643-I646 PolarHBondContact O-N 2.94Å; I646-R648 VanDerWaalsContact C-N 3.29Å; I646-R648 PolarHBondContact O-N 3.4Å; I646-M649 HydrophobicContact CB-CE 4.28Å; I646-M649 HydrophobicContact CG1-CE 3.61Å; I646-M649 CarbonylContact O-C 3.18Å; I646-M649 PolarHBondContact O-N 2.9Å; I646-Q650 WeakPolarHBondContact O-CB 3.45Å; I646-Q650 VanDerWaalsContact O-CG 3.28Å; I646-Q650 WeakPolarHBondContact O-CG 3.3Å; I646-Q650 PolarHBondContact O-N 3.31Å; I646-I677 HydrophobicContact CD1-CD1 3.31Å; I646-I677 HydrophobicContact CD1-CG1 4.44Å; I646-I677 HydrophobicContact CG2-CD1 4.35Å
647	N	37.5	Very low	41.2	Very low	91 Å²	91	76.9 Å²	76.9	49%	0.487	41%	0.411	S	S	.	.	H	α-helix	trans	-67.7	-28.6	173	-69.8	-11.9	0	0	0	112.1	Q643 Q650	Q643-N647 VanDerWaalsContact O-CB 3.28Å; Q643-N647 WeakPolarHBondContact O-CB 3.41Å; Q643-N647 PolarHBondContact O-N 2.6Å; Q643-N647 PolarHBondContact O-ND2 3.21Å; N647-Q650 PolarHBondContact O-N 3.37Å
648	R	33.7	Very low	38.8	Very low	133 Å²	133	82 Å²	82	50%	0.502	44%	0.437	S	S	.	.	H	α-helix	trans	-76.7	-30	170	-76.6	173.4	-176.6	-170.9	0.3	113.2	R644 M645 I646 Q650 N651	R644-R648 WeakPolarHBondContact O-CB 3.18Å; R644-R648 WeakPolarHBondContact O-CD 3.33Å; R644-R648 WeakPolarHBondContact O-CG 3.44Å; R644-R648 PolarHBondContact O-N 2.9Å; M645-R648 CarbonylContact O-C 3.55Å; M645-R648 PolarHBondContact O-N 3.04Å; I646-R648 VanDerWaalsContact C-N 3.29Å; I646-R648 PolarHBondContact O-N 3.4Å; R648-Q650 VanDerWaalsContact C-N 3.26Å; R648-N651 PolarHBondContact O-N 2.77Å
649	M	31.6	Very low	37.2	Very low	142 Å²	142	84.6 Å²	84.6	70%	0.7	46%	0.456	S	S	*	.	H	α-helix	trans	-71.4	-25.3	168.6	-73	-171.9	-67.1	0	0	111.6	M645 I646 N651	M645-M649 VanDerWaalsContact O-CG 3.31Å; M645-M649 WeakPolarHBondContact O-CG 3.35Å; M645-M649 PolarHBondContact O-N 3.31Å; I646-M649 HydrophobicContact CB-CE 4.28Å; I646-M649 HydrophobicContact CG1-CE 3.61Å; I646-M649 CarbonylContact O-C 3.18Å; I646-M649 PolarHBondContact O-N 2.9Å; M649-N651 VanDerWaalsContact C-N 3.26Å; M649-N651 PolarHBondContact O-N 2.79Å
650	Q	39.4	Very low	36.3	Very low	71 Å²	71	89.8 Å²	89.8	33%	0.332	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	9.8	173.2	-72.8	174.8	23.3	0	0	113.7	I646 N647 R648 P652	I646-Q650 WeakPolarHBondContact O-CB 3.45Å; I646-Q650 VanDerWaalsContact O-CG 3.28Å; I646-Q650 WeakPolarHBondContact O-CG 3.3Å; I646-Q650 PolarHBondContact O-N 3.31Å; N647-Q650 PolarHBondContact O-N 3.37Å; R648-Q650 VanDerWaalsContact C-N 3.26Å; Q650-P652 WeakPolarHBondContact O-CD 3.13Å
651	N	32.5	Very low	35.7	Very low	84 Å²	84	92 Å²	92	45%	0.449	51%	0.51	S	S	.	.			trans	-62.4	112.6	172.4	-125	-5.4	0	0	0	108.2	R648 M649 S653 L654	R648-N651 PolarHBondContact O-N 2.77Å; M649-N651 VanDerWaalsContact C-N 3.26Å; M649-N651 PolarHBondContact O-N 2.79Å; N651-S653 PolarHBondContact O-N 3.19Å; N651-L654 PolarHBondContact O-N 2.68Å
652	P	35.7	Very low	35.3	Very low	69 Å²	69	93 Å²	93	45%	0.448	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-13.7	-172.9	-18.8	31.8	0	0	0	112.8	Q650 L654 S655	Q650-P652 WeakPolarHBondContact O-CD 3.13Å; P652-L654 VanDerWaalsContact C-N 3.31Å; P652-L654 PolarHBondContact O-N 3.01Å; P652-S655 WeakPolarHBondContact CA-OG 3.48Å; P652-S655 PolarHBondContact O-N 3.49Å; P652-S655 PolarHBondContact O-OG 3.26Å
653	S	35.3	Very low	35.1	Very low	66 Å²	66	98.9 Å²	98.9	46%	0.462	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-11.8	175.7	53.1	0	0	0	0	114.7	N651	N651-S653 PolarHBondContact O-N 3.19Å
654	L	32.6	Very low	34.9	Very low	115 Å²	115	103.5 Å²	103.5	60%	0.602	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	-13.2	170.5	-87.4	114.2	0	0	0	113.6	N651 P652	N651-L654 PolarHBondContact O-N 2.68Å; P652-L654 VanDerWaalsContact C-N 3.31Å; P652-L654 PolarHBondContact O-N 3.01Å
655	S	34.9	Very low	34.7	Very low	92 Å²	92	105.3 Å²	105.3	64%	0.643	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.4	-7	179.1	55.1	0	0	0	0	114.5	P652	P652-S655 WeakPolarHBondContact CA-OG 3.48Å; P652-S655 PolarHBondContact O-N 3.49Å; P652-S655 PolarHBondContact O-OG 3.26Å
656	S	36.1	Very low	34.8	Very low	78 Å²	78	100.2 Å²	100.2	55%	0.545	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	-3.6	-179	56.1	0	0	0	0	114.8
657	S	33.6	Very low	34.8	Very low	91 Å²	91	104 Å²	104	64%	0.636	59%	0.593	S	S	*	*	S	Bend	trans	-124.2	6.5	-174.7	55.5	0	0	0	0	115.5
658	L	30.9	Very low	34.9	Very low	110 Å²	110	103.6 Å²	103.6	58%	0.576	60%	0.595	S	S	*	*	S	Bend	trans	-95.5	120.7	166.8	-100.2	88.4	0	0	0	110.1	T660 L662	L658-T660 PolarHBondContact O-N 2.91Å; L658-L662 HydrophobicContact CD2-CD1 3.88Å
659	P	30.9	Very low	35.2	Very low	92 Å²	92	101.2 Å²	101.2	60%	0.597	60%	0.595	S	S	*	*			trans	-55.8	136.4	178.6	-21.5	30.6	0	0	0	111.5	L661	P659-L661 PolarHBondContact O-N 2.91Å
660	T	34.4	Very low	35.7	Very low	147 Å²	147	99 Å²	99	90%	0.902	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55	13.9	178	-25.5	0	0	0	0	115.5	L658	L658-T660 PolarHBondContact O-N 2.91Å
661	L	33.6	Very low	36.1	Very low	157 Å²	157	99.2 Å²	99.2	82%	0.822	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	-7.6	-178.1	-87	152.5	0	0	0	114	P659	P659-L661 PolarHBondContact O-N 2.91Å
662	L	33.5	Very low	36.6	Very low	104 Å²	104	103.3 Å²	103.3	55%	0.545	60%	0.6	S	S	.	*	S	Bend	trans	-94.4	-5.7	-173.8	-80.9	160.5	0	0	0	115.6	L658	L658-L662 HydrophobicContact CD2-CD1 3.88Å
663	F	36.9	Very low	37.1	Very low	154 Å²	154	102.5 Å²	102.5	68%	0.675	59%	0.592	S	S	*	*			trans	-151.5	82.3	-179	-64	-78.6	0	0	0	113.4	T665	F663-T665 PolarHBondContact O-N 3.44Å; F663-T665 VanDerWaalsContact O-N 3.12Å
664	P	35.6	Very low	37.7	Very low	128 Å²	128	103.9 Å²	103.9	83%	0.831	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-2.6	171.8	-13.2	28.5	0	0	0	113.6
665	T	36.2	Very low	38.7	Very low	120 Å²	120	104 Å²	104	74%	0.736	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.3	24.3	-176.9	55.4	0	0	0	0	114.1	F663 P668	F663-T665 PolarHBondContact O-N 3.44Å; F663-T665 VanDerWaalsContact O-N 3.12Å; T665-P668 WeakPolarHBondContact O-CD 3.45Å
666	G	36.5	Very low	39.4	Very low	21 Å²	21	103.5 Å²	103.5	22%	0.216	58%	0.575	C	S	.	*			trans	-91.1	8.5	-159.5	0	0	0	0	0	120.2	P668	G666-P668 VanDerWaalsContact C-CD 3.5Å
667	T	38.4	Very low	40.1	Very low	120 Å²	120	100.5 Å²	100.5	74%	0.736	55%	0.553	S	S	*	*	H	α-helix	trans	-78.5	-23.8	173.6	45.4	0	0	0	0	116.4	T671	T667-T671 PolarHBondContact O-OG1 3Å
668	P	40.3	Very low	41	Very low	82 Å²	82	100.7 Å²	100.7	53%	0.532	55%	0.546	S	S	.	.	H	α-helix	trans	-76.7	-30	-178.8	-12.8	27.5	0	0	0	114.3	T665 G666 R672	T665-P668 WeakPolarHBondContact O-CD 3.45Å; G666-P668 VanDerWaalsContact C-CD 3.5Å; P668-R672 VanDerWaalsContact O-CB 3.23Å; P668-R672 WeakPolarHBondContact O-CB 3.2Å; P668-R672 PolarHBondContact O-N 3.29Å
669	T	39.7	Very low	42.1	Very low	82 Å²	82	99.3 Å²	99.3	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-74.1	-39	-171.8	36.8	0	0	0	0	113.1	L673	T669-L673 WeakPolarHBondContact O-CB 3.2Å; T669-L673 WeakPolarHBondContact O-CD1 3.48Å; T669-L673 WeakPolarHBondContact O-CG 3.39Å; T669-L673 PolarHBondContact O-N 3.2Å
670	I	43.1	Very low	43	Very low	96 Å²	96	97.6 Å²	97.6	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-70.5	-39.7	177	-63.2	175.7	0	0	0	110.7	L673 K674	I670-L673 PolarHBondContact O-N 2.75Å; I670-K674 WeakPolarHBondContact O-CB 3.48Å; I670-K674 WeakPolarHBondContact O-CG 3.35Å; I670-K674 PolarHBondContact O-N 3.27Å
671	T	46.4	Very low	43.9	Very low	76 Å²	76	94.4 Å²	94.4	47%	0.466	50%	0.499	S	S	.	.	H	α-helix	trans	-66	-42.2	177.3	-39.1	0	0	0	0	110.8	T667 L673 K674 E675	T667-T671 PolarHBondContact O-OG1 3Å; T671-L673 PolarHBondContact O-N 3.29Å; T671-K674 PolarHBondContact O-N 3.47Å; T671-E675 WeakPolarHBondContact O-CG 3.5Å; T671-E675 PolarHBondContact O-N 3.11Å
672	R	44.7	Very low	44.9	Very low	169 Å²	169	94.9 Å²	94.9	64%	0.638	50%	0.495	S	S	*	.	H	α-helix	trans	-63.8	-39	173.9	-168.2	175.6	-175.7	169.3	2	112.6	P668 E675 Q676	P668-R672 VanDerWaalsContact O-CB 3.23Å; P668-R672 WeakPolarHBondContact O-CB 3.2Å; P668-R672 PolarHBondContact O-N 3.29Å; R672-E675 PolarHBondContact O-N 3.36Å; R672-Q676 WeakPolarHBondContact O-CB 3.27Å; R672-Q676 VanDerWaalsContact O-CG 3.25Å; R672-Q676 WeakPolarHBondContact O-CG 3.45Å; R672-Q676 PolarHBondContact O-N 3.45Å
673	L	45.2	Very low	46.1	Very low	53 Å²	53	95.9 Å²	95.9	28%	0.277	50%	0.496	S	S	.	.	H	α-helix	trans	-64.3	-45.4	172.7	-80.6	163	0	0	0	111.2	T669 I670 T671 E675 Q676 I677	T669-L673 WeakPolarHBondContact O-CB 3.2Å; T669-L673 WeakPolarHBondContact O-CD1 3.48Å; T669-L673 WeakPolarHBondContact O-CG 3.39Å; T669-L673 PolarHBondContact O-N 3.2Å; I670-L673 PolarHBondContact O-N 2.75Å; T671-L673 PolarHBondContact O-N 3.29Å; L673-E675 VanDerWaalsContact C-N 3.33Å; L673-E675 PolarHBondContact O-N 3.49Å; L673-Q676 PolarHBondContact O-N 3.06Å; L673-I677 WeakPolarHBondContact O-CB 3.37Å; L673-I677 VanDerWaalsContact O-CD1 3.27Å; L673-I677 WeakPolarHBondContact O-CD1 3.31Å; L673-I677 WeakPolarHBondContact O-CG1 3.28Å; L673-I677 PolarHBondContact O-N 3.05Å
674	K	48.4	Very low	47.7	Very low	94 Å²	94	93 Å²	93	41%	0.409	48%	0.481	S	S	.	.	H	α-helix	trans	-60.2	-41.4	174.9	-77.8	-176.9	174.6	-173.7	0	112.1	I670 T671 I677 N678	I670-K674 WeakPolarHBondContact O-CB 3.48Å; I670-K674 WeakPolarHBondContact O-CG 3.35Å; I670-K674 PolarHBondContact O-N 3.27Å; T671-K674 PolarHBondContact O-N 3.47Å; K674-I677 PolarHBondContact O-N 3.25Å; K674-N678 VanDerWaalsContact O-CB 3.24Å; K674-N678 WeakPolarHBondContact O-CB 3.27Å; K674-N678 PolarHBondContact O-N 3.22Å; K674-N678 PolarHBondContact O-ND2 3.31Å
675	E	53	Low	50.1	Low	117 Å²	117	89.7 Å²	89.7	55%	0.547	45%	0.453	S	S	.	.	H	α-helix	trans	-65.9	-43.9	174.7	-77.3	177	177.5	0	0	112.1	T671 R672 L673 I677 N678 N679	T671-E675 WeakPolarHBondContact O-CG 3.5Å; T671-E675 PolarHBondContact O-N 3.11Å; R672-E675 PolarHBondContact O-N 3.36Å; L673-E675 VanDerWaalsContact C-N 3.33Å; L673-E675 PolarHBondContact O-N 3.49Å; E675-I677 VanDerWaalsContact C-N 3.3Å; E675-I677 PolarHBondContact O-N 3.41Å; E675-N678 PolarHBondContact O-N 3.03Å; E675-N679 WeakPolarHBondContact O-CB 3.07Å; E675-N679 PolarHBondContact O-N 2.65Å; E675-N679 PolarHBondContact O-ND2 2.76Å
676	Q	50.3	Low	52.8	Low	82 Å²	82	84.9 Å²	84.9	38%	0.383	43%	0.425	S	S	.	.	H	α-helix	trans	-60.5	-42.6	175.7	-78.2	176.9	-33.4	0	0	111.5	R672 L673 N679 Y680	R672-Q676 WeakPolarHBondContact O-CB 3.27Å; R672-Q676 VanDerWaalsContact O-CG 3.25Å; R672-Q676 WeakPolarHBondContact O-CG 3.45Å; R672-Q676 PolarHBondContact O-N 3.45Å; L673-Q676 PolarHBondContact O-N 3.06Å; Q676-N679 PolarHBondContact O-N 2.59Å; Q676-Y680 WeakPolarHBondContact O-CB 3.44Å; Q676-Y680 PolarHBondContact O-N 3.29Å
677	I	51.1	Low	55.5	Low	16 Å²	16	83.9 Å²	83.9	8%	0.082	41%	0.414	C	S	.	.	H	α-helix	trans	-68	-47.6	178.7	-76.5	165	0	0	0	112	I646 L673 K674 E675 N679 Y680 D681	I646-I677 HydrophobicContact CD1-CD1 3.31Å; I646-I677 HydrophobicContact CD1-CG1 4.44Å; I646-I677 HydrophobicContact CG2-CD1 4.35Å; L673-I677 WeakPolarHBondContact O-CB 3.37Å; L673-I677 VanDerWaalsContact O-CD1 3.27Å; L673-I677 WeakPolarHBondContact O-CD1 3.31Å; L673-I677 WeakPolarHBondContact O-CG1 3.28Å; L673-I677 PolarHBondContact O-N 3.05Å; K674-I677 PolarHBondContact O-N 3.25Å; E675-I677 VanDerWaalsContact C-N 3.3Å; E675-I677 PolarHBondContact O-N 3.41Å; I677-N679 VanDerWaalsContact C-N 3.27Å; I677-N679 PolarHBondContact O-N 2.73Å; I677-Y680 WeakPolarHBondContact O-CA 3.2Å; I677-Y680 WeakPolarHBondContact O-CB 3.32Å; I677-Y680 PolarHBondContact O-N 3.17Å; I677-D681 PolarHBondContact O-N 3.39Å
678	N	53.2	Low	58.2	Low	95 Å²	95	78.8 Å²	78.8	51%	0.508	38%	0.382	S	S	.	.	H	α-helix	trans	-66.4	-32.7	177.5	-74	-10.8	0	0	0	111.6	K674 E675 K682	K674-N678 VanDerWaalsContact O-CB 3.24Å; K674-N678 WeakPolarHBondContact O-CB 3.27Å; K674-N678 PolarHBondContact O-N 3.22Å; K674-N678 PolarHBondContact O-ND2 3.31Å; E675-N678 PolarHBondContact O-N 3.03Å; N678-K682 PolarHBondContact O-N 3.16Å
679	N	52.9	Low	60.8	Low	81 Å²	81	74.9 Å²	74.9	43%	0.433	36%	0.356	S	S	.	.	H	α-helix	trans	-69.1	-35.1	170.3	-74.4	-21.3	0	0	0	111.4	E675 Q676 I677 K682 H683	E675-N679 WeakPolarHBondContact O-CB 3.07Å; E675-N679 PolarHBondContact O-N 2.65Å; E675-N679 PolarHBondContact O-ND2 2.76Å; Q676-N679 PolarHBondContact O-N 2.59Å; I677-N679 VanDerWaalsContact C-N 3.27Å; I677-N679 PolarHBondContact O-N 2.73Å; N679-K682 WeakPolarHBondContact O-CB 3.29Å; N679-K682 PolarHBondContact O-N 2.97Å; N679-H683 PolarHBondContact O-CD2 3.05Å; N679-H683 PolarHBondContact O-N 3.36Å
680	Y	49.4	Very low	63.4	Low	55 Å²	55	71.2 Å²	71.2	22%	0.216	33%	0.333	C	S	.	.	H	α-helix	trans	-65.4	-40.1	175.5	-113.5	-90.5	0	0	0	112.8	E522 F639 Q676 I677 K682 H683 R684	E522-Y680 HydrophobicContact CB-CE1 4.28Å; E522-Y680 WeakPolarHBondContact O-CE1 3.37Å; E522-Y680 PolarHBondContact O-OH 2.85Å; F639-Y680 HydrophobicContact CE1-CD1 4.25Å; F639-Y680 HydrophobicContact CE2-CD1 4.36Å; F639-Y680 AromaticContact CZ-CD1 3.87Å; F639-Y680 HydrophobicContact CZ-CD1 3.87Å; F639-Y680 HydrophobicContact CZ-CE1 4.41Å; F639-Y680 HydrophobicContact CZ-CG 4.29Å; Q676-Y680 WeakPolarHBondContact O-CB 3.44Å; Q676-Y680 PolarHBondContact O-N 3.29Å; I677-Y680 WeakPolarHBondContact O-CA 3.2Å; I677-Y680 WeakPolarHBondContact O-CB 3.32Å; I677-Y680 PolarHBondContact O-N 3.17Å; Y680-K682 PolarHBondContact O-N 2.98Å; Y680-H683 CarbonylContact O-C 3.56Å; Y680-H683 WeakPolarHBondContact O-CA 3.25Å; Y680-H683 PolarHBondContact O-N 2.86Å; Y680-R684 PolarHBondContact O-N 2.99Å
681	D	52.9	Low	65.9	Low	81 Å²	81	68.1 Å²	68.1	43%	0.433	32%	0.316	S	S	.	.	H	α-helix	trans	-63.4	-32.6	177.6	-142.7	14.1	0	0	0	111.2	I677 H683	I677-D681 PolarHBondContact O-N 3.39Å; D681-H683 PolarHBondContact O-N 3.3Å
682	K	55	Low	68	Low	167 Å²	167	64.5 Å²	64.5	73%	0.726	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-18.5	170.3	-70.2	179.3	-179.8	176.4	0	114	N678 N679 Y680	N678-K682 PolarHBondContact O-N 3.16Å; N679-K682 WeakPolarHBondContact O-CB 3.29Å; N679-K682 PolarHBondContact O-N 2.97Å; Y680-K682 PolarHBondContact O-N 2.98Å
683	H	59.2	Low	70.1	Confident	125 Å²	125	58 Å²	58	58%	0.579	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.7	6.3	-175.1	-65.1	-45.3	0	0	0	113.7	N679 Y680 D681 K685	N679-H683 PolarHBondContact O-CD2 3.05Å; N679-H683 PolarHBondContact O-N 3.36Å; Y680-H683 CarbonylContact O-C 3.56Å; Y680-H683 WeakPolarHBondContact O-CA 3.25Å; Y680-H683 PolarHBondContact O-N 2.86Å; D681-H683 PolarHBondContact O-N 3.3Å; H683-K685 PolarHBondContact O-N 3.31Å
684	R	70.3	Confident	72	Confident	92 Å²	92	55.5 Å²	55.5	35%	0.347	26%	0.259	S	S	.	.	P	Polyproline II helix	trans	-53.7	134.8	176.2	176.2	178.8	159.9	178.8	-7.4	110.5	Y680 E785	Y680-R684 PolarHBondContact O-N 2.99Å; R684-E785 IonicContact CZ-OE1 3.25Å; R684-E785 IonicContact NE-OE1 3.4Å; R684-E785 IonicContact NH2-OE1 2.73Å; R684-E785 PolarHBondContact NH2-OE1 3.5Å
685	K	87.2	Confident	73.4	Confident	60 Å²	60	51.6 Å²	51.6	26%	0.261	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-93.4	150	177.8	-64.9	-62.6	-172.5	176.2	0	112.6	N528 T529 D530 H683	N528-K685 VanDerWaalsContact O-CE 3.26Å; N528-K685 WeakPolarHBondContact O-CE 3.27Å; T529-K685 WeakPolarHBondContact O-CB 3.46Å; D530-K685 WeakPolarHBondContact OD1-CD 3.28Å; H683-K685 PolarHBondContact O-N 3.31Å
686	S	91.6	Very high	74.1	Confident	19 Å²	19	46.4 Å²	46.4	13%	0.133	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-82.5	147.4	-173.8	57.7	0	0	0	0	111.3	D530 L531 Y688 G765	D530-S686 WeakPolarHBondContact CA-O 3.35Å; D530-S686 PolarHBondContact OD1-N 3.31Å; D530-S686 PolarHBondContact OD1-OG 2.94Å; L531-S686 PolarHBondContact N-O 3.44Å; S686-Y688 WeakPolarHBondContact OG-CE2 3.21Å; S686-G765 PolarHBondContact OG-O 3.48Å
687	T	93.9	Very high	74.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	134	180	-46.2	0	0	0	0	110.2	L531 L633 H636 E785 Y786	L531-T687 HydrophobicContact CB-CG2 4.47Å; L531-T687 HydrophobicContact CD2-CG2 4.24Å; L531-T687 CarbonylContact O-C 3.38Å; L531-T687 VanDerWaalsContact O-CA 3.31Å; L531-T687 WeakPolarHBondContact O-CA 3.34Å; L633-T687 HydrophobicContact CD2-CG2 3.7Å; H636-T687 PolarHBondContact ND1-OG1 2.81Å; T687-E785 CarbonylContact O-C 3.53Å; T687-E785 WeakPolarHBondContact O-CA 3.25Å; T687-E785 WeakPolarHBondContact O-CG 3.39Å; T687-Y786 HydrophobicContact CG2-CD1 4.4Å; T687-Y786 PolarHBondContact O-N 2.79Å
688	Y	95.6	Very high	74.6	Confident	13 Å²	13	47 Å²	47	5%	0.051	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	135.9	177.4	-63.6	-85	0	0	0	111.1	L531 L532 I533 S686 F761 G765 D766 P767 W783 E785	L531-Y688 PolarHBondContact O-N 3.3Å; L532-Y688 CarbonylContact C-O 3.45Å; L532-Y688 WeakPolarHBondContact CA-O 3.29Å; I533-Y688 PolarHBondContact N-O 2.92Å; S686-Y688 WeakPolarHBondContact OG-CE2 3.21Å; Y688-F761 HydrophobicContact CD2-CD2 4.17Å; Y688-F761 AromaticContact CD2-CE2 3.81Å; Y688-F761 HydrophobicContact CD2-CE2 3.81Å; Y688-F761 HydrophobicContact CE2-CD2 4.45Å; Y688-F761 HydrophobicContact CE2-CE2 4.2Å; Y688-G765 WeakPolarHBondContact CE2-O 3.21Å; Y688-D766 PolarHBondContact OH-OD1 2.84Å; Y688-P767 HydrophobicContact CD1-CG 3.67Å; Y688-P767 HydrophobicContact CD2-CG 4.4Å; Y688-P767 VanDerWaalsContact CE1-CD 3.47Å; Y688-P767 HydrophobicContact CE1-CG 3.76Å; Y688-P767 HydrophobicContact CE2-CG 4.47Å; Y688-P767 HydrophobicContact CG-CG 4.01Å; Y688-W783 AromaticContact CD1-CD1 3.92Å; Y688-W783 HydrophobicContact CD1-CD2 4.38Å; Y688-W783 HydrophobicContact CD1-CG 4.23Å; Y688-W783 AromaticContact CD1-NE1 3.91Å; Y688-W783 WeakPolarHBondContact CE1-O 3.49Å; Y688-E785 HydrophobicContact CE1-CB 4.38Å
689	A	94.8	Very high	74.9	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.9	-178.3	0	0	0	0	0	111.5	I533 W535 L633 W783 Y786 Y793 L794	I533-A689 CarbonylContact O-C 3.5Å; I533-A689 WeakPolarHBondContact O-CA 3.42Å; W535-A689 HydrophobicContact CH2-CB 4.41Å; W535-A689 HydrophobicContact CZ3-CB 4.13Å; L633-A689 HydrophobicContact CD1-CB 4.06Å; L633-A689 HydrophobicContact CD2-CB 4.02Å; A689-W783 VanDerWaalsContact C-CZ2 3.49Å; A689-W783 VanDerWaalsContact O-CZ2 3.26Å; A689-W783 WeakPolarHBondContact O-CZ2 3.42Å; A689-W783 PolarHBondContact O-NE1 3.43Å; A689-Y786 HydrophobicContact CB-CD2 3.73Å; A689-Y786 HydrophobicContact CB-CE2 4.47Å; A689-Y786 HydrophobicContact CB-CG 4.26Å; A689-Y793 CarbonylContact O-C 3.55Å; A689-Y793 VanDerWaalsContact O-CA 3.32Å; A689-Y793 WeakPolarHBondContact O-CA 3.49Å; A689-Y793 WeakPolarHBondContact O-CB 3.49Å; A689-L794 PolarHBondContact O-N 3.16Å
690	L	94.7	Very high	74.9	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133.2	179	174.2	68.4	0	0	0	110.6	I533 G534 W535 L754 W783 L794 V796	I533-L690 PolarHBondContact O-N 3.48Å; G534-L690 CarbonylContact C-O 3.56Å; G534-L690 VanDerWaalsContact CA-O 3.26Å; G534-L690 WeakPolarHBondContact CA-O 3.26Å; W535-L690 VanDerWaalsContact CE3-O 3.23Å; W535-L690 PolarHBondContact N-O 2.82Å; L690-L754 HydrophobicContact CD1-CD2 4.43Å; L690-L754 HydrophobicContact CD2-CD2 4.35Å; L690-W783 HydrophobicContact CB-CH2 3.8Å; L690-W783 HydrophobicContact CB-CZ2 3.88Å; L690-W783 HydrophobicContact CD1-CH2 4.46Å; L690-L794 WeakPolarHBondContact CA-O 3.41Å; L690-L794 HydrophobicContact CD1-CB 4.21Å; L690-L794 HydrophobicContact CD1-CD2 4.03Å; L690-L794 HydrophobicContact CD1-CG 4.16Å; L690-V796 HydrophobicContact CD1-CG2 3.75Å
691	F	93.6	Very high	74.8	Confident	31 Å²	31	43.8 Å²	43.8	14%	0.136	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126.1	169.4	-179.5	-103.8	0	0	0	110.6	W535 T536 E537 N693 Y793 L794 H795 V796	W535-F691 AromaticContact CD1-CD2 3.56Å; W535-F691 AromaticContact CD1-CE2 3.8Å; W535-F691 HydrophobicContact CD2-CD2 4.22Å; W535-F691 AromaticContact CE2-CD2 3.61Å; W535-F691 HydrophobicContact CG-CD2 4.18Å; W535-F691 HydrophobicContact CZ2-CB 4.3Å; W535-F691 HydrophobicContact CZ2-CD2 4.15Å; W535-F691 AromaticContact NE1-CD2 3.2Å; W535-F691 AromaticContact NE1-CE2 3.56Å; W535-F691 WeakPolarHBondContact O-CA 3.31Å; T536-F691 WeakPolarHBondContact O-CE2 3.38Å; E537-F691 HydrophobicContact CB-CZ 4.23Å; F691-N693 HydrophobicContact CD1-CB 4.33Å; F691-N693 HydrophobicContact CE1-CB 3.69Å; F691-N693 HydrophobicContact CZ-CB 4.3Å; F691-Y793 HydrophobicContact CB-CD2 3.57Å; F691-Y793 HydrophobicContact CB-CE2 3.39Å; F691-Y793 HydrophobicContact CD1-CE2 4.32Å; F691-Y793 HydrophobicContact CG-CE2 4.07Å; F691-L794 PolarHBondContact N-O 3.37Å; F691-H795 AromaticContact CD1-CD2 3.44Å; F691-H795 VanDerWaalsContact CD1-CD2 3.44Å; F691-H795 WeakPolarHBondContact CD1-CD2 3.31Å; F691-H795 AromaticContact CD1-NE2 3.99Å; F691-H795 AromaticContact CE1-CD2 3.95Å; F691-V796 PolarHBondContact O-N 3.28Å
692	F	92	Very high	74.8	Confident	1 Å²	1	46.9 Å²	46.9	0%	0.004	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	117.3	-175.4	-172.2	-91.7	0	0	0	111.9	W535 T536 E537 Y694 I716 D720 D721 Y724 L754 V796	W535-F692 PolarHBondContact O-N 2.74Å; T536-F692 VanDerWaalsContact CA-O 3.32Å; T536-F692 WeakPolarHBondContact CA-O 3.21Å; T536-F692 HydrophobicContact CG2-CB 4.3Å; T536-F692 HydrophobicContact CG2-CD1 4.26Å; E537-F692 PolarHBondContact N-O 3.12Å; F692-Y694 HydrophobicContact CZ-CD1 4.25Å; F692-I716 HydrophobicContact CD1-CG2 3.57Å; F692-I716 HydrophobicContact CE1-CG2 3.82Å; F692-D720 WeakPolarHBondContact CE1-O 3.48Å; F692-D721 HydrophobicContact CB-CB 4.02Å; F692-D721 HydrophobicContact CD1-CB 3.69Å; F692-D721 HydrophobicContact CD2-CB 4.2Å; F692-D721 HydrophobicContact CE1-CB 4.22Å; F692-D721 HydrophobicContact CG-CB 3.7Å; F692-Y724 HydrophobicContact CE1-CD2 4.27Å; F692-Y724 HydrophobicContact CE1-CE2 4.29Å; F692-Y724 HydrophobicContact CE2-CD2 4.1Å; F692-Y724 HydrophobicContact CE2-CG 4.37Å; F692-Y724 AromaticContact CZ-CD2 3.46Å; F692-Y724 HydrophobicContact CZ-CD2 3.46Å; F692-Y724 VanDerWaalsContact CZ-CD2 3.46Å; F692-Y724 AromaticContact CZ-CE2 3.63Å; F692-Y724 HydrophobicContact CZ-CE2 3.63Å; F692-Y724 HydrophobicContact CZ-CG 4.13Å; F692-L754 HydrophobicContact CD2-CD1 4.2Å; F692-L754 HydrophobicContact CE2-CD1 3.87Å; F692-V796 HydrophobicContact CD2-CB 3.97Å; F692-V796 HydrophobicContact CD2-CG1 3.9Å; F692-V796 HydrophobicContact CE2-CB 4.5Å; F692-V796 HydrophobicContact CE2-CG1 3.92Å
693	N	88	Confident	74.7	Confident	32 Å²	32	40 Å²	40	17%	0.171	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	34	177.8	-170.9	2.9	0	0	0	111.1	E537 F691 K695 V796	E537-N693 HydrophobicContact CB-CB 4.29Å; E537-N693 VanDerWaalsContact CD-ND2 3.29Å; E537-N693 PolarHBondContact OE1-ND2 3Å; E537-N693 VanDerWaalsContact OE1-ND2 3.16Å; E537-N693 PolarHBondContact OE2-OD1 3.2Å; E537-N693 VanDerWaalsContact OE2-OD1 3.04Å; F691-N693 HydrophobicContact CD1-CB 4.33Å; F691-N693 HydrophobicContact CE1-CB 3.69Å; F691-N693 HydrophobicContact CZ-CB 4.3Å; N693-K695 WeakPolarHBondContact OD1-CE 3.46Å; N693-V796 CarbonylContact C-O 3.55Å; N693-V796 PolarHBondContact N-O 2.91Å
694	Y	85.8	Confident	74.3	Confident	1 Å²	1	44 Å²	44	0%	0.004	20%	0.204	C	C	.	.			trans	-85	130.8	175.1	171.5	-102.6	0	0	0	110.3	F692 I716 Y724 D747 I750 V796 H824	F692-Y694 HydrophobicContact CZ-CD1 4.25Å; Y694-I716 WeakPolarHBondContact O-CD1 3.45Å; Y694-I716 WeakPolarHBondContact O-CG1 3.31Å; Y694-Y724 HydrophobicContact CD1-CE1 4Å; Y694-Y724 HydrophobicContact CD1-CE2 4.47Å; Y694-Y724 AromaticContact CD1-CZ 3.82Å; Y694-Y724 AromaticContact CE1-CE1 3.79Å; Y694-Y724 HydrophobicContact CE1-CE1 3.79Å; Y694-Y724 AromaticContact CE1-CZ 3.78Å; Y694-Y724 WeakPolarHBondContact CE1-OH 3.27Å; Y694-D747 WeakPolarHBondContact CE1-OD1 3.25Å; Y694-D747 PolarHBondContact OH-OD1 2.86Å; Y694-I750 HydrophobicContact CD1-CD1 3.65Å; Y694-I750 HydrophobicContact CD1-CG2 4.27Å; Y694-I750 HydrophobicContact CD2-CD1 3.42Å; Y694-I750 VanDerWaalsContact CD2-CD1 3.42Å; Y694-I750 HydrophobicContact CE1-CD1 3.33Å; Y694-I750 HydrophobicContact CE2-CD1 3.11Å; Y694-I750 HydrophobicContact CG-CD1 3.68Å; Y694-V796 PolarHBondContact N-O 3.43Å; Y694-H824 AromaticContact CD2-ND1 3.93Å; Y694-H824 AromaticContact CE2-ND1 4Å
695	K	76.8	Confident	73.4	Confident	12 Å²	12	47.1 Å²	47.1	5%	0.052	23%	0.228	C	C	.	.			trans	-108.8	132.5	-179.7	-55.6	-168.4	-175.7	-158.8	0	108.1	E537 N693 Q699 I700 G714 I716	E537-K695 IonicContact OE2-NZ 2.72Å; E537-K695 PolarHBondContact OE2-NZ 2.69Å; N693-K695 WeakPolarHBondContact OD1-CE 3.46Å; K695-Q699 HydrophobicContact CB-CB 4.28Å; K695-I700 HydrophobicContact CB-CG1 4.18Å; K695-G714 WeakPolarHBondContact CE-O 3.21Å; K695-G714 PolarHBondContact NZ-O 2.81Å; K695-I716 HydrophobicContact CG-CD1 3.89Å; K695-I716 HydrophobicContact CG-CG1 3.89Å
696	T	68	Low	71.7	Confident	8 Å²	8	45.1 Å²	45.1	5%	0.049	22%	0.222	C	C	.	.			trans	-56.8	146.7	177.8	61.2	0	0	0	0	110	Q698 Q699 I700 Y724	T696-Q698 PolarHBondContact O-N 3.28Å; T696-Q699 WeakPolarHBondContact O-CA 3.42Å; T696-Q699 WeakPolarHBondContact O-CB 3.37Å; T696-Q699 PolarHBondContact O-N 3.38Å; T696-Q699 VanDerWaalsContact OG1-CG 3.25Å; T696-Q699 WeakPolarHBondContact OG1-CG 3.34Å; T696-I700 PolarHBondContact O-N 3.26Å; T696-I700 VanDerWaalsContact O-N 3.13Å; T696-Y724 WeakPolarHBondContact CG2-OH 3.36Å
697	S	57.2	Low	69.9	Low	39 Å²	39	48 Å²	48	27%	0.273	24%	0.239	S	C	.	.	H	α-helix	trans	-54.1	-29.7	-178.4	-76.8	0	0	0	0	113.4	I700 T701	S697-I700 PolarHBondContact O-N 3.07Å; S697-T701 PolarHBondContact O-N 2.93Å
698	Q	54.6	Low	68.1	Low	70 Å²	70	55.2 Å²	55.2	33%	0.327	27%	0.266	S	S	.	.	H	α-helix	trans	-70.2	-34.2	173.6	-64.3	-174.3	-20.5	0	0	114.1	T696 I700 T701 K702 E742	T696-Q698 PolarHBondContact O-N 3.28Å; Q698-I700 VanDerWaalsContact C-N 3.33Å; Q698-T701 PolarHBondContact O-OG1 3.42Å; Q698-K702 PolarHBondContact O-N 3.44Å; Q698-E742 PolarHBondContact NE2-OE2 2.87Å; Q698-E742 PolarHBondContact OE1-OE2 2.86Å
699	Q	59.8	Low	66.1	Low	29 Å²	29	58.2 Å²	58.2	14%	0.136	28%	0.28	C	S	.	.	H	α-helix	trans	-66.9	-40.9	172.5	-69.6	168.3	7.9	0	0	109.6	Q180 K695 T696 T701 K702 H703	Q180-Q699 VanDerWaalsContact NE2-CD 3.3Å; K695-Q699 HydrophobicContact CB-CB 4.28Å; T696-Q699 WeakPolarHBondContact O-CA 3.42Å; T696-Q699 WeakPolarHBondContact O-CB 3.37Å; T696-Q699 PolarHBondContact O-N 3.38Å; T696-Q699 VanDerWaalsContact OG1-CG 3.25Å; T696-Q699 WeakPolarHBondContact OG1-CG 3.34Å; Q699-T701 PolarHBondContact O-N 2.72Å; Q699-K702 PolarHBondContact O-N 3.26Å; Q699-H703 WeakPolarHBondContact O-CB 3.49Å; Q699-H703 PolarHBondContact O-CD2 3.48Å; Q699-H703 PolarHBondContact O-N 3.5Å
700	I	53.4	Low	64.1	Low	39 Å²	39	62.7 Å²	62.7	20%	0.2	30%	0.301	C	S	.	.	H	α-helix	trans	-59.6	-44.3	179.5	-57.5	171	0	0	0	111.7	K695 T696 S697 Q698 H703 D798	K695-I700 HydrophobicContact CB-CG1 4.18Å; T696-I700 PolarHBondContact O-N 3.26Å; T696-I700 VanDerWaalsContact O-N 3.13Å; S697-I700 PolarHBondContact O-N 3.07Å; Q698-I700 VanDerWaalsContact C-N 3.33Å; I700-H703 PolarHBondContact O-N 3.13Å; I700-D798 WeakPolarHBondContact CD1-OD2 3.36Å
701	T	47.4	Very low	62.3	Low	96 Å²	96	65.5 Å²	65.5	59%	0.589	32%	0.315	S	S	*	.	H	α-helix	trans	-64.8	-41.2	-179.1	54.4	0	0	0	0	112.1	S697 Q698 Q699 H703	S697-T701 PolarHBondContact O-N 2.93Å; Q698-T701 PolarHBondContact O-OG1 3.42Å; Q699-T701 PolarHBondContact O-N 2.72Å; T701-H703 VanDerWaalsContact C-N 3.27Å; T701-H703 PolarHBondContact O-N 3.29Å
702	K	51.9	Low	60.4	Low	146 Å²	146	65.5 Å²	65.5	64%	0.635	32%	0.316	S	S	*	.	H	α-helix	trans	-66.2	-29.4	174.9	-69.6	177.5	-178.9	172.3	0	112.5	Q698 Q699 R704	Q698-K702 PolarHBondContact O-N 3.44Å; Q699-K702 PolarHBondContact O-N 3.26Å; K702-R704 PolarHBondContact O-N 3.17Å
703	H	54.1	Low	58.7	Low	22 Å²	22	67.1 Å²	67.1	10%	0.102	32%	0.324	C	S	.	.	H	α-helix	trans	-76.7	-15.2	-177.8	-81.5	-56.4	0	0	0	115.8	Q699 I700 T701 N705 A706 Q710 L711	Q699-H703 WeakPolarHBondContact O-CB 3.49Å; Q699-H703 PolarHBondContact O-CD2 3.48Å; Q699-H703 PolarHBondContact O-N 3.5Å; I700-H703 PolarHBondContact O-N 3.13Å; T701-H703 VanDerWaalsContact C-N 3.27Å; T701-H703 PolarHBondContact O-N 3.29Å; H703-N705 PolarHBondContact O-N 3.03Å; H703-A706 HydrophobicContact CB-CB 4.4Å; H703-A706 WeakPolarHBondContact O-CB 3.2Å; H703-A706 PolarHBondContact O-N 3.35Å; H703-A706 VanDerWaalsContact O-N 3.15Å; H703-Q710 PolarHBondContact CE1-O 2.86Å; H703-Q710 VanDerWaalsContact CE1-O 3.25Å; H703-L711 HydrophobicContact CB-CD2 4.43Å
704	R	49.5	Very low	57.4	Low	209 Å²	209	65.8 Å²	65.8	79%	0.789	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-29.5	-177.9	-76.5	-173.9	176.7	174.6	0.5	113.3	K702	K702-R704 PolarHBondContact O-N 3.17Å
705	N	50.9	Low	56.8	Low	159 Å²	159	67.3 Å²	67.3	85%	0.85	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	17.5	177.2	-64.4	-11.1	0	0	0	112.6	H703	H703-N705 PolarHBondContact O-N 3.03Å
706	A	53.3	Low	56.9	Low	18 Å²	18	67 Å²	67	15%	0.149	32%	0.323	C	S	.	.			trans	-74.5	133	-174.4	0	0	0	0	0	112.5	H703 Q710 L711	H703-A706 HydrophobicContact CB-CB 4.4Å; H703-A706 WeakPolarHBondContact O-CB 3.2Å; H703-A706 PolarHBondContact O-N 3.35Å; H703-A706 VanDerWaalsContact O-N 3.15Å; A706-Q710 VanDerWaalsContact CA-OE1 3.27Å; A706-Q710 HydrophobicContact CB-CB 3.58Å; A706-L711 HydrophobicContact CB-CD2 4.2Å; A706-L711 HydrophobicContact CB-CG 4.12Å
707	T	53.6	Low	57.4	Low	79 Å²	79	66.7 Å²	66.7	49%	0.485	32%	0.321	S	S	.	.			trans	-57.2	158.8	166.4	56.8	0	0	0	0	111.3	K709 Q710 L711	T707-K709 PolarHBondContact O-N 3.22Å; T707-K709 VanDerWaalsContact O-N 3.17Å; T707-Q710 CarbonylContact O-C 3.57Å; T707-Q710 WeakPolarHBondContact O-CA 3.36Å; T707-Q710 WeakPolarHBondContact O-CB 3.41Å; T707-Q710 PolarHBondContact O-N 3.47Å; T707-Q710 WeakPolarHBondContact OG1-CG 3.33Å; T707-Q710 PolarHBondContact OG1-N 3.34Å; T707-Q710 PolarHBondContact OG1-OE1 3.5Å; T707-L711 PolarHBondContact O-N 3.29Å
708	R	54.6	Low	58.6	Low	152 Å²	152	65.2 Å²	65.2	57%	0.574	31%	0.31	S	S	*	.	H	α-helix	trans	-50.6	-40.5	172.7	-76.8	-171.4	-175.8	177.4	4	111.8	D611 L711 Q712	D611-R708 VanDerWaalsContact CG-NH1 3.26Å; D611-R708 IonicContact OD1-NH1 2.69Å; D611-R708 PolarHBondContact OD1-NH1 3.28Å; D611-R708 IonicContact OD2-NH1 3.27Å; D611-R708 PolarHBondContact OD2-NH1 2.97Å; R708-L711 PolarHBondContact O-N 3.48Å; R708-Q712 PolarHBondContact O-N 3.46Å; R708-Q712 VanDerWaalsContact O-N 3.07Å
709	K	53.3	Low	59.8	Low	75 Å²	75	61.9 Å²	61.9	33%	0.326	30%	0.295	S	S	.	.	H	α-helix	trans	-52.8	-54.4	171.5	178.7	168.3	-172.3	-178	0	111.9	D176 W614 T707 L711 Q712 M713	D176-K709 WeakPolarHBondContact OD1-CE 3.5Å; D176-K709 IonicContact OD1-NZ 2.66Å; D176-K709 PolarHBondContact OD1-NZ 2.77Å; W614-K709 HydrophobicContact CH2-CB 3.27Å; W614-K709 HydrophobicContact CH2-CD 3.62Å; W614-K709 HydrophobicContact CH2-CG 3.25Å; W614-K709 HydrophobicContact CZ2-CB 3.65Å; W614-K709 HydrophobicContact CZ2-CD 4.39Å; W614-K709 HydrophobicContact CZ2-CG 4.12Å; W614-K709 HydrophobicContact CZ3-CB 3.8Å; W614-K709 HydrophobicContact CZ3-CD 4.42Å; W614-K709 HydrophobicContact CZ3-CG 3.68Å; T707-K709 PolarHBondContact O-N 3.22Å; T707-K709 VanDerWaalsContact O-N 3.17Å; K709-L711 VanDerWaalsContact C-N 3.33Å; K709-L711 PolarHBondContact O-N 3.33Å; K709-Q712 PolarHBondContact O-N 3.26Å; K709-M713 HydrophobicContact CD-CE 4.15Å; K709-M713 HydrophobicContact CD-SD 4.46Å; K709-M713 HydrophobicContact CG-CE 3.85Å; K709-M713 HydrophobicContact CG-SD 3.78Å; K709-M713 WeakPolarHBondContact O-CB 3.29Å; K709-M713 VanDerWaalsContact O-CG 3.3Å; K709-M713 WeakPolarHBondContact O-CG 3.25Å; K709-M713 PolarHBondContact O-N 3.06Å
710	Q	53	Low	61	Low	95 Å²	95	62 Å²	62	44%	0.444	30%	0.296	S	S	.	.	H	α-helix	trans	-65.2	-35.3	179.6	-75.1	165.1	-36	0	0	112.4	H703 A706 T707 Q712 M713 G714	H703-Q710 PolarHBondContact CE1-O 2.86Å; H703-Q710 VanDerWaalsContact CE1-O 3.25Å; A706-Q710 VanDerWaalsContact CA-OE1 3.27Å; A706-Q710 HydrophobicContact CB-CB 3.58Å; T707-Q710 CarbonylContact O-C 3.57Å; T707-Q710 WeakPolarHBondContact O-CA 3.36Å; T707-Q710 WeakPolarHBondContact O-CB 3.41Å; T707-Q710 PolarHBondContact O-N 3.47Å; T707-Q710 WeakPolarHBondContact OG1-CG 3.33Å; T707-Q710 PolarHBondContact OG1-N 3.34Å; T707-Q710 PolarHBondContact OG1-OE1 3.5Å; Q710-Q712 VanDerWaalsContact C-N 3.31Å; Q710-Q712 PolarHBondContact O-N 3.4Å; Q710-M713 PolarHBondContact O-N 3.3Å; Q710-G714 PolarHBondContact O-N 3.33Å
711	L	56.5	Low	62.6	Low	63 Å²	63	60.1 Å²	60.1	33%	0.33	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-37.7	175.7	-72.9	169.7	0	0	0	112.3	H703 A706 T707 R708 K709 K715	H703-L711 HydrophobicContact CB-CD2 4.43Å; A706-L711 HydrophobicContact CB-CD2 4.2Å; A706-L711 HydrophobicContact CB-CG 4.12Å; T707-L711 PolarHBondContact O-N 3.29Å; R708-L711 PolarHBondContact O-N 3.48Å; K709-L711 VanDerWaalsContact C-N 3.33Å; K709-L711 PolarHBondContact O-N 3.33Å; L711-K715 PolarHBondContact O-N 3.06Å
712	Q	55.3	Low	64.7	Low	30 Å²	30	55.6 Å²	55.6	14%	0.14	26%	0.259	C	S	.	.	H	α-helix	trans	-76.2	-38.3	175.4	-68.2	-149.9	-26.8	0	0	113.6	W614 R708 K709 Q710 G714 K715	W614-Q712 VanDerWaalsContact C-NE2 3.27Å; W614-Q712 VanDerWaalsContact C-OE1 3.24Å; W614-Q712 VanDerWaalsContact CB-CD 3.43Å; W614-Q712 HydrophobicContact CE3-CB 4.4Å; W614-Q712 HydrophobicContact CE3-CG 4.47Å; W614-Q712 PolarHBondContact O-NE2 3.29Å; W614-Q712 PolarHBondContact O-OE1 2.87Å; R708-Q712 PolarHBondContact O-N 3.46Å; R708-Q712 VanDerWaalsContact O-N 3.07Å; K709-Q712 PolarHBondContact O-N 3.26Å; Q710-Q712 VanDerWaalsContact C-N 3.31Å; Q710-Q712 PolarHBondContact O-N 3.4Å; Q712-G714 PolarHBondContact O-N 3.49Å; Q712-K715 PolarHBondContact O-N 3.23Å; Q712-K715 VanDerWaalsContact O-N 3.13Å
713	M	55.8	Low	66.3	Low	35 Å²	35	49 Å²	49	17%	0.172	23%	0.231	C	C	.	.	H	α-helix	trans	-63	-24.1	172.3	-72.1	176.3	165.5	0	0	112.4	D176 P178 K709 Q710	D176-M713 HydrophobicContact CB-CE 4.14Å; D176-M713 WeakPolarHBondContact O-CE 3.49Å; P178-M713 WeakPolarHBondContact CB-O 3.19Å; P178-M713 HydrophobicContact CG-CB 4.27Å; K709-M713 HydrophobicContact CD-CE 4.15Å; K709-M713 HydrophobicContact CD-SD 4.46Å; K709-M713 HydrophobicContact CG-CE 3.85Å; K709-M713 HydrophobicContact CG-SD 3.78Å; K709-M713 WeakPolarHBondContact O-CB 3.29Å; K709-M713 VanDerWaalsContact O-CG 3.3Å; K709-M713 WeakPolarHBondContact O-CG 3.25Å; K709-M713 PolarHBondContact O-N 3.06Å; Q710-M713 PolarHBondContact O-N 3.3Å
714	G	59.6	Low	68.1	Low	4 Å²	4	48.4 Å²	48.4	4%	0.041	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	21.9	173.9	0	0	0	0	0	114.6	K695 Q710 Q712	K695-G714 WeakPolarHBondContact CE-O 3.21Å; K695-G714 PolarHBondContact NZ-O 2.81Å; Q710-G714 PolarHBondContact O-N 3.33Å; Q712-G714 PolarHBondContact O-N 3.49Å
715	K	73.5	Confident	70.1	Confident	34 Å²	34	39 Å²	39	15%	0.148	19%	0.194	C	C	.	.	S	Bend	trans	-68.1	145.6	162.8	-74.1	-174.6	172.7	174.5	0	109.3	E537 A538 L617 D618 L711 Q712 G717	E537-K715 HydrophobicContact CG-CB 4.42Å; E537-K715 HydrophobicContact CG-CD 4.33Å; E537-K715 HydrophobicContact CG-CG 4.33Å; E537-K715 WeakPolarHBondContact OE2-CA 3.38Å; E537-K715 WeakPolarHBondContact OE2-CG 3.38Å; A538-K715 HydrophobicContact CB-CB 3.73Å; A538-K715 HydrophobicContact CB-CD 4.03Å; L617-K715 HydrophobicContact CD2-CD 4.35Å; D618-K715 IonicContact OD1-NZ 2.87Å; D618-K715 PolarHBondContact OD1-NZ 2.81Å; D618-K715 IonicContact OD2-NZ 3.67Å; D618-K715 PolarHBondContact OD2-NZ 3.03Å; D618-K715 VanDerWaalsContact OD2-NZ 3.12Å; L711-K715 PolarHBondContact O-N 3.06Å; Q712-K715 PolarHBondContact O-N 3.23Å; Q712-K715 VanDerWaalsContact O-N 3.13Å; K715-G717 PolarHBondContact O-N 3.27Å
716	I	79	Confident	72	Confident	4 Å²	4	31.8 Å²	31.8	2%	0.021	16%	0.155	C	C	.	.			trans	-72.3	116	178	-67.2	-56.5	0	0	0	108.5	T536 E537 A538 F692 Y694 K695 D720	T536-I716 HydrophobicContact CG2-CG2 4.05Å; E537-I716 HydrophobicContact CB-CB 4.31Å; E537-I716 PolarHBondContact N-O 3.07Å; E537-I716 PolarHBondContact OE2-N 3.4Å; A538-I716 PolarHBondContact N-O 3.33Å; F692-I716 HydrophobicContact CD1-CG2 3.57Å; F692-I716 HydrophobicContact CE1-CG2 3.82Å; Y694-I716 WeakPolarHBondContact O-CD1 3.45Å; Y694-I716 WeakPolarHBondContact O-CG1 3.31Å; K695-I716 HydrophobicContact CG-CD1 3.89Å; K695-I716 HydrophobicContact CG-CG1 3.89Å; I716-D720 HydrophobicContact CG2-CB 3.62Å
717	G	78.5	Confident	73.7	Confident	2 Å²	2	31 Å²	31	2%	0.021	15%	0.148	C	C	.	.			trans	-94.2	-166.6	-167.9	0	0	0	0	0	113.9	T536 S541 K715 A719 D720	T536-G717 VanDerWaalsContact CB-O 3.31Å; T536-G717 WeakPolarHBondContact CB-O 3.42Å; T536-G717 VanDerWaalsContact CG2-O 3.28Å; T536-G717 WeakPolarHBondContact CG2-O 3.26Å; T536-G717 PolarHBondContact OG1-O 2.72Å; S541-G717 WeakPolarHBondContact OG-CA 3.39Å; K715-G717 PolarHBondContact O-N 3.27Å; G717-A719 PolarHBondContact O-N 3.2Å; G717-D720 PolarHBondContact N-OD2 2.92Å
718	F	82.3	Confident	75.1	Confident	8 Å²	8	27.2 Å²	27.2	4%	0.035	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	116.2	175.2	-168.7	-109.3	0	0	0	110.7	R184 Y305 N336 P539 S541 N542 Y625	R184-F718 PolarHBondContact NH1-O 3.31Å; Y305-F718 HydrophobicContact CD1-CZ 4.25Å; Y305-F718 AromaticContact CE1-CD1 3.97Å; Y305-F718 HydrophobicContact CE1-CD1 3.97Å; Y305-F718 HydrophobicContact CE1-CD2 4.46Å; Y305-F718 AromaticContact CE1-CE1 3.31Å; Y305-F718 HydrophobicContact CE1-CE1 3.31Å; Y305-F718 AromaticContact CE1-CE2 3.87Å; Y305-F718 HydrophobicContact CE1-CE2 3.87Å; Y305-F718 HydrophobicContact CE1-CG 4.5Å; Y305-F718 AromaticContact CE1-CZ 3.25Å; Y305-F718 HydrophobicContact CE1-CZ 3.25Å; Y305-F718 HydrophobicContact CE2-CE2 4.33Å; Y305-F718 AromaticContact CZ-CD1 3.75Å; Y305-F718 AromaticContact CZ-CD2 3.77Å; Y305-F718 AromaticContact CZ-CE1 3.52Å; Y305-F718 AromaticContact CZ-CE2 3.53Å; Y305-F718 AromaticContact CZ-CG 3.86Å; Y305-F718 AromaticContact CZ-CZ 3.41Å; Y305-F718 VanDerWaalsContact CZ-CZ 3.41Å; Y305-F718 WeakPolarHBondContact OH-CA 3.24Å; Y305-F718 WeakPolarHBondContact OH-CB 3.26Å; Y305-F718 WeakPolarHBondContact OH-CD1 3.35Å; Y305-F718 WeakPolarHBondContact OH-CD2 3.33Å; Y305-F718 WeakPolarHBondContact OH-CE1 3.27Å; Y305-F718 WeakPolarHBondContact OH-CE2 3.35Å; Y305-F718 WeakPolarHBondContact OH-CG 3.38Å; Y305-F718 WeakPolarHBondContact OH-CZ 3.23Å; Y305-F718 PolarHBondContact OH-O 2.51Å; N336-F718 HydrophobicContact CB-CD2 3.91Å; N336-F718 HydrophobicContact CB-CE2 3.88Å; P539-F718 WeakPolarHBondContact O-CB 3.32Å; P539-F718 WeakPolarHBondContact O-CD2 3.49Å; S541-F718 PolarHBondContact OG-N 3.12Å; N542-F718 HydrophobicContact CB-CB 3.85Å; N542-F718 HydrophobicContact CB-CD1 3.8Å; N542-F718 HydrophobicContact CB-CG 4.16Å; N542-F718 PolarHBondContact ND2-O 3.41Å; Y625-F718 HydrophobicContact CE1-CD2 4.18Å; Y625-F718 AromaticContact CE1-CE2 3.96Å; Y625-F718 HydrophobicContact CE1-CE2 3.96Å
719	A	80.7	Confident	76.6	Confident	1 Å²	1	20.1 Å²	20.1	1%	0.008	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	8.3	177.7	0	0	0	0	0	116.5	Y305 G717 D721 L722 P723	Y305-A719 HydrophobicContact CE1-CB 4.01Å; Y305-A719 VanDerWaalsContact CE2-CA 3.49Å; Y305-A719 HydrophobicContact CE2-CB 3.65Å; Y305-A719 VanDerWaalsContact OH-CA 3.29Å; Y305-A719 WeakPolarHBondContact OH-CA 3.3Å; Y305-A719 WeakPolarHBondContact OH-CB 3.45Å; Y305-A719 PolarHBondContact OH-N 3Å; G717-A719 PolarHBondContact O-N 3.2Å; A719-D721 VanDerWaalsContact CA-OD1 3.25Å; A719-D721 WeakPolarHBondContact CA-OD1 3.19Å; A719-D721 PolarHBondContact O-N 3.21Å; A719-D721 VanDerWaalsContact O-N 3.15Å; A719-L722 HydrophobicContact CB-CB 4.32Å; A719-L722 HydrophobicContact CB-CD1 3.68Å; A719-L722 HydrophobicContact CB-CG 3.83Å; A719-L722 WeakPolarHBondContact O-CB 3.28Å; A719-L722 PolarHBondContact O-N 3.24Å; A719-L722 VanDerWaalsContact O-N 3.1Å; A719-P723 WeakPolarHBondContact O-CD 3.06Å
720	D	84	Confident	77.9	Confident	30 Å²	30	18.3 Å²	18.3	16%	0.16	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.3	175.1	-74.8	-6.4	0	0	0	111.9	F692 I716 G717 Y724	F692-D720 WeakPolarHBondContact CE1-O 3.48Å; I716-D720 HydrophobicContact CG2-CB 3.62Å; G717-D720 PolarHBondContact N-OD2 2.92Å; D720-Y724 WeakPolarHBondContact O-CD2 3.48Å; D720-Y724 WeakPolarHBondContact O-CE2 3.46Å
721	D	88.8	Confident	78.8	Confident	1 Å²	1	14.8 Å²	14.8	1%	0.005	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-31.9	171.4	56.6	-24.5	0	0	0	113.9	N336 T536 F692 A719 Y724 L725	N336-D721 PolarHBondContact ND2-OD1 3.47Å; N336-D721 PolarHBondContact ND2-OD2 3.26Å; N336-D721 VanDerWaalsContact ND2-OD2 3.12Å; T536-D721 HydrophobicContact CG2-CB 4.21Å; F692-D721 HydrophobicContact CB-CB 4.02Å; F692-D721 HydrophobicContact CD1-CB 3.69Å; F692-D721 HydrophobicContact CD2-CB 4.2Å; F692-D721 HydrophobicContact CE1-CB 4.22Å; F692-D721 HydrophobicContact CG-CB 3.7Å; A719-D721 VanDerWaalsContact CA-OD1 3.25Å; A719-D721 WeakPolarHBondContact CA-OD1 3.19Å; A719-D721 PolarHBondContact O-N 3.21Å; A719-D721 VanDerWaalsContact O-N 3.15Å; D721-Y724 PolarHBondContact O-N 2.86Å; D721-L725 HydrophobicContact CB-CD1 4.31Å; D721-L725 PolarHBondContact O-N 3.09Å
722	L	89.6	Confident	78.8	Confident	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-55.2	-45.4	-177.2	-68	-171.5	0	0	0	114.9	F223 Y237 Y305 L335 A719 Y724 L725 L726 F739	F223-L722 HydrophobicContact CE2-CD2 4.36Å; F223-L722 HydrophobicContact CZ-CD1 4.32Å; F223-L722 HydrophobicContact CZ-CD2 4.37Å; Y237-L722 HydrophobicContact CE1-CD1 3.84Å; Y305-L722 HydrophobicContact CD1-CD1 4.08Å; Y305-L722 HydrophobicContact CD2-CD1 3.91Å; Y305-L722 HydrophobicContact CD2-CD2 3.79Å; Y305-L722 HydrophobicContact CD2-CG 3.89Å; Y305-L722 HydrophobicContact CE1-CD1 4.44Å; Y305-L722 HydrophobicContact CE2-CD1 4.23Å; Y305-L722 HydrophobicContact CE2-CG 4.18Å; Y305-L722 HydrophobicContact CG-CD1 3.83Å; Y305-L722 HydrophobicContact CG-CD2 4.15Å; Y305-L722 HydrophobicContact CG-CG 4.29Å; L335-L722 HydrophobicContact CD1-CD2 3.69Å; A719-L722 HydrophobicContact CB-CB 4.32Å; A719-L722 HydrophobicContact CB-CD1 3.68Å; A719-L722 HydrophobicContact CB-CG 3.83Å; A719-L722 WeakPolarHBondContact O-CB 3.28Å; A719-L722 PolarHBondContact O-N 3.24Å; A719-L722 VanDerWaalsContact O-N 3.1Å; L722-Y724 PolarHBondContact O-N 3.01Å; L722-L725 PolarHBondContact O-N 2.8Å; L722-L725 VanDerWaalsContact O-N 3.11Å; L722-L726 WeakPolarHBondContact O-CB 3.44Å; L722-L726 WeakPolarHBondContact O-CG 3.45Å; L722-L726 PolarHBondContact O-N 2.9Å; L722-F739 HydrophobicContact CB-CE1 3.72Å; L722-F739 HydrophobicContact CB-CZ 3.66Å
723	P	87.4	Confident	78.6	Confident	9 Å²	9	15.8 Å²	15.8	6%	0.058	9%	0.088	C	C	.	.	H	α-helix	trans	-59.5	-36.3	-178.6	5.9	-10.4	0	0	0	112.4	A719 G727 A728 P729 F739 Y743	A719-P723 WeakPolarHBondContact O-CD 3.06Å; P723-G727 PolarHBondContact O-N 2.99Å; P723-G727 VanDerWaalsContact O-N 3.1Å; P723-A728 HydrophobicContact CB-CB 3.59Å; P723-A728 WeakPolarHBondContact O-CB 3.23Å; P723-A728 PolarHBondContact O-N 2.79Å; P723-P729 VanDerWaalsContact O-CD 3.25Å; P723-P729 WeakPolarHBondContact O-CD 3.07Å; P723-F739 HydrophobicContact CB-CB 3.89Å; P723-F739 HydrophobicContact CB-CD1 3.84Å; P723-F739 HydrophobicContact CB-CD2 3.72Å; P723-F739 HydrophobicContact CB-CE1 4.29Å; P723-F739 HydrophobicContact CB-CE2 4.16Å; P723-F739 HydrophobicContact CB-CG 3.54Å; P723-F739 HydrophobicContact CB-CZ 4.43Å; P723-F739 VanDerWaalsContact CD-CE1 3.45Å; P723-F739 HydrophobicContact CG-CB 4.04Å; P723-F739 HydrophobicContact CG-CD1 3.48Å; P723-F739 VanDerWaalsContact CG-CD1 3.48Å; P723-F739 HydrophobicContact CG-CD2 4.3Å; P723-F739 HydrophobicContact CG-CE1 3.94Å; P723-F739 HydrophobicContact CG-CG 3.69Å; P723-Y743 HydrophobicContact CB-CE1 4.45Å; P723-Y743 WeakPolarHBondContact CB-OH 3.49Å
724	Y	90.3	Very high	78.2	Confident	9 Å²	9	17.5 Å²	17.5	4%	0.035	10%	0.098	C	C	.	.	H	α-helix	trans	-73.2	-34.2	178.8	-60.6	-88.2	0	0	0	112.6	F692 Y694 T696 D720 D721 L722 P729 D747 I750 S751	F692-Y724 HydrophobicContact CE1-CD2 4.27Å; F692-Y724 HydrophobicContact CE1-CE2 4.29Å; F692-Y724 HydrophobicContact CE2-CD2 4.1Å; F692-Y724 HydrophobicContact CE2-CG 4.37Å; F692-Y724 AromaticContact CZ-CD2 3.46Å; F692-Y724 HydrophobicContact CZ-CD2 3.46Å; F692-Y724 VanDerWaalsContact CZ-CD2 3.46Å; F692-Y724 AromaticContact CZ-CE2 3.63Å; F692-Y724 HydrophobicContact CZ-CE2 3.63Å; F692-Y724 HydrophobicContact CZ-CG 4.13Å; Y694-Y724 HydrophobicContact CD1-CE1 4Å; Y694-Y724 HydrophobicContact CD1-CE2 4.47Å; Y694-Y724 AromaticContact CD1-CZ 3.82Å; Y694-Y724 AromaticContact CE1-CE1 3.79Å; Y694-Y724 HydrophobicContact CE1-CE1 3.79Å; Y694-Y724 AromaticContact CE1-CZ 3.78Å; Y694-Y724 WeakPolarHBondContact CE1-OH 3.27Å; T696-Y724 WeakPolarHBondContact CG2-OH 3.36Å; D720-Y724 WeakPolarHBondContact O-CD2 3.48Å; D720-Y724 WeakPolarHBondContact O-CE2 3.46Å; D721-Y724 PolarHBondContact O-N 2.86Å; L722-Y724 PolarHBondContact O-N 3.01Å; Y724-P729 HydrophobicContact CD1-CG 4.49Å; Y724-D747 HydrophobicContact CE1-CB 3.82Å; Y724-D747 PolarHBondContact OH-OD1 2.98Å; Y724-D747 VanDerWaalsContact OH-OD1 3.1Å; Y724-I750 HydrophobicContact CD1-CB 4.29Å; Y724-I750 HydrophobicContact CD1-CG2 3.85Å; Y724-I750 HydrophobicContact CE1-CG2 4.29Å; Y724-I750 HydrophobicContact CG-CG2 4.47Å; Y724-S751 WeakPolarHBondContact O-CA 3.46Å; Y724-S751 WeakPolarHBondContact O-CB 2.9Å; Y724-S751 PolarHBondContact O-OG 2.91Å
725	L	92.2	Very high	77.8	Confident	12 Å²	12	24.1 Å²	24.1	6%	0.063	13%	0.128	C	C	.	.	H	α-helix	trans	-74	-34.1	177.4	-70	166.6	0	0	0	112.8	L335 D721 L722 L754 M755 L758	L335-L725 HydrophobicContact CD1-CD1 3.67Å; L335-L725 HydrophobicContact CD2-CD1 4.17Å; D721-L725 HydrophobicContact CB-CD1 4.31Å; D721-L725 PolarHBondContact O-N 3.09Å; L722-L725 PolarHBondContact O-N 2.8Å; L722-L725 VanDerWaalsContact O-N 3.11Å; L725-L754 HydrophobicContact CD2-CB 4.18Å; L725-L754 HydrophobicContact CD2-CD2 4.35Å; L725-M755 WeakPolarHBondContact O-CG 3.48Å; L725-L758 HydrophobicContact CB-CD2 4.46Å; L725-L758 HydrophobicContact CD2-CD2 4.4Å
726	L	91	Very high	76.7	Confident	7 Å²	7	25 Å²	25	4%	0.037	13%	0.134	C	C	.	.	H	α-helix	trans	-91.8	-13.8	-177.1	-61.3	-178.2	0	0	0	113.9	F223 Y237 L239 L242 L722 F739	F223-L726 HydrophobicContact CE2-CD2 4.49Å; Y237-L726 HydrophobicContact CD1-CD1 3.93Å; L239-L726 HydrophobicContact CD2-CD2 3.74Å; L242-L726 HydrophobicContact CD2-CD2 4.06Å; L722-L726 WeakPolarHBondContact O-CB 3.44Å; L722-L726 WeakPolarHBondContact O-CG 3.45Å; L722-L726 PolarHBondContact O-N 2.9Å; L726-F739 HydrophobicContact CD1-CE2 4.36Å; L726-F739 HydrophobicContact CD1-CZ 4.24Å
727	G	88.3	Confident	75.6	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.5	17.9	178.5	0	0	0	0	0	114.8	P723 P729 F730 M755	P723-G727 PolarHBondContact O-N 2.99Å; P723-G727 VanDerWaalsContact O-N 3.1Å; G727-P729 VanDerWaalsContact C-N 3.27Å; G727-P729 VanDerWaalsContact O-N 3.15Å; G727-F730 WeakPolarHBondContact O-CB 3.14Å; G727-F730 WeakPolarHBondContact O-CD2 3.46Å; G727-F730 PolarHBondContact O-N 3.01Å; G727-M755 VanDerWaalsContact CA-SD 3.56Å
728	A	84.2	Confident	74.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-49.4	-36.8	177	0	0	0	0	0	114.6	P723 F730 I731 S732 E737 F739 Y743	P723-A728 HydrophobicContact CB-CB 3.59Å; P723-A728 WeakPolarHBondContact O-CB 3.23Å; P723-A728 PolarHBondContact O-N 2.79Å; A728-F730 PolarHBondContact O-N 3.08Å; A728-I731 PolarHBondContact O-N 2.94Å; A728-I731 VanDerWaalsContact O-N 3.16Å; A728-S732 WeakPolarHBondContact O-CB 3.17Å; A728-S732 PolarHBondContact O-N 3.07Å; A728-S732 VanDerWaalsContact O-N 3.07Å; A728-S732 PolarHBondContact O-OG 2.64Å; A728-E737 WeakPolarHBondContact CA-OE2 3.46Å; A728-E737 WeakPolarHBondContact CB-OE2 3.38Å; A728-F739 HydrophobicContact CB-CD2 3.63Å; A728-F739 HydrophobicContact CB-CE2 4.21Å; A728-F739 HydrophobicContact CB-CG 4.45Å; A728-Y743 HydrophobicContact CB-CE2 4.39Å
729	P	85.4	Confident	73.8	Confident	4 Å²	4	25.5 Å²	25.5	3%	0.026	14%	0.135	C	C	.	.	H	α-helix	trans	-58.4	-11.2	176.2	-28.6	38.2	0	0	0	116	P723 Y724 G727 Y743 K748	P723-P729 VanDerWaalsContact O-CD 3.25Å; P723-P729 WeakPolarHBondContact O-CD 3.07Å; Y724-P729 HydrophobicContact CD1-CG 4.49Å; G727-P729 VanDerWaalsContact C-N 3.27Å; G727-P729 VanDerWaalsContact O-N 3.15Å; P729-Y743 HydrophobicContact CB-CD1 4.23Å; P729-Y743 HydrophobicContact CB-CD2 4.17Å; P729-Y743 HydrophobicContact CB-CG 3.91Å; P729-Y743 HydrophobicContact CG-CD1 3.87Å; P729-Y743 HydrophobicContact CG-CD2 4.34Å; P729-Y743 HydrophobicContact CG-CE1 4.03Å; P729-Y743 HydrophobicContact CG-CE2 4.46Å; P729-Y743 HydrophobicContact CG-CG 4.03Å; P729-K748 HydrophobicContact CB-CG 3.89Å; P729-K748 VanDerWaalsContact O-CE 3.28Å; P729-K748 WeakPolarHBondContact O-CE 3.25Å
730	F	80.7	Confident	73	Confident	36 Å²	36	27.1 Å²	27.1	16%	0.158	15%	0.147	C	C	.	.	H	α-helix	trans	-101.1	-23.3	179.2	-61.5	-72.5	0	0	0	114.3	P79 L80 V241 G727 A728 K748 V752 M755	P79-F730 WeakPolarHBondContact CG-O 3.44Å; L80-F730 HydrophobicContact CD1-CB 3.66Å; L80-F730 HydrophobicContact CD1-CD1 3.46Å; L80-F730 VanDerWaalsContact CD1-CD1 3.46Å; L80-F730 HydrophobicContact CD1-CE1 4.21Å; L80-F730 HydrophobicContact CD1-CG 3.62Å; L80-F730 HydrophobicContact CD2-CD1 4.13Å; L80-F730 HydrophobicContact CG-CB 4.36Å; L80-F730 HydrophobicContact CG-CD1 4.16Å; V241-F730 HydrophobicContact CG1-CD2 4.36Å; G727-F730 WeakPolarHBondContact O-CB 3.14Å; G727-F730 WeakPolarHBondContact O-CD2 3.46Å; G727-F730 PolarHBondContact O-N 3.01Å; A728-F730 PolarHBondContact O-N 3.08Å; F730-K748 HydrophobicContact CD1-CD 4.45Å; F730-K748 HydrophobicContact CD1-CG 4.34Å; F730-K748 HydrophobicContact CE1-CB 3.88Å; F730-K748 HydrophobicContact CE1-CD 4.19Å; F730-K748 HydrophobicContact CE1-CG 3.95Å; F730-K748 HydrophobicContact CZ-CB 3.85Å; F730-K748 HydrophobicContact CZ-CG 4.25Å; F730-V752 HydrophobicContact CE1-CG2 4.5Å; F730-V752 HydrophobicContact CE2-CG2 4.14Å; F730-V752 HydrophobicContact CZ-CG2 3.52Å; F730-M755 HydrophobicContact CD2-CE 3.97Å; F730-M755 HydrophobicContact CE2-CE 3.53Å
731	I	72.4	Confident	71.9	Confident	21 Å²	21	28.4 Å²	28.4	11%	0.108	15%	0.154	C	C	.	.	H	α-helix	trans	-101.3	-21.9	-178.6	-45.2	178.5	0	0	0	111.6	I51 V241 A728 P733	I51-I731 HydrophobicContact CD1-CG2 4.03Å; I51-I731 HydrophobicContact CG1-CG2 4.35Å; V241-I731 HydrophobicContact CB-CD1 3.99Å; V241-I731 HydrophobicContact CB-CG1 4.29Å; V241-I731 HydrophobicContact CG2-CD1 3.35Å; V241-I731 HydrophobicContact CG2-CG1 3.31Å; A728-I731 PolarHBondContact O-N 2.94Å; A728-I731 VanDerWaalsContact O-N 3.16Å; I731-P733 VanDerWaalsContact C-CD 3.44Å; I731-P733 WeakPolarHBondContact O-CD 3.42Å; I731-P733 VanDerWaalsContact O-N 3.14Å
732	S	56.9	Low	70.9	Confident	20 Å²	20	32.3 Å²	32.3	14%	0.14	17%	0.172	C	C	.	.			trans	-81	92.6	-172.2	-73.1	0	0	0	0	113.6	A728	A728-S732 WeakPolarHBondContact O-CB 3.17Å; A728-S732 PolarHBondContact O-N 3.07Å; A728-S732 VanDerWaalsContact O-N 3.07Å; A728-S732 PolarHBondContact O-OG 2.64Å
733	P	49.6	Very low	70.3	Confident	95 Å²	95	34 Å²	34	62%	0.617	18%	0.178	S	C	*	.	S	Bend	trans	-110.9	-2.9	133.5	-8.8	26.7	0	0	0	114.3	I731	I731-P733 VanDerWaalsContact C-CD 3.44Å; I731-P733 WeakPolarHBondContact O-CD 3.42Å; I731-P733 VanDerWaalsContact O-N 3.14Å
734	N	47.7	Very low	70	Confident	70 Å²	70	35.2 Å²	35.2	37%	0.374	19%	0.186	S	C	.	.	S	Bend	trans	-130.8	143.7	-170.2	-70.9	-47.4	0	0	0	114.1	N49 L736	N49-N734 VanDerWaalsContact C-ND2 3.25Å; N49-N734 HydrophobicContact CB-CB 4.19Å; N49-N734 WeakPolarHBondContact CB-ND2 3.44Å; N49-N734 VanDerWaalsContact O-CB 3.31Å; N49-N734 WeakPolarHBondContact O-CB 3.38Å; N49-N734 PolarHBondContact O-ND2 3.05Å; N734-L736 VanDerWaalsContact C-N 3.26Å; N734-L736 PolarHBondContact O-N 2.82Å
735	Q	50.8	Low	69.6	Low	144 Å²	144	40.4 Å²	40.4	67%	0.673	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	27.3	-154	-60.6	171.9	-2.7	0	0	118	H187	H187-Q735 PolarHBondContact CE1-O 2.91Å; H187-Q735 PolarHBondContact ND1-O 2.98Å
736	L	50.3	Low	69.2	Low	51 Å²	51	43.5 Å²	43.5	27%	0.267	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-23.7	-162.6	-72.3	162.3	0	0	0	115.3	M47 F191 N734	M47-L736 HydrophobicContact CG-CD2 4.48Å; M47-L736 WeakPolarHBondContact O-CD1 3.44Å; F191-L736 WeakPolarHBondContact CE2-O 3.47Å; F191-L736 WeakPolarHBondContact CZ-O 3.35Å; N734-L736 VanDerWaalsContact C-N 3.26Å; N734-L736 PolarHBondContact O-N 2.82Å
737	E	57	Low	68.9	Low	15 Å²	15	43.2 Å²	43.2	7%	0.07	23%	0.228	C	C	.	.	S	Bend	trans	-80.1	153.9	169.2	-75	-172.6	168.8	0	0	111	H187 A728 F739	H187-E737 VanDerWaalsContact CB-O 3.25Å; H187-E737 WeakPolarHBondContact CB-O 3.42Å; A728-E737 WeakPolarHBondContact CA-OE2 3.46Å; A728-E737 WeakPolarHBondContact CB-OE2 3.38Å; E737-F739 HydrophobicContact CB-CD2 3.78Å; E737-F739 HydrophobicContact CB-CE2 4.39Å; E737-F739 PolarHBondContact O-N 2.84Å; E737-F739 WeakPolarHBondContact OE2-CD2 3.29Å
738	P	55.1	Low	68.8	Low	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-68.6	22.2	178.3	31.8	-37.9	0	0	0	114	R184 L188 A236 Y237	R184-P738 WeakPolarHBondContact CA-O 3.36Å; R184-P738 VanDerWaalsContact CB-O 3.25Å; R184-P738 WeakPolarHBondContact CB-O 3.26Å; R184-P738 HydrophobicContact CG-CB 4.17Å; R184-P738 VanDerWaalsContact CG-O 3.27Å; R184-P738 WeakPolarHBondContact CG-O 3.49Å; L188-P738 HydrophobicContact CD2-CB 3.65Å; L188-P738 HydrophobicContact CD2-CG 4.16Å; L188-P738 HydrophobicContact CG-CB 3.72Å; A236-P738 WeakPolarHBondContact O-CD 3.38Å; Y237-P738 HydrophobicContact CD1-CG 4.47Å; Y237-P738 HydrophobicContact CE1-CG 4.1Å
739	F	68	Low	68.9	Low	10 Å²	10	53.6 Å²	53.6	4%	0.044	27%	0.273	C	S	.	.	S	Bend	trans	-121.7	167.1	-172.7	-47.6	-56.1	0	0	0	111.6	Y237 L722 P723 L726 A728 E737 Y743	Y237-F739 HydrophobicContact CD1-CZ 4.4Å; Y237-F739 HydrophobicContact CE1-CZ 4.28Å; L722-F739 HydrophobicContact CB-CE1 3.72Å; L722-F739 HydrophobicContact CB-CZ 3.66Å; P723-F739 HydrophobicContact CB-CB 3.89Å; P723-F739 HydrophobicContact CB-CD1 3.84Å; P723-F739 HydrophobicContact CB-CD2 3.72Å; P723-F739 HydrophobicContact CB-CE1 4.29Å; P723-F739 HydrophobicContact CB-CE2 4.16Å; P723-F739 HydrophobicContact CB-CG 3.54Å; P723-F739 HydrophobicContact CB-CZ 4.43Å; P723-F739 VanDerWaalsContact CD-CE1 3.45Å; P723-F739 HydrophobicContact CG-CB 4.04Å; P723-F739 HydrophobicContact CG-CD1 3.48Å; P723-F739 VanDerWaalsContact CG-CD1 3.48Å; P723-F739 HydrophobicContact CG-CD2 4.3Å; P723-F739 HydrophobicContact CG-CE1 3.94Å; P723-F739 HydrophobicContact CG-CG 3.69Å; L726-F739 HydrophobicContact CD1-CE2 4.36Å; L726-F739 HydrophobicContact CD1-CZ 4.24Å; A728-F739 HydrophobicContact CB-CD2 3.63Å; A728-F739 HydrophobicContact CB-CE2 4.21Å; A728-F739 HydrophobicContact CB-CG 4.45Å; E737-F739 HydrophobicContact CB-CD2 3.78Å; E737-F739 HydrophobicContact CB-CE2 4.39Å; E737-F739 PolarHBondContact O-N 2.84Å; E737-F739 WeakPolarHBondContact OE2-CD2 3.29Å; F739-Y743 WeakPolarHBondContact CB-OH 3.48Å
740	S	62.9	Low	69.1	Low	35 Å²	35	53.6 Å²	53.6	25%	0.245	27%	0.273	C	S	.	.			trans	-67.2	145.3	-179.1	61.2	0	0	0	0	112.2	E742 Y743	S740-E742 VanDerWaalsContact C-N 3.27Å; S740-E742 PolarHBondContact O-N 2.87Å; S740-Y743 WeakPolarHBondContact O-CE2 3.34Å; S740-Y743 VanDerWaalsContact O-CZ 3.23Å; S740-Y743 PolarHBondContact O-OH 2.9Å
741	N	60.7	Low	69.5	Low	58 Å²	58	51.9 Å²	51.9	31%	0.31	27%	0.265	S	S	.	.	S	Bend	trans	-83.1	5	177.5	-58.5	-27.4	0	0	0	114.4
742	E	68.5	Low	70.4	Confident	82 Å²	82	52 Å²	52	38%	0.383	27%	0.267	S	S	.	.			trans	-119.9	89.3	-170.4	-63.9	-179.1	-126	0	0	110.9	K179 Q698 S740	K179-E742 IonicContact NZ-OE1 2.77Å; K179-E742 PolarHBondContact NZ-OE1 3.1Å; K179-E742 VanDerWaalsContact NZ-OE1 3.1Å; Q698-E742 PolarHBondContact NE2-OE2 2.87Å; Q698-E742 PolarHBondContact OE1-OE2 2.86Å; S740-E742 VanDerWaalsContact C-N 3.27Å; S740-E742 PolarHBondContact O-N 2.87Å
743	Y	76.4	Confident	72	Confident	35 Å²	35	52.4 Å²	52.4	14%	0.137	27%	0.267	C	S	.	.			trans	-111.9	143	176	-62.5	-70.5	0	0	0	112.4	P723 A728 P729 F739 S740 D747	P723-Y743 HydrophobicContact CB-CE1 4.45Å; P723-Y743 WeakPolarHBondContact CB-OH 3.49Å; A728-Y743 HydrophobicContact CB-CE2 4.39Å; P729-Y743 HydrophobicContact CB-CD1 4.23Å; P729-Y743 HydrophobicContact CB-CD2 4.17Å; P729-Y743 HydrophobicContact CB-CG 3.91Å; P729-Y743 HydrophobicContact CG-CD1 3.87Å; P729-Y743 HydrophobicContact CG-CD2 4.34Å; P729-Y743 HydrophobicContact CG-CE1 4.03Å; P729-Y743 HydrophobicContact CG-CE2 4.46Å; P729-Y743 HydrophobicContact CG-CG 4.03Å; F739-Y743 WeakPolarHBondContact CB-OH 3.48Å; S740-Y743 WeakPolarHBondContact O-CE2 3.34Å; S740-Y743 VanDerWaalsContact O-CZ 3.23Å; S740-Y743 PolarHBondContact O-OH 2.9Å; Y743-D747 HydrophobicContact CD1-CB 3.98Å
744	T	81.6	Confident	74	Confident	36 Å²	36	48 Å²	48	22%	0.221	24%	0.239	C	C	.	.			trans	-96	167.2	175	68.7	0	0	0	0	111.7	M746 D747 K748	T744-M746 PolarHBondContact O-N 2.73Å; T744-M746 PolarHBondContact OG1-N 2.76Å; T744-D747 WeakPolarHBondContact CA-OD2 3.22Å; T744-D747 WeakPolarHBondContact CB-OD2 3.45Å; T744-D747 PolarHBondContact N-OD2 2.9Å; T744-D747 WeakPolarHBondContact O-CB 3.42Å; T744-D747 PolarHBondContact O-N 3.44Å; T744-D747 VanDerWaalsContact OG1-CG 3.28Å; T744-D747 PolarHBondContact OG1-N 2.82Å; T744-D747 PolarHBondContact OG1-OD2 3.46Å; T744-K748 PolarHBondContact O-N 3.41Å; T744-K748 VanDerWaalsContact O-N 3.1Å
745	D	82	Confident	76.1	Confident	118 Å²	118	44.8 Å²	44.8	63%	0.631	22%	0.221	S	C	*	.	H	α-helix	trans	-61.9	-26.1	174.2	-66	-31.8	0	0	0	113	K748 K749	D745-K748 IonicContact OD1-NZ 3.91Å; D745-K749 WeakPolarHBondContact O-CG 3.3Å; D745-K749 PolarHBondContact O-N 2.76Å; D745-K749 VanDerWaalsContact O-N 3.12Å
746	M	83.2	Confident	78.1	Confident	77 Å²	77	38 Å²	38	38%	0.379	19%	0.19	S	C	.	.	H	α-helix	trans	-69.5	-39.4	172.5	-175.4	170.7	-83.2	0	0	111.4	T744 K748 K749 I750 H824	T744-M746 PolarHBondContact O-N 2.73Å; T744-M746 PolarHBondContact OG1-N 2.76Å; M746-K748 VanDerWaalsContact C-N 3.33Å; M746-K748 PolarHBondContact O-N 2.84Å; M746-K749 WeakPolarHBondContact O-CB 3.37Å; M746-K749 PolarHBondContact O-N 2.92Å; M746-I750 HydrophobicContact CG-CD1 4.16Å; M746-I750 PolarHBondContact O-N 3.15Å; M746-H824 PolarHBondContact SD-NE2 3.48Å
747	D	84.9	Confident	80.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.7	-42.2	175.9	-59.9	-52.1	0	0	0	111.1	Y694 Y724 Y743 T744 K749 I750 S751	Y694-D747 WeakPolarHBondContact CE1-OD1 3.25Å; Y694-D747 PolarHBondContact OH-OD1 2.86Å; Y724-D747 HydrophobicContact CE1-CB 3.82Å; Y724-D747 PolarHBondContact OH-OD1 2.98Å; Y724-D747 VanDerWaalsContact OH-OD1 3.1Å; Y743-D747 HydrophobicContact CD1-CB 3.98Å; T744-D747 WeakPolarHBondContact CA-OD2 3.22Å; T744-D747 WeakPolarHBondContact CB-OD2 3.45Å; T744-D747 PolarHBondContact N-OD2 2.9Å; T744-D747 WeakPolarHBondContact O-CB 3.42Å; T744-D747 PolarHBondContact O-N 3.44Å; T744-D747 VanDerWaalsContact OG1-CG 3.28Å; T744-D747 PolarHBondContact OG1-N 2.82Å; T744-D747 PolarHBondContact OG1-OD2 3.46Å; D747-K749 PolarHBondContact O-N 2.78Å; D747-I750 PolarHBondContact O-N 2.89Å; D747-S751 WeakPolarHBondContact O-CB 3.33Å; D747-S751 PolarHBondContact O-N 2.77Å
748	K	86.4	Confident	81.9	Confident	76 Å²	76	35.6 Å²	35.6	33%	0.33	18%	0.178	S	C	.	.	H	α-helix	trans	-57.2	-47.8	171.9	-70.1	175.7	179.6	169.9	0	111.5	P729 F730 T744 D745 M746 I750 S751 V752	P729-K748 HydrophobicContact CB-CG 3.89Å; P729-K748 VanDerWaalsContact O-CE 3.28Å; P729-K748 WeakPolarHBondContact O-CE 3.25Å; F730-K748 HydrophobicContact CD1-CD 4.45Å; F730-K748 HydrophobicContact CD1-CG 4.34Å; F730-K748 HydrophobicContact CE1-CB 3.88Å; F730-K748 HydrophobicContact CE1-CD 4.19Å; F730-K748 HydrophobicContact CE1-CG 3.95Å; F730-K748 HydrophobicContact CZ-CB 3.85Å; F730-K748 HydrophobicContact CZ-CG 4.25Å; T744-K748 PolarHBondContact O-N 3.41Å; T744-K748 VanDerWaalsContact O-N 3.1Å; D745-K748 IonicContact OD1-NZ 3.91Å; M746-K748 VanDerWaalsContact C-N 3.33Å; M746-K748 PolarHBondContact O-N 2.84Å; K748-I750 PolarHBondContact O-N 3.37Å; K748-S751 WeakPolarHBondContact O-CB 3.34Å; K748-S751 PolarHBondContact O-N 2.82Å; K748-V752 WeakPolarHBondContact O-CG2 3.38Å; K748-V752 PolarHBondContact O-N 2.8Å
749	K	86.7	Confident	83.7	Confident	143 Å²	143	35.6 Å²	35.6	62%	0.622	18%	0.178	S	C	*	.	H	α-helix	trans	-60.1	-42.8	178.4	-73.7	177.1	-177.2	-174.4	0	112.7	D745 M746 D747 S751 V752 N753	D745-K749 WeakPolarHBondContact O-CG 3.3Å; D745-K749 PolarHBondContact O-N 2.76Å; D745-K749 VanDerWaalsContact O-N 3.12Å; M746-K749 WeakPolarHBondContact O-CB 3.37Å; M746-K749 PolarHBondContact O-N 2.92Å; D747-K749 PolarHBondContact O-N 2.78Å; K749-S751 VanDerWaalsContact C-N 3.34Å; K749-V752 PolarHBondContact O-N 3.09Å; K749-N753 PolarHBondContact O-N 3.42Å; K749-N753 VanDerWaalsContact O-N 3.11Å
750	I	89.3	Confident	84.9	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.021	18%	0.176	C	C	.	.	H	α-helix	trans	-65.7	-40.8	177.9	-72.1	165	0	0	0	110.8	Y694 Y724 M746 D747 K748 N753 L754 V796 H824 F825	Y694-I750 HydrophobicContact CD1-CD1 3.65Å; Y694-I750 HydrophobicContact CD1-CG2 4.27Å; Y694-I750 HydrophobicContact CD2-CD1 3.42Å; Y694-I750 VanDerWaalsContact CD2-CD1 3.42Å; Y694-I750 HydrophobicContact CE1-CD1 3.33Å; Y694-I750 HydrophobicContact CE2-CD1 3.11Å; Y694-I750 HydrophobicContact CG-CD1 3.68Å; Y724-I750 HydrophobicContact CD1-CB 4.29Å; Y724-I750 HydrophobicContact CD1-CG2 3.85Å; Y724-I750 HydrophobicContact CE1-CG2 4.29Å; Y724-I750 HydrophobicContact CG-CG2 4.47Å; M746-I750 HydrophobicContact CG-CD1 4.16Å; M746-I750 PolarHBondContact O-N 3.15Å; D747-I750 PolarHBondContact O-N 2.89Å; K748-I750 PolarHBondContact O-N 3.37Å; I750-N753 PolarHBondContact O-N 3.03Å; I750-L754 HydrophobicContact CG2-CD1 4.07Å; I750-L754 PolarHBondContact O-N 3.39Å; I750-V796 HydrophobicContact CG2-CG1 4.25Å; I750-H824 HydrophobicContact CD1-CB 4.48Å; I750-F825 HydrophobicContact CG1-CE2 4.23Å; I750-F825 HydrophobicContact CG2-CZ 4.27Å
751	S	89.7	Confident	86.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.6	-44.7	174.3	-179	0	0	0	0	112.1	Y724 D747 K748 K749 N753 L754 M755	Y724-S751 WeakPolarHBondContact O-CA 3.46Å; Y724-S751 WeakPolarHBondContact O-CB 2.9Å; Y724-S751 PolarHBondContact O-OG 2.91Å; D747-S751 WeakPolarHBondContact O-CB 3.33Å; D747-S751 PolarHBondContact O-N 2.77Å; K748-S751 WeakPolarHBondContact O-CB 3.34Å; K748-S751 PolarHBondContact O-N 2.82Å; K749-S751 VanDerWaalsContact C-N 3.34Å; S751-N753 VanDerWaalsContact C-N 3.33Å; S751-N753 PolarHBondContact O-N 3Å; S751-L754 PolarHBondContact O-N 2.79Å; S751-M755 WeakPolarHBondContact O-CB 3.39Å; S751-M755 WeakPolarHBondContact O-CG 3.36Å; S751-M755 PolarHBondContact O-N 3.26Å
752	V	90	Very high	88.1	Confident	22 Å²	22	30.9 Å²	30.9	13%	0.133	15%	0.15	C	C	.	.	H	α-helix	trans	-55.3	-47.9	173.7	175.6	0	0	0	0	111.5	Y245 F730 K748 K749 L754 M755 N756	Y245-V752 WeakPolarHBondContact OH-CG1 3.41Å; F730-V752 HydrophobicContact CE1-CG2 4.5Å; F730-V752 HydrophobicContact CE2-CG2 4.14Å; F730-V752 HydrophobicContact CZ-CG2 3.52Å; K748-V752 WeakPolarHBondContact O-CG2 3.38Å; K748-V752 PolarHBondContact O-N 2.8Å; K749-V752 PolarHBondContact O-N 3.09Å; V752-L754 PolarHBondContact O-N 3.36Å; V752-M755 PolarHBondContact O-N 2.73Å; V752-N756 WeakPolarHBondContact O-CB 3.41Å; V752-N756 PolarHBondContact O-N 2.95Å; V752-N756 PolarHBondContact O-ND2 3.34Å
753	N	90.5	Very high	89.3	Confident	29 Å²	29	28.2 Å²	28.2	16%	0.155	14%	0.137	C	C	.	.	H	α-helix	trans	-65.3	-40.3	-177.9	-72.7	-11.8	0	0	0	112.2	K749 I750 S751 N756 Y757 P780 F825	K749-N753 PolarHBondContact O-N 3.42Å; K749-N753 VanDerWaalsContact O-N 3.11Å; I750-N753 PolarHBondContact O-N 3.03Å; S751-N753 VanDerWaalsContact C-N 3.33Å; S751-N753 PolarHBondContact O-N 3Å; N753-N756 WeakPolarHBondContact O-CB 3.33Å; N753-N756 PolarHBondContact O-N 3.35Å; N753-Y757 WeakPolarHBondContact O-CD2 3.08Å; N753-Y757 PolarHBondContact O-N 3.05Å; N753-P780 HydrophobicContact CB-CG 4.2Å; N753-F825 HydrophobicContact CB-CE1 4.03Å; N753-F825 HydrophobicContact CB-CE2 3.76Å; N753-F825 HydrophobicContact CB-CZ 3.4Å; N753-F825 WeakPolarHBondContact ND2-CE2 3.44Å
754	L	92.8	Very high	90	Very high	4 Å²	4	29.6 Å²	29.6	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-68.1	-43.5	175.9	-80.1	172.9	0	0	0	112.2	L690 F692 L725 I750 S751 V752 N756 Y757 L758 V796 F825	L690-L754 HydrophobicContact CD1-CD2 4.43Å; L690-L754 HydrophobicContact CD2-CD2 4.35Å; F692-L754 HydrophobicContact CD2-CD1 4.2Å; F692-L754 HydrophobicContact CE2-CD1 3.87Å; L725-L754 HydrophobicContact CD2-CB 4.18Å; L725-L754 HydrophobicContact CD2-CD2 4.35Å; I750-L754 HydrophobicContact CG2-CD1 4.07Å; I750-L754 PolarHBondContact O-N 3.39Å; S751-L754 PolarHBondContact O-N 2.79Å; V752-L754 PolarHBondContact O-N 3.36Å; L754-N756 VanDerWaalsContact C-N 3.29Å; L754-N756 PolarHBondContact O-N 2.75Å; L754-Y757 PolarHBondContact O-N 2.87Å; L754-L758 WeakPolarHBondContact O-CB 3.17Å; L754-L758 PolarHBondContact O-N 3.14Å; L754-V796 HydrophobicContact CD2-CG2 4.21Å; L754-F825 HydrophobicContact CD2-CE1 4.25Å; L754-F825 HydrophobicContact CG-CE1 4.25Å; L754-F825 HydrophobicContact CG-CZ 4.31Å
755	M	92.2	Very high	90.6	Very high	1 Å²	1	28 Å²	28	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-62.7	-34.7	174.3	-71.7	-170.1	-63.1	0	0	112	V241 L242 Y245 L725 G727 F730 S751 V752 L758 A759	V241-M755 HydrophobicContact CG1-CE 4.44Å; V241-M755 HydrophobicContact CG1-SD 4.08Å; L242-M755 HydrophobicContact CD1-CB 4.38Å; L242-M755 HydrophobicContact CD1-CG 4.11Å; L242-M755 HydrophobicContact CD1-SD 4.43Å; Y245-M755 HydrophobicContact CD1-CB 3.87Å; Y245-M755 HydrophobicContact CD2-CE 4.31Å; Y245-M755 HydrophobicContact CE1-CB 3.96Å; Y245-M755 HydrophobicContact CG-CE 4.39Å; Y245-M755 HydrophobicContact CG-SD 4.5Å; L725-M755 WeakPolarHBondContact O-CG 3.48Å; G727-M755 VanDerWaalsContact CA-SD 3.56Å; F730-M755 HydrophobicContact CD2-CE 3.97Å; F730-M755 HydrophobicContact CE2-CE 3.53Å; S751-M755 WeakPolarHBondContact O-CB 3.39Å; S751-M755 WeakPolarHBondContact O-CG 3.36Å; S751-M755 PolarHBondContact O-N 3.26Å; V752-M755 PolarHBondContact O-N 2.73Å; M755-L758 PolarHBondContact O-N 2.88Å; M755-A759 WeakPolarHBondContact O-CB 3.41Å; M755-A759 PolarHBondContact O-N 2.9Å
756	N	91.4	Very high	91.1	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.011	11%	0.114	C	C	.	.	H	α-helix	trans	-60.6	-50.4	172.4	-82.1	-27.9	0	0	0	112.1	Y245 V752 N753 L754 L758 A759 N760	Y245-N756 VanDerWaalsContact CE1-OD1 3.23Å; Y245-N756 WeakPolarHBondContact CE1-OD1 3.44Å; Y245-N756 VanDerWaalsContact CZ-OD1 3.29Å; Y245-N756 VanDerWaalsContact OH-CG 3.23Å; Y245-N756 PolarHBondContact OH-ND2 2.86Å; Y245-N756 PolarHBondContact OH-OD1 3.42Å; V752-N756 WeakPolarHBondContact O-CB 3.41Å; V752-N756 PolarHBondContact O-N 2.95Å; V752-N756 PolarHBondContact O-ND2 3.34Å; N753-N756 WeakPolarHBondContact O-CB 3.33Å; N753-N756 PolarHBondContact O-N 3.35Å; L754-N756 VanDerWaalsContact C-N 3.29Å; L754-N756 PolarHBondContact O-N 2.75Å; N756-L758 VanDerWaalsContact C-N 3.28Å; N756-L758 PolarHBondContact O-N 3.23Å; N756-A759 PolarHBondContact O-N 3.3Å; N756-N760 WeakPolarHBondContact O-CB 3.2Å; N756-N760 PolarHBondContact O-N 3.21Å; N756-N760 PolarHBondContact O-ND2 2.92Å
757	Y	93.6	Very high	91.6	Very high	3 Å²	3	19.9 Å²	19.9	1%	0.012	10%	0.096	C	C	.	.	H	α-helix	trans	-60	-42.3	176.4	-72.8	-58.3	0	0	0	111.6	N753 L754 F761 P767 I779 P780 V781 W783 L794 F825	N753-Y757 WeakPolarHBondContact O-CD2 3.08Å; N753-Y757 PolarHBondContact O-N 3.05Å; L754-Y757 PolarHBondContact O-N 2.87Å; Y757-F761 WeakPolarHBondContact O-CB 3.42Å; Y757-F761 PolarHBondContact O-N 3.24Å; Y757-P767 HydrophobicContact CD1-CB 3.89Å; Y757-P767 WeakPolarHBondContact CD1-O 3.5Å; Y757-P767 HydrophobicContact CG-CB 4.46Å; Y757-I779 HydrophobicContact CD1-CG2 3.87Å; Y757-I779 HydrophobicContact CE1-CB 3.84Å; Y757-I779 HydrophobicContact CE1-CD1 4.38Å; Y757-I779 HydrophobicContact CE1-CG2 3.64Å; Y757-P780 HydrophobicContact CE2-CG 3.99Å; Y757-P780 WeakPolarHBondContact OH-CD 3.24Å; Y757-P780 WeakPolarHBondContact OH-CG 3.34Å; Y757-V781 PolarHBondContact OH-N 3.46Å; Y757-V781 PolarHBondContact OH-O 2.95Å; Y757-W783 AromaticContact CD1-CE3 3.92Å; Y757-W783 HydrophobicContact CD1-CE3 3.92Å; Y757-W783 HydrophobicContact CE1-CB 4.3Å; Y757-W783 HydrophobicContact CE1-CE3 4.3Å; Y757-W783 HydrophobicContact CG-CE3 4.01Å; Y757-W783 HydrophobicContact CG-CZ3 4.22Å; Y757-L794 HydrophobicContact CD2-CD2 3.98Å; Y757-L794 HydrophobicContact CE2-CD2 3.67Å; Y757-F825 HydrophobicContact CD2-CE1 4.45Å; Y757-F825 AromaticContact CE2-CD1 3.91Å; Y757-F825 HydrophobicContact CE2-CD1 3.91Å; Y757-F825 AromaticContact CE2-CE1 3.95Å; Y757-F825 HydrophobicContact CE2-CE1 3.95Å
758	L	93.9	Very high	92	Very high	13 Å²	13	21 Å²	21	7%	0.068	10%	0.102	C	C	.	.	H	α-helix	trans	-65.2	-45.4	-179.9	-174.2	58.3	0	0	0	111.5	L242 I303 I333 L725 L754 M755 N756 F761 I762	L242-L758 HydrophobicContact CD1-CD2 3.94Å; L242-L758 HydrophobicContact CD1-CG 4.49Å; L242-L758 HydrophobicContact CD2-CD2 3.61Å; L242-L758 HydrophobicContact CG-CD2 4.44Å; I303-L758 HydrophobicContact CD1-CD1 4.46Å; I333-L758 HydrophobicContact CD1-CD1 3.26Å; L725-L758 HydrophobicContact CB-CD2 4.46Å; L725-L758 HydrophobicContact CD2-CD2 4.4Å; L754-L758 WeakPolarHBondContact O-CB 3.17Å; L754-L758 PolarHBondContact O-N 3.14Å; M755-L758 PolarHBondContact O-N 2.88Å; N756-L758 VanDerWaalsContact C-N 3.28Å; N756-L758 PolarHBondContact O-N 3.23Å; L758-F761 PolarHBondContact O-N 3.48Å; L758-I762 HydrophobicContact CD1-CD1 4.11Å; L758-I762 HydrophobicContact CD1-CG1 4.36Å; L758-I762 HydrophobicContact CG-CD1 3.86Å; L758-I762 WeakPolarHBondContact O-CB 3.43Å; L758-I762 VanDerWaalsContact O-CG1 3.24Å; L758-I762 WeakPolarHBondContact O-CG1 3.37Å; L758-I762 PolarHBondContact O-N 3.08Å
759	A	93.2	Very high	92.2	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-63.2	-47.3	177.5	0	0	0	0	0	111.5	S246 M755 N756 F761 I762 H763 F771	S246-A759 VanDerWaalsContact CB-CB 3.48Å; M755-A759 WeakPolarHBondContact O-CB 3.41Å; M755-A759 PolarHBondContact O-N 2.9Å; N756-A759 PolarHBondContact O-N 3.3Å; A759-F761 VanDerWaalsContact C-N 3.3Å; A759-F761 PolarHBondContact O-N 2.96Å; A759-I762 PolarHBondContact O-N 2.86Å; A759-H763 PolarHBondContact O-CD2 3.27Å; A759-H763 VanDerWaalsContact O-CD2 3.27Å; A759-H763 PolarHBondContact O-N 3.45Å; A759-F771 HydrophobicContact CB-CD1 4.05Å; A759-F771 HydrophobicContact CB-CE1 3.33Å; A759-F771 HydrophobicContact CB-CZ 3.88Å
760	N	94	Very high	92	Very high	3 Å²	3	21.2 Å²	21.2	2%	0.016	10%	0.104	C	C	.	.	H	α-helix	trans	-56	-45.5	174.2	-72.6	-9.2	0	0	0	111.5	N756 H763 N764 D766 P767 K769 E770 F771	N756-N760 WeakPolarHBondContact O-CB 3.2Å; N756-N760 PolarHBondContact O-N 3.21Å; N756-N760 PolarHBondContact O-ND2 2.92Å; N760-H763 PolarHBondContact O-N 3.17Å; N760-N764 WeakPolarHBondContact O-CB 2.98Å; N760-N764 PolarHBondContact O-N 2.93Å; N760-D766 CarbonylContact C-O 3.56Å; N760-P767 VanDerWaalsContact CB-O 3.25Å; N760-P767 WeakPolarHBondContact CB-O 3.34Å; N760-P767 PolarHBondContact ND2-O 3.24Å; N760-K769 VanDerWaalsContact CB-O 3.22Å; N760-K769 WeakPolarHBondContact CB-O 3.48Å; N760-K769 PolarHBondContact OD1-O 2.98Å; N760-E770 WeakPolarHBondContact OD1-CA 3.32Å; N760-F771 WeakPolarHBondContact OD1-CD1 3.42Å; N760-F771 PolarHBondContact OD1-N 3.19Å
761	F	95.4	Very high	91.5	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-64.6	-46.9	177.3	-174.1	-99.2	0	0	0	111.8	R331 I333 D530 L532 Y688 Y757 L758 A759 H763 N764 G765 P767	R331-F761 HydrophobicContact CB-CE1 3.9Å; R331-F761 HydrophobicContact CB-CZ 4.3Å; R331-F761 WeakPolarHBondContact CD-O 3.44Å; R331-F761 HydrophobicContact CG-CE1 4.39Å; R331-F761 PolarHBondContact NE-O 3.3Å; I333-F761 HydrophobicContact CD1-CD1 3.74Å; I333-F761 HydrophobicContact CD1-CE1 3.99Å; I333-F761 HydrophobicContact CG1-CD1 3.99Å; I333-F761 HydrophobicContact CG1-CE1 3.68Å; D530-F761 HydrophobicContact CB-CE2 4.11Å; D530-F761 HydrophobicContact CB-CZ 4.01Å; L532-F761 HydrophobicContact CB-CD1 4.26Å; L532-F761 HydrophobicContact CB-CE1 3.82Å; L532-F761 HydrophobicContact CB-CE2 4.18Å; L532-F761 HydrophobicContact CB-CZ 3.77Å; L532-F761 HydrophobicContact CD1-CB 4.41Å; L532-F761 HydrophobicContact CD1-CD1 4.2Å; L532-F761 HydrophobicContact CD1-CD2 4.3Å; L532-F761 HydrophobicContact CD1-CG 4.04Å; Y688-F761 HydrophobicContact CD2-CD2 4.17Å; Y688-F761 AromaticContact CD2-CE2 3.81Å; Y688-F761 HydrophobicContact CD2-CE2 3.81Å; Y688-F761 HydrophobicContact CE2-CD2 4.45Å; Y688-F761 HydrophobicContact CE2-CE2 4.2Å; Y757-F761 WeakPolarHBondContact O-CB 3.42Å; Y757-F761 PolarHBondContact O-N 3.24Å; L758-F761 PolarHBondContact O-N 3.48Å; A759-F761 VanDerWaalsContact C-N 3.3Å; A759-F761 PolarHBondContact O-N 2.96Å; F761-H763 VanDerWaalsContact C-N 3.28Å; F761-H763 PolarHBondContact O-N 2.89Å; F761-N764 PolarHBondContact O-N 3.46Å; F761-G765 WeakPolarHBondContact CD2-O 3.43Å; F761-G765 VanDerWaalsContact CE2-O 3.29Å; F761-G765 WeakPolarHBondContact CE2-O 3.49Å; F761-G765 WeakPolarHBondContact O-CA 3.44Å; F761-G765 PolarHBondContact O-N 3.47Å; F761-P767 HydrophobicContact CB-CB 4.37Å
762	I	94.9	Very high	90.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-59.2	-38.1	179.5	-70.4	165.4	0	0	0	111.7	P219 F221 T248 T301 I303 R331 L758 A759	P219-I762 HydrophobicContact CB-CG2 4.02Å; F221-I762 HydrophobicContact CB-CD1 4.24Å; F221-I762 HydrophobicContact CD1-CD1 4.11Å; F221-I762 HydrophobicContact CG-CD1 4.22Å; T248-I762 HydrophobicContact CG2-CG2 3.86Å; T301-I762 HydrophobicContact CG2-CG1 4.25Å; I303-I762 HydrophobicContact CD1-CD1 4.37Å; R331-I762 VanDerWaalsContact CZ-O 3.24Å; R331-I762 PolarHBondContact NH1-O 2.79Å; L758-I762 HydrophobicContact CD1-CD1 4.11Å; L758-I762 HydrophobicContact CD1-CG1 4.36Å; L758-I762 HydrophobicContact CG-CD1 3.86Å; L758-I762 WeakPolarHBondContact O-CB 3.43Å; L758-I762 VanDerWaalsContact O-CG1 3.24Å; L758-I762 WeakPolarHBondContact O-CG1 3.37Å; L758-I762 PolarHBondContact O-N 3.08Å; A759-I762 PolarHBondContact O-N 2.86Å
763	H	93.3	Very high	88.8	Confident	26 Å²	26	30.6 Å²	30.6	12%	0.12	15%	0.153	C	C	.	.	H	α-helix	trans	-76.9	-46.7	177.8	-82.6	-90.7	0	0	0	112.5	P219 S246 T248 R331 A759 N760 F761 F771	P219-H763 WeakPolarHBondContact CG-ND1 3.2Å; S246-H763 PolarHBondContact O-NE2 3.3Å; T248-H763 WeakPolarHBondContact CG2-NE2 3.46Å; R331-H763 VanDerWaalsContact CZ-O 3.31Å; R331-H763 PolarHBondContact NH1-O 2.91Å; R331-H763 PolarHBondContact NH2-O 3.04Å; A759-H763 PolarHBondContact O-CD2 3.27Å; A759-H763 VanDerWaalsContact O-CD2 3.27Å; A759-H763 PolarHBondContact O-N 3.45Å; N760-H763 PolarHBondContact O-N 3.17Å; F761-H763 VanDerWaalsContact C-N 3.28Å; F761-H763 PolarHBondContact O-N 2.89Å; H763-F771 HydrophobicContact CB-CB 3.73Å; H763-F771 HydrophobicContact CB-CG 4.33Å; H763-F771 AromaticContact CD2-CD1 3.99Å; H763-F771 AromaticContact CD2-CD2 3.58Å; H763-F771 AromaticContact CD2-CG 3.53Å; H763-F771 AromaticContact CE1-CD2 3.74Å; H763-F771 AromaticContact CG-CG 3.81Å; H763-F771 AromaticContact NE2-CD2 3.38Å; H763-F771 WeakPolarHBondContact NE2-CD2 3.49Å; H763-F771 AromaticContact NE2-CE2 3.69Å; H763-F771 AromaticContact NE2-CG 3.86Å
764	N	91.9	Very high	87.2	Confident	64 Å²	64	31.9 Å²	31.9	34%	0.342	16%	0.158	S	C	.	.	H	α-helix	trans	-116	-15	-161.6	-61.4	-45.8	0	0	0	115	N760 F761 D766 K769	N760-N764 WeakPolarHBondContact O-CB 2.98Å; N760-N764 PolarHBondContact O-N 2.93Å; F761-N764 PolarHBondContact O-N 3.46Å; N764-D766 PolarHBondContact O-N 2.81Å; N764-K769 HydrophobicContact CB-CB 3.82Å; N764-K769 HydrophobicContact CB-CD 4.33Å; N764-K769 PolarHBondContact ND2-O 2.87Å
765	G	92.8	Very high	85.4	Confident	2 Å²	2	40 Å²	40	2%	0.021	20%	0.195	C	C	.	.	S	Bend	trans	77	3.6	-171.2	0	0	0	0	0	112.9	S686 Y688 F761	S686-G765 PolarHBondContact OG-O 3.48Å; Y688-G765 WeakPolarHBondContact CE2-O 3.21Å; F761-G765 WeakPolarHBondContact CD2-O 3.43Å; F761-G765 VanDerWaalsContact CE2-O 3.29Å; F761-G765 WeakPolarHBondContact CE2-O 3.49Å; F761-G765 WeakPolarHBondContact O-CA 3.44Å; F761-G765 PolarHBondContact O-N 3.47Å
766	D	93.5	Very high	83.6	Confident	26 Å²	26	41.7 Å²	41.7	14%	0.139	21%	0.206	C	C	.	.			trans	-133.9	117.9	-179.7	-179	-17.7	0	0	0	108	Y688 N760 N764 N768 K769	Y688-D766 PolarHBondContact OH-OD1 2.84Å; N760-D766 CarbonylContact C-O 3.56Å; N764-D766 PolarHBondContact O-N 2.81Å; D766-N768 PolarHBondContact O-N 2.91Å; D766-N768 VanDerWaalsContact O-N 3.1Å; D766-N768 WeakPolarHBondContact OD1-CA 3.33Å; D766-N768 VanDerWaalsContact OD1-CB 3.26Å; D766-N768 WeakPolarHBondContact OD1-CB 3.41Å; D766-N768 PolarHBondContact OD1-N 2.99Å; D766-N768 PolarHBondContact OD1-ND2 3.03Å; D766-K769 HydrophobicContact CB-CB 4.2Å; D766-K769 HydrophobicContact CB-CD 3.85Å; D766-K769 HydrophobicContact CB-CG 3.92Å; D766-K769 PolarHBondContact O-N 3.23Å; D766-K769 VanDerWaalsContact OD2-CE 3.25Å; D766-K769 WeakPolarHBondContact OD2-CE 3.23Å; D766-K769 WeakPolarHBondContact OD2-CG 3.4Å; D766-K769 IonicContact OD2-NZ 3.98Å
767	P	94.1	Very high	82.2	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-11.8	-177.7	31.3	-35.3	0	0	0	112.7	Y688 Y757 N760 F761 W783	Y688-P767 HydrophobicContact CD1-CG 3.67Å; Y688-P767 HydrophobicContact CD2-CG 4.4Å; Y688-P767 VanDerWaalsContact CE1-CD 3.47Å; Y688-P767 HydrophobicContact CE1-CG 3.76Å; Y688-P767 HydrophobicContact CE2-CG 4.47Å; Y688-P767 HydrophobicContact CG-CG 4.01Å; Y757-P767 HydrophobicContact CD1-CB 3.89Å; Y757-P767 WeakPolarHBondContact CD1-O 3.5Å; Y757-P767 HydrophobicContact CG-CB 4.46Å; N760-P767 VanDerWaalsContact CB-O 3.25Å; N760-P767 WeakPolarHBondContact CB-O 3.34Å; N760-P767 PolarHBondContact ND2-O 3.24Å; F761-P767 HydrophobicContact CB-CB 4.37Å; P767-W783 HydrophobicContact CB-CD2 4.41Å; P767-W783 HydrophobicContact CB-CE3 3.7Å; P767-W783 HydrophobicContact CB-CZ3 4.1Å; P767-W783 HydrophobicContact CG-CB 4.25Å; P767-W783 HydrophobicContact CG-CD2 3.86Å; P767-W783 HydrophobicContact CG-CE3 3.66Å; P767-W783 HydrophobicContact CG-CG 4.14Å; P767-W783 HydrophobicContact CG-CZ3 4.29Å
768	N	92.5	Very high	81.1	Confident	23 Å²	23	56.2 Å²	56.2	12%	0.123	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-17.3	179.1	-50.2	-81.6	0	0	0	114	D766 E770 I779 H782 W783	D766-N768 PolarHBondContact O-N 2.91Å; D766-N768 VanDerWaalsContact O-N 3.1Å; D766-N768 WeakPolarHBondContact OD1-CA 3.33Å; D766-N768 VanDerWaalsContact OD1-CB 3.26Å; D766-N768 WeakPolarHBondContact OD1-CB 3.41Å; D766-N768 PolarHBondContact OD1-N 2.99Å; D766-N768 PolarHBondContact OD1-ND2 3.03Å; N768-E770 PolarHBondContact O-N 3.26Å; N768-I779 HydrophobicContact CB-CD1 3.94Å; N768-I779 WeakPolarHBondContact OD1-CD1 3.27Å; N768-H782 PolarHBondContact OD1-ND1 3.23Å; N768-H782 VanDerWaalsContact OD1-ND1 3.14Å; N768-W783 PolarHBondContact ND2-O 3.47Å; N768-W783 PolarHBondContact OD1-N 2.8Å
769	K	89.8	Confident	80.5	Confident	121 Å²	121	56.9 Å²	56.9	53%	0.526	27%	0.273	S	S	.	.	S	Bend	trans	-84	109.3	180	-73.4	179.5	-171.8	167.8	0	109.2	N760 N764 D766 F771	N760-K769 VanDerWaalsContact CB-O 3.22Å; N760-K769 WeakPolarHBondContact CB-O 3.48Å; N760-K769 PolarHBondContact OD1-O 2.98Å; N764-K769 HydrophobicContact CB-CB 3.82Å; N764-K769 HydrophobicContact CB-CD 4.33Å; N764-K769 PolarHBondContact ND2-O 2.87Å; D766-K769 HydrophobicContact CB-CB 4.2Å; D766-K769 HydrophobicContact CB-CD 3.85Å; D766-K769 HydrophobicContact CB-CG 3.92Å; D766-K769 PolarHBondContact O-N 3.23Å; D766-K769 VanDerWaalsContact OD2-CE 3.25Å; D766-K769 WeakPolarHBondContact OD2-CE 3.23Å; D766-K769 WeakPolarHBondContact OD2-CG 3.4Å; D766-K769 IonicContact OD2-NZ 3.98Å; K769-F771 PolarHBondContact O-N 2.94Å
770	E	83	Confident	79.8	Confident	102 Å²	102	57.6 Å²	57.6	48%	0.477	28%	0.277	S	S	.	.			trans	-61.9	126.1	176	-64.8	177	-179.8	0	0	109.9	N760 N768	N760-E770 WeakPolarHBondContact OD1-CA 3.32Å; N768-E770 PolarHBondContact O-N 3.26Å
771	F	78.8	Confident	79.5	Confident	10 Å²	10	57.7 Å²	57.7	4%	0.044	28%	0.278	C	S	.	.			trans	-82	145.3	166.2	75	-75.6	0	0	0	109	S246 D247 A759 N760 H763 K769 G773 T776	S246-F771 WeakPolarHBondContact O-CE2 3.49Å; D247-F771 HydrophobicContact CB-CE2 4.42Å; A759-F771 HydrophobicContact CB-CD1 4.05Å; A759-F771 HydrophobicContact CB-CE1 3.33Å; A759-F771 HydrophobicContact CB-CZ 3.88Å; N760-F771 WeakPolarHBondContact OD1-CD1 3.42Å; N760-F771 PolarHBondContact OD1-N 3.19Å; H763-F771 HydrophobicContact CB-CB 3.73Å; H763-F771 HydrophobicContact CB-CG 4.33Å; H763-F771 AromaticContact CD2-CD1 3.99Å; H763-F771 AromaticContact CD2-CD2 3.58Å; H763-F771 AromaticContact CD2-CG 3.53Å; H763-F771 AromaticContact CE1-CD2 3.74Å; H763-F771 AromaticContact CG-CG 3.81Å; H763-F771 AromaticContact NE2-CD2 3.38Å; H763-F771 WeakPolarHBondContact NE2-CD2 3.49Å; H763-F771 AromaticContact NE2-CE2 3.69Å; H763-F771 AromaticContact NE2-CG 3.86Å; K769-F771 PolarHBondContact O-N 2.94Å; F771-G773 VanDerWaalsContact CE2-CA 3.48Å; F771-G773 PolarHBondContact O-N 3.25Å; F771-T776 HydrophobicContact CD1-CG2 4.02Å; F771-T776 HydrophobicContact CE1-CG2 3.63Å; F771-T776 HydrophobicContact CZ-CG2 4.02Å; F771-T776 WeakPolarHBondContact O-CG2 3.26Å
772	M	62.5	Low	79.1	Confident	199 Å²	199	63.2 Å²	63.2	98%	0.98	30%	0.303	S	S	*	.	S	Bend	trans	-76.7	73.7	175.7	-70.2	-167.1	-179.1	0	0	110
773	G	60.6	Low	79	Confident	14 Å²	14	63.3 Å²	63.3	14%	0.144	30%	0.304	C	S	.	.	S	Bend	trans	-120	-170.2	173.6	0	0	0	0	0	112.7	F771 Q775	F771-G773 VanDerWaalsContact CE2-CA 3.48Å; F771-G773 PolarHBondContact O-N 3.25Å; G773-Q775 PolarHBondContact O-N 2.95Å
774	H	57.1	Low	78.8	Confident	56 Å²	56	63.6 Å²	63.6	26%	0.259	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.8	129.6	177.2	-99.4	-51.4	0	0	0	112	N84 T776	N84-H774 PolarHBondContact OD1-NE2 3.46Å; H774-T776 VanDerWaalsContact C-N 3.25Å; H774-T776 PolarHBondContact O-N 3.1Å
775	Q	55.5	Low	78.8	Confident	174 Å²	174	63.5 Å²	63.5	81%	0.813	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	5.7	67.5	178	-63.6	-174.8	0.1	0	0	114.7	G773 K777	G773-Q775 PolarHBondContact O-N 2.95Å; Q775-K777 PolarHBondContact O-N 3.17Å
776	T	53.2	Low	78.6	Confident	37 Å²	37	63.7 Å²	63.7	23%	0.227	31%	0.305	C	S	.	.			trans	-64.3	110.7	-179.9	42.1	0	0	0	0	107.5	F771 H774	F771-T776 HydrophobicContact CD1-CG2 4.02Å; F771-T776 HydrophobicContact CE1-CG2 3.63Å; F771-T776 HydrophobicContact CZ-CG2 4.02Å; F771-T776 WeakPolarHBondContact O-CG2 3.26Å; H774-T776 VanDerWaalsContact C-N 3.25Å; H774-T776 PolarHBondContact O-N 3.1Å
777	K	61.9	Low	78.2	Confident	133 Å²	133	64.2 Å²	64.2	58%	0.578	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-71.9	137.7	174.7	-72.5	-176.5	-179.7	176.5	0	107.9	Q775 I779	Q775-K777 PolarHBondContact O-N 3.17Å; K777-I779 PolarHBondContact O-N 3Å
778	K	70.3	Confident	77.2	Confident	177 Å²	177	66.6 Å²	66.6	77%	0.77	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-46.4	128.3	173.1	-170.1	175.3	-176.8	176.4	0	110.1
779	I	81.3	Confident	76.3	Confident	28 Å²	28	71.1 Å²	71.1	14%	0.144	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-56.6	140	176.3	46.9	156.4	0	0	0	110.9	Y757 N768 K777	Y757-I779 HydrophobicContact CD1-CG2 3.87Å; Y757-I779 HydrophobicContact CE1-CB 3.84Å; Y757-I779 HydrophobicContact CE1-CD1 4.38Å; Y757-I779 HydrophobicContact CE1-CG2 3.64Å; N768-I779 HydrophobicContact CB-CD1 3.94Å; N768-I779 WeakPolarHBondContact OD1-CD1 3.27Å; K777-I779 PolarHBondContact O-N 3Å
780	P	80.1	Confident	75.8	Confident	15 Å²	15	66.9 Å²	66.9	10%	0.097	33%	0.329	C	S	.	.	S	Bend	trans	-66.9	-42.5	-174.4	24.2	-32.6	0	0	0	112	N753 Y757 N822 F825	N753-P780 HydrophobicContact CB-CG 4.2Å; Y757-P780 HydrophobicContact CE2-CG 3.99Å; Y757-P780 WeakPolarHBondContact OH-CD 3.24Å; Y757-P780 WeakPolarHBondContact OH-CG 3.34Å; P780-N822 WeakPolarHBondContact CA-OD1 3.29Å; P780-N822 WeakPolarHBondContact CB-OD1 3.09Å; P780-N822 PolarHBondContact O-ND2 2.97Å; P780-F825 HydrophobicContact CB-CB 4.36Å; P780-F825 HydrophobicContact CB-CD2 4.45Å; P780-F825 HydrophobicContact CB-CG 4.39Å; P780-F825 HydrophobicContact CG-CB 4.17Å; P780-F825 HydrophobicContact CG-CD1 4.07Å; P780-F825 HydrophobicContact CG-CD2 4.11Å; P780-F825 HydrophobicContact CG-CG 3.85Å
781	V	86	Confident	75.9	Confident	4 Å²	4	65.2 Å²	65.2	2%	0.024	32%	0.318	C	S	.	.	S	Bend	trans	-136.7	141.2	-178.4	172.1	0	0	0	0	109.7	Y757 W783 W817 N822 F825 M827	Y757-V781 PolarHBondContact OH-N 3.46Å; Y757-V781 PolarHBondContact OH-O 2.95Å; V781-W783 PolarHBondContact O-N 3.27Å; V781-W817 HydrophobicContact CB-CZ3 4.25Å; V781-W817 HydrophobicContact CG1-CH2 3.95Å; V781-W817 HydrophobicContact CG1-CZ3 3.76Å; V781-W817 HydrophobicContact CG2-CE3 4.24Å; V781-W817 HydrophobicContact CG2-CZ3 3.86Å; V781-N822 HydrophobicContact CG2-CB 4.39Å; V781-F825 HydrophobicContact CG2-CB 4.13Å; V781-F825 VanDerWaalsContact CG2-O 3.3Å; V781-F825 WeakPolarHBondContact CG2-O 3.36Å; V781-M827 HydrophobicContact CG1-CG 3.82Å; V781-M827 HydrophobicContact CG1-SD 4.18Å
782	H	88.7	Confident	76.3	Confident	116 Å²	116	67.2 Å²	67.2	54%	0.537	33%	0.329	S	S	.	.			trans	-67.2	123.5	171.6	-177.6	62.3	0	0	0	110	N768 P784	N768-H782 PolarHBondContact OD1-ND1 3.23Å; N768-H782 VanDerWaalsContact OD1-ND1 3.14Å; H782-P784 WeakPolarHBondContact O-CD 3.26Å
783	W	91.3	Very high	77.6	Confident	3 Å²	3	59 Å²	59	1%	0.011	29%	0.287	C	S	.	.			trans	-100.2	91.1	-179.7	-175.6	-4.3	0	0	0	109.9	L532 Y688 A689 L690 Y757 P767 N768 V781 L794	L532-W783 HydrophobicContact CD1-CH2 3.64Å; L532-W783 HydrophobicContact CD1-CZ2 4.44Å; L532-W783 HydrophobicContact CD1-CZ3 4.1Å; L532-W783 HydrophobicContact CD2-CH2 4.25Å; L532-W783 HydrophobicContact CG-CH2 3.94Å; L532-W783 HydrophobicContact CG-CZ2 4.39Å; Y688-W783 AromaticContact CD1-CD1 3.92Å; Y688-W783 HydrophobicContact CD1-CD2 4.38Å; Y688-W783 HydrophobicContact CD1-CG 4.23Å; Y688-W783 AromaticContact CD1-NE1 3.91Å; Y688-W783 WeakPolarHBondContact CE1-O 3.49Å; A689-W783 VanDerWaalsContact C-CZ2 3.49Å; A689-W783 VanDerWaalsContact O-CZ2 3.26Å; A689-W783 WeakPolarHBondContact O-CZ2 3.42Å; A689-W783 PolarHBondContact O-NE1 3.43Å; L690-W783 HydrophobicContact CB-CH2 3.8Å; L690-W783 HydrophobicContact CB-CZ2 3.88Å; L690-W783 HydrophobicContact CD1-CH2 4.46Å; Y757-W783 AromaticContact CD1-CE3 3.92Å; Y757-W783 HydrophobicContact CD1-CE3 3.92Å; Y757-W783 HydrophobicContact CE1-CB 4.3Å; Y757-W783 HydrophobicContact CE1-CE3 4.3Å; Y757-W783 HydrophobicContact CG-CE3 4.01Å; Y757-W783 HydrophobicContact CG-CZ3 4.22Å; P767-W783 HydrophobicContact CB-CD2 4.41Å; P767-W783 HydrophobicContact CB-CE3 3.7Å; P767-W783 HydrophobicContact CB-CZ3 4.1Å; P767-W783 HydrophobicContact CG-CB 4.25Å; P767-W783 HydrophobicContact CG-CD2 3.86Å; P767-W783 HydrophobicContact CG-CE3 3.66Å; P767-W783 HydrophobicContact CG-CG 4.14Å; P767-W783 HydrophobicContact CG-CZ3 4.29Å; N768-W783 PolarHBondContact ND2-O 3.47Å; N768-W783 PolarHBondContact OD1-N 2.8Å; V781-W783 PolarHBondContact O-N 3.27Å; W783-L794 HydrophobicContact CD2-CB 3.71Å; W783-L794 HydrophobicContact CD2-CD2 3.8Å; W783-L794 HydrophobicContact CD2-CG 4.34Å; W783-L794 HydrophobicContact CE3-CB 4.24Å; W783-L794 HydrophobicContact CE3-CD2 3.46Å; W783-L794 VanDerWaalsContact CE3-CD2 3.46Å; W783-L794 HydrophobicContact CE3-CG 4.47Å; W783-L794 HydrophobicContact CG-CB 3.94Å; W783-L794 HydrophobicContact CG-CD2 4.37Å; W783-L794 HydrophobicContact CH2-CD2 4.42Å; W783-L794 HydrophobicContact CZ2-CB 4.15Å; W783-L794 HydrophobicContact CZ3-CD2 3.81Å
784	P	90.4	Very high	79.1	Confident	32 Å²	32	58.4 Å²	58.4	21%	0.208	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-64.3	156.3	178.5	27.5	-37.7	0	0	0	112.6	H782 L792 M827	H782-P784 WeakPolarHBondContact O-CD 3.26Å; P784-L792 HydrophobicContact CB-CD1 4.48Å; P784-L792 HydrophobicContact CG-CB 4.06Å; P784-L792 HydrophobicContact CG-CD1 3.8Å; P784-M827 VanDerWaalsContact CD-CE 3.47Å; P784-M827 HydrophobicContact CG-CE 3.66Å
785	E	90.7	Very high	80.8	Confident	62 Å²	62	56.2 Å²	56.2	29%	0.29	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-58.3	136.5	172	-166.3	-170.5	152.8	0	0	110.8	R684 T687 Y688 T787	R684-E785 IonicContact CZ-OE1 3.25Å; R684-E785 IonicContact NE-OE1 3.4Å; R684-E785 IonicContact NH2-OE1 2.73Å; R684-E785 PolarHBondContact NH2-OE1 3.5Å; T687-E785 CarbonylContact O-C 3.53Å; T687-E785 WeakPolarHBondContact O-CA 3.25Å; T687-E785 WeakPolarHBondContact O-CG 3.39Å; Y688-E785 HydrophobicContact CE1-CB 4.38Å; E785-T787 PolarHBondContact O-N 2.96Å
786	Y	89.7	Confident	82.5	Confident	5 Å²	5	47.9 Å²	47.9	2%	0.02	23%	0.232	C	C	.	.	P	Polyproline II helix	trans	-70.6	117.9	168.4	-176.7	-82.2	0	0	0	109.4	L633 T687 A689 R791 L792 L830	L633-Y786 HydrophobicContact CB-CD1 4.3Å; L633-Y786 HydrophobicContact CB-CE1 3.79Å; L633-Y786 HydrophobicContact CD1-CD2 4.39Å; L633-Y786 HydrophobicContact CD1-CE2 4.01Å; L633-Y786 HydrophobicContact CD2-CD1 3.87Å; L633-Y786 HydrophobicContact CD2-CD2 4.26Å; L633-Y786 HydrophobicContact CD2-CE1 4.17Å; L633-Y786 HydrophobicContact CD2-CG 3.93Å; L633-Y786 HydrophobicContact CG-CE1 4.41Å; T687-Y786 HydrophobicContact CG2-CD1 4.4Å; T687-Y786 PolarHBondContact O-N 2.79Å; A689-Y786 HydrophobicContact CB-CD2 3.73Å; A689-Y786 HydrophobicContact CB-CE2 4.47Å; A689-Y786 HydrophobicContact CB-CG 4.26Å; Y786-R791 HydrophobicContact CE2-CB 4.18Å; Y786-L792 WeakPolarHBondContact CD2-O 3.23Å; Y786-L830 HydrophobicContact CE2-CD2 4.17Å
787	T	84.2	Confident	83.9	Confident	38 Å²	38	46.1 Å²	46.1	23%	0.233	22%	0.221	C	C	.	.			trans	-117.8	155.6	166.7	70.5	0	0	0	0	109.3	E785 D789 S790 R791	E785-T787 PolarHBondContact O-N 2.96Å; T787-D789 PolarHBondContact O-N 3.48Å; T787-S790 PolarHBondContact N-OG 3.18Å; T787-S790 PolarHBondContact O-N 3.01Å; T787-S790 VanDerWaalsContact OG1-CB 3.3Å; T787-S790 WeakPolarHBondContact OG1-CB 3.36Å; T787-S790 PolarHBondContact OG1-N 2.92Å; T787-S790 PolarHBondContact OG1-OG 2.95Å; T787-S790 VanDerWaalsContact OG1-OG 3.09Å; T787-R791 WeakPolarHBondContact O-CA 3.46Å; T787-R791 PolarHBondContact O-N 3.36Å
788	Y	72.9	Confident	84.3	Confident	50 Å²	50	41.7 Å²	41.7	20%	0.196	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-29	177.6	-179.9	-106.5	0	0	0	113.3	K634 D638 R791	K634-Y788 HydrophobicContact CD-CD2 4.13Å; K634-Y788 HydrophobicContact CD-CE2 3.67Å; K634-Y788 VanDerWaalsContact CE-CE2 3.44Å; K634-Y788 HydrophobicContact CG-CD2 3.91Å; K634-Y788 HydrophobicContact CG-CE2 3.99Å; K634-Y788 PolarHBondContact NZ-OH 2.98Å; K634-Y788 VanDerWaalsContact NZ-OH 3.12Å; D638-Y788 VanDerWaalsContact CG-CB 3.44Å; D638-Y788 VanDerWaalsContact CG-CG 3.48Å; D638-Y788 WeakPolarHBondContact OD1-CB 3.02Å; D638-Y788 VanDerWaalsContact OD1-CG 3.3Å; D638-Y788 WeakPolarHBondContact OD2-CD1 3.48Å; D638-Y788 WeakPolarHBondContact OD2-CD2 3.35Å; Y788-R791 WeakPolarHBondContact O-CG 3.35Å; Y788-R791 PolarHBondContact O-NE 3.06Å
789	D	73.7	Confident	83.6	Confident	118 Å²	118	36.3 Å²	36.3	63%	0.631	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-48.1	177.1	-59.5	-42.7	0	0	0	112	T787	T787-D789 PolarHBondContact O-N 3.48Å
790	S	80.2	Confident	81.9	Confident	31 Å²	31	38.2 Å²	38.2	22%	0.217	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-41.5	-177	80.3	0	0	0	0	111.9	T787 L792 Q829	T787-S790 PolarHBondContact N-OG 3.18Å; T787-S790 PolarHBondContact O-N 3.01Å; T787-S790 VanDerWaalsContact OG1-CB 3.3Å; T787-S790 WeakPolarHBondContact OG1-CB 3.36Å; T787-S790 PolarHBondContact OG1-N 2.92Å; T787-S790 PolarHBondContact OG1-OG 2.95Å; T787-S790 VanDerWaalsContact OG1-OG 3.09Å; S790-L792 PolarHBondContact O-N 3.04Å; S790-L792 VanDerWaalsContact O-N 3.15Å; S790-L792 PolarHBondContact OG-N 3.44Å; S790-Q829 WeakPolarHBondContact O-CG 3.21Å; S790-Q829 PolarHBondContact O-NE2 3.45Å
791	R	84.1	Confident	80.1	Confident	68 Å²	68	43.3 Å²	43.3	26%	0.257	21%	0.214	S	C	.	.			trans	52.1	27.3	-175.1	-50.6	-179.9	-172	176.7	-2.8	113.5	Y786 T787 Y788 Q829 L830	Y786-R791 HydrophobicContact CE2-CB 4.18Å; T787-R791 WeakPolarHBondContact O-CA 3.46Å; T787-R791 PolarHBondContact O-N 3.36Å; Y788-R791 WeakPolarHBondContact O-CG 3.35Å; Y788-R791 PolarHBondContact O-NE 3.06Å; R791-Q829 HydrophobicContact CB-CG 4.11Å; R791-L830 HydrophobicContact CB-CB 4.19Å; R791-L830 WeakPolarHBondContact CB-O 3.21Å; R791-L830 WeakPolarHBondContact CD-O 3.41Å; R791-L830 WeakPolarHBondContact O-CB 3.17Å; R791-L830 PolarHBondContact O-N 2.78Å
792	L	87.6	Confident	77.6	Confident	52 Å²	52	45.6 Å²	45.6	27%	0.272	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	135.9	-176.6	-66.1	176	0	0	0	110.7	P784 Y786 S790 M827 K828 Q829	P784-L792 HydrophobicContact CB-CD1 4.48Å; P784-L792 HydrophobicContact CG-CB 4.06Å; P784-L792 HydrophobicContact CG-CD1 3.8Å; Y786-L792 WeakPolarHBondContact CD2-O 3.23Å; S790-L792 PolarHBondContact O-N 3.04Å; S790-L792 VanDerWaalsContact O-N 3.15Å; S790-L792 PolarHBondContact OG-N 3.44Å; L792-M827 HydrophobicContact CB-CE 4.05Å; L792-K828 WeakPolarHBondContact CA-O 3.49Å; L792-Q829 HydrophobicContact CD2-CB 4.17Å
793	Y	90.2	Very high	74.8	Confident	27 Å²	27	49.2 Å²	49.2	11%	0.106	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	150.2	176.8	70.4	-89.5	0	0	0	110.6	A689 F691 H795 M827 K828 L830	A689-Y793 CarbonylContact O-C 3.55Å; A689-Y793 VanDerWaalsContact O-CA 3.32Å; A689-Y793 WeakPolarHBondContact O-CA 3.49Å; A689-Y793 WeakPolarHBondContact O-CB 3.49Å; F691-Y793 HydrophobicContact CB-CD2 3.57Å; F691-Y793 HydrophobicContact CB-CE2 3.39Å; F691-Y793 HydrophobicContact CD1-CE2 4.32Å; F691-Y793 HydrophobicContact CG-CE2 4.07Å; Y793-H795 HydrophobicContact CD2-CB 4.39Å; Y793-H795 HydrophobicContact CE2-CB 3.88Å; Y793-H795 PolarHBondContact O-N 2.78Å; Y793-M827 VanDerWaalsContact C-CE 3.42Å; Y793-M827 VanDerWaalsContact O-CE 3.23Å; Y793-M827 WeakPolarHBondContact O-CE 3.41Å; Y793-K828 HydrophobicContact CD1-CB 4.26Å; Y793-K828 WeakPolarHBondContact CD1-O 3.38Å; Y793-K828 HydrophobicContact CD2-CB 4.48Å; Y793-K828 HydrophobicContact CE1-CB 3.58Å; Y793-K828 HydrophobicContact CE2-CB 3.82Å; Y793-K828 PolarHBondContact N-O 2.77Å; Y793-K828 PolarHBondContact O-N 3.31Å; Y793-K828 WeakPolarHBondContact OH-CB 3.29Å; Y793-L830 HydrophobicContact CD1-CB 3.77Å; Y793-L830 HydrophobicContact CE1-CB 3.93Å
794	L	92.8	Very high	71.9	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	121.8	173.8	-177.3	65.9	0	0	0	109	A689 L690 F691 Y757 W783 V796 F825 M827	A689-L794 PolarHBondContact O-N 3.16Å; L690-L794 WeakPolarHBondContact CA-O 3.41Å; L690-L794 HydrophobicContact CD1-CB 4.21Å; L690-L794 HydrophobicContact CD1-CD2 4.03Å; L690-L794 HydrophobicContact CD1-CG 4.16Å; F691-L794 PolarHBondContact N-O 3.37Å; Y757-L794 HydrophobicContact CD2-CD2 3.98Å; Y757-L794 HydrophobicContact CE2-CD2 3.67Å; W783-L794 HydrophobicContact CD2-CB 3.71Å; W783-L794 HydrophobicContact CD2-CD2 3.8Å; W783-L794 HydrophobicContact CD2-CG 4.34Å; W783-L794 HydrophobicContact CE3-CB 4.24Å; W783-L794 HydrophobicContact CE3-CD2 3.46Å; W783-L794 VanDerWaalsContact CE3-CD2 3.46Å; W783-L794 HydrophobicContact CE3-CG 4.47Å; W783-L794 HydrophobicContact CG-CB 3.94Å; W783-L794 HydrophobicContact CG-CD2 4.37Å; W783-L794 HydrophobicContact CH2-CD2 4.42Å; W783-L794 HydrophobicContact CZ2-CB 4.15Å; W783-L794 HydrophobicContact CZ3-CD2 3.81Å; L794-V796 HydrophobicContact CD2-CG2 4.46Å; L794-V796 HydrophobicContact CG-CG2 4.35Å; L794-F825 HydrophobicContact CD1-CD1 4.41Å; L794-F825 HydrophobicContact CD2-CD1 4.33Å; L794-M827 HydrophobicContact CB-SD 4.42Å; L794-M827 HydrophobicContact CD1-SD 3.95Å
795	H	91.4	Very high	69.2	Low	10 Å²	10	58.8 Å²	58.8	5%	0.046	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	121	175.7	173.8	-77.9	0	0	0	109.9	F691 Y793 T826 K828	F691-H795 AromaticContact CD1-CD2 3.44Å; F691-H795 VanDerWaalsContact CD1-CD2 3.44Å; F691-H795 WeakPolarHBondContact CD1-CD2 3.31Å; F691-H795 AromaticContact CD1-NE2 3.99Å; F691-H795 AromaticContact CE1-CD2 3.95Å; Y793-H795 HydrophobicContact CD2-CB 4.39Å; Y793-H795 HydrophobicContact CE2-CB 3.88Å; Y793-H795 PolarHBondContact O-N 2.78Å; H795-T826 WeakPolarHBondContact CA-O 3.32Å; H795-T826 WeakPolarHBondContact CB-O 2.97Å; H795-T826 PolarHBondContact N-O 3.1Å; H795-T826 PolarHBondContact ND1-OG1 3.37Å; H795-T826 PolarHBondContact O-N 3.15Å; H795-T826 PolarHBondContact O-OG1 3.1Å; H795-K828 HydrophobicContact CB-CB 4.29Å; H795-K828 HydrophobicContact CB-CD 3.81Å; H795-K828 HydrophobicContact CB-CG 3.9Å; H795-K828 PolarHBondContact CD2-NZ 3.28Å; H795-K828 PolarHBondContact CE1-NZ 2.78Å; H795-K828 VanDerWaalsContact CE1-NZ 3.3Å; H795-K828 PolarHBondContact NE2-NZ 3.43Å
796	V	90.9	Very high	66.4	Low	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	109.9	175.3	-176.8	0	0	0	0	109.1	L690 F691 F692 N693 Y694 I750 L754 L794 H824 F825	L690-V796 HydrophobicContact CD1-CG2 3.75Å; F691-V796 PolarHBondContact O-N 3.28Å; F692-V796 HydrophobicContact CD2-CB 3.97Å; F692-V796 HydrophobicContact CD2-CG1 3.9Å; F692-V796 HydrophobicContact CE2-CB 4.5Å; F692-V796 HydrophobicContact CE2-CG1 3.92Å; N693-V796 CarbonylContact C-O 3.55Å; N693-V796 PolarHBondContact N-O 2.91Å; Y694-V796 PolarHBondContact N-O 3.43Å; I750-V796 HydrophobicContact CG2-CG1 4.25Å; L754-V796 HydrophobicContact CD2-CG2 4.21Å; L794-V796 HydrophobicContact CD2-CG2 4.46Å; L794-V796 HydrophobicContact CG-CG2 4.35Å; V796-H824 CarbonylContact C-O 3.57Å; V796-H824 VanDerWaalsContact CA-O 3.29Å; V796-H824 WeakPolarHBondContact CA-O 3.25Å; V796-F825 HydrophobicContact CG1-CE1 4.23Å; V796-F825 HydrophobicContact CG1-CZ 4.22Å; V796-F825 HydrophobicContact CG2-CD1 3.76Å; V796-F825 HydrophobicContact CG2-CE1 3.64Å; V796-F825 HydrophobicContact CG2-CZ 4.43Å
797	G	84.1	Confident	64	Low	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.6	174.6	179.6	0	0	0	0	0	114.3	H824	G797-H824 PolarHBondContact N-O 2.77Å
798	D	69.1	Low	61.7	Low	39 Å²	39	71.2 Å²	71.2	21%	0.209	35%	0.346	C	S	.	.			trans	-83.6	122.8	-174.6	-63.7	-16.3	0	0	0	112.9	I700 S800 H824	I700-D798 WeakPolarHBondContact CD1-OD2 3.36Å; D798-S800 PolarHBondContact O-N 3.41Å; D798-H824 IonicContact OD1-CE1 3.41Å; D798-H824 PolarHBondContact OD1-CE1 3.05Å; D798-H824 IonicContact OD1-ND1 2.97Å; D798-H824 PolarHBondContact OD1-ND1 2.83Å
799	E	56.3	Low	60.2	Low	64 Å²	64	71.1 Å²	71.1	30%	0.299	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-74	-4.5	175.2	-65	-157.7	138.1	0	0	114.5	R801 I813 T826	E799-R801 VanDerWaalsContact C-N 3.26Å; E799-R801 PolarHBondContact O-N 3.26Å; E799-I813 WeakPolarHBondContact OE2-CD1 3.19Å; E799-T826 HydrophobicContact CG-CG2 4.34Å
800	S	45.4	Very low	58.7	Low	68 Å²	68	69.8 Å²	69.8	48%	0.476	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-70.4	-4.3	-165.6	67.1	0	0	0	0	116.8	D798	D798-S800 PolarHBondContact O-N 3.41Å
801	R	41.6	Very low	56.8	Low	123 Å²	123	73.4 Å²	73.4	46%	0.464	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-98.4	-10.3	-171.3	-70.7	-171.5	179.3	-168	0.8	117.1	E799 K803	E799-R801 VanDerWaalsContact C-N 3.26Å; E799-R801 PolarHBondContact O-N 3.26Å; R801-K803 PolarHBondContact O-N 2.96Å
802	S	33.4	Very low	54.8	Low	52 Å²	52	75.5 Å²	75.5	36%	0.364	37%	0.369	S	S	.	.			trans	-91.6	79.8	178.7	65.9	0	0	0	0	112.3	Q804 S805 F806	S802-Q804 PolarHBondContact O-N 3.23Å; S802-S805 PolarHBondContact O-N 2.99Å; S802-S805 VanDerWaalsContact OG-CB 3.28Å; S802-S805 WeakPolarHBondContact OG-CB 3.42Å; S802-S805 PolarHBondContact OG-OG 3.05Å; S802-F806 WeakPolarHBondContact O-CB 3.44Å; S802-F806 PolarHBondContact O-N 2.9Å
803	K	30.8	Very low	52.9	Low	191 Å²	191	75.6 Å²	75.6	83%	0.83	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-24.2	-176.8	-81.6	-175.9	177.1	178.7	0	115.4	R801	R801-K803 PolarHBondContact O-N 2.96Å
804	Q	31	Very low	50.6	Low	189 Å²	189	82.1 Å²	82.1	88%	0.883	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-24.2	177.2	-79.3	171	-21.5	0	0	114.7	S802	S802-Q804 PolarHBondContact O-N 3.23Å
805	S	34	Very low	48.4	Very low	48 Å²	48	88.6 Å²	88.6	34%	0.336	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-30.1	173.3	121.3	0	0	0	0	111.5	S802 H807 Q808 T809	S802-S805 PolarHBondContact O-N 2.99Å; S802-S805 VanDerWaalsContact OG-CB 3.28Å; S802-S805 WeakPolarHBondContact OG-CB 3.42Å; S802-S805 PolarHBondContact OG-OG 3.05Å; S805-H807 PolarHBondContact O-N 3.3Å; S805-Q808 PolarHBondContact O-N 2.9Å; S805-T809 VanDerWaalsContact O-CB 3.3Å; S805-T809 WeakPolarHBondContact O-CB 3.4Å; S805-T809 PolarHBondContact O-N 2.83Å; S805-T809 PolarHBondContact O-OG1 3.18Å; S805-T809 PolarHBondContact OG-OG1 3.18Å
806	F	31.8	Very low	46.1	Very low	61 Å²	61	93.7 Å²	93.7	27%	0.268	46%	0.455	S	S	.	.	H	α-helix	trans	-59.3	-25.2	-172.9	-164.6	-105.5	0	0	0	114.6	S802 K810	S802-F806 WeakPolarHBondContact O-CB 3.44Å; S802-F806 PolarHBondContact O-N 2.9Å; F806-K810 HydrophobicContact CD1-CD 4.29Å; F806-K810 HydrophobicContact CE1-CD 3.81Å; F806-K810 HydrophobicContact CZ-CD 3.94Å; F806-K810 WeakPolarHBondContact O-CB 3.42Å; F806-K810 PolarHBondContact O-N 3.39Å
807	H	37.8	Very low	44	Very low	144 Å²	144	99.6 Å²	99.6	67%	0.667	48%	0.477	S	S	*	.	H	α-helix	trans	-86.9	-25.7	176.2	-79.1	-54.5	0	0	0	114.3	S805	S805-H807 PolarHBondContact O-N 3.3Å
808	Q	36.8	Very low	41.6	Very low	160 Å²	160	102.9 Å²	102.9	75%	0.748	51%	0.512	S	S	*	.	H	α-helix	trans	-91.1	-42.3	178.6	-69.6	179.5	-12.8	0	0	111	S805 H812	S805-Q808 PolarHBondContact O-N 2.9Å; Q808-H812 PolarHBondContact O-N 3.48Å
809	T	42.1	Very low	40.5	Very low	48 Å²	48	105.7 Å²	105.7	29%	0.294	53%	0.527	S	S	.	.	H	α-helix	trans	-71.9	-39	-179.2	-45.8	0	0	0	0	111.8	S805 N811 H812 I813	S805-T809 VanDerWaalsContact O-CB 3.3Å; S805-T809 WeakPolarHBondContact O-CB 3.4Å; S805-T809 PolarHBondContact O-N 2.83Å; S805-T809 PolarHBondContact O-OG1 3.18Å; S805-T809 PolarHBondContact OG-OG1 3.18Å; T809-N811 VanDerWaalsContact C-N 3.33Å; T809-N811 PolarHBondContact O-N 3.26Å; T809-H812 PolarHBondContact O-N 2.78Å; T809-H812 VanDerWaalsContact O-N 3.16Å; T809-I813 HydrophobicContact CG2-CD1 3.39Å; T809-I813 HydrophobicContact CG2-CG1 3.83Å; T809-I813 WeakPolarHBondContact O-CB 3.37Å; T809-I813 WeakPolarHBondContact O-CG1 3.48Å; T809-I813 PolarHBondContact O-N 2.89Å
810	K	41	Very low	40.2	Very low	91 Å²	91	110.3 Å²	110.3	40%	0.396	55%	0.546	S	S	.	.	H	α-helix	trans	-65.1	-32.1	179.8	-172.8	174.7	-174.2	171.7	0	113.8	F806 R814	F806-K810 HydrophobicContact CD1-CD 4.29Å; F806-K810 HydrophobicContact CE1-CD 3.81Å; F806-K810 HydrophobicContact CZ-CD 3.94Å; F806-K810 WeakPolarHBondContact O-CB 3.42Å; F806-K810 PolarHBondContact O-N 3.39Å; K810-R814 WeakPolarHBondContact O-CB 3.43Å; K810-R814 PolarHBondContact O-N 3.05Å
811	N	41.4	Very low	40.3	Very low	107 Å²	107	114.3 Å²	114.3	57%	0.572	56%	0.557	S	S	*	*	H	α-helix	trans	-81.5	-26.6	175.9	-74.2	-12.9	0	0	0	112.1	T809 N815	T809-N811 VanDerWaalsContact C-N 3.33Å; T809-N811 PolarHBondContact O-N 3.26Å; N811-N815 VanDerWaalsContact O-CG 3.22Å; N811-N815 PolarHBondContact O-ND2 2.92Å
812	H	41.9	Very low	41.2	Very low	111 Å²	111	110 Å²	110	51%	0.514	54%	0.543	S	S	.	.	H	α-helix	trans	-82.2	-42.2	177.6	-148.4	15.9	0	0	0	112.3	Q808 T809 N815 L816	Q808-H812 PolarHBondContact O-N 3.48Å; T809-H812 PolarHBondContact O-N 2.78Å; T809-H812 VanDerWaalsContact O-N 3.16Å; H812-N815 PolarHBondContact O-N 2.89Å; H812-L816 WeakPolarHBondContact O-CG 3.39Å; H812-L816 PolarHBondContact O-N 3.2Å; H812-L816 VanDerWaalsContact O-N 3.16Å
813	I	46.4	Very low	42.8	Very low	55 Å²	55	113.1 Å²	113.1	28%	0.282	55%	0.552	S	S	.	*	H	α-helix	trans	-68.4	-41.3	176.3	-66.9	-173.9	0	0	0	111.2	E799 T809 N815 L816 W817	E799-I813 WeakPolarHBondContact OE2-CD1 3.19Å; T809-I813 HydrophobicContact CG2-CD1 3.39Å; T809-I813 HydrophobicContact CG2-CG1 3.83Å; T809-I813 WeakPolarHBondContact O-CB 3.37Å; T809-I813 WeakPolarHBondContact O-CG1 3.48Å; T809-I813 PolarHBondContact O-N 2.89Å; I813-N815 PolarHBondContact O-N 2.92Å; I813-L816 PolarHBondContact O-N 2.78Å; I813-W817 HydrophobicContact CG2-CB 4.38Å; I813-W817 PolarHBondContact O-N 2.89Å
814	R	42.5	Very low	45.3	Very low	163 Å²	163	105.4 Å²	105.4	62%	0.615	52%	0.519	S	S	*	.	H	α-helix	trans	-63.4	-24	177.3	-167.3	175.7	-172.4	144.4	-1.1	113.2	K810	K810-R814 WeakPolarHBondContact O-CB 3.43Å; K810-R814 PolarHBondContact O-N 3.05Å
815	N	46.1	Very low	48	Very low	137 Å²	137	96.6 Å²	96.6	73%	0.733	48%	0.478	S	S	*	.	H	α-helix	trans	-91.5	-15.7	176	-70.6	-6.6	0	0	0	113.5	N811 H812 I813	N811-N815 VanDerWaalsContact O-CG 3.22Å; N811-N815 PolarHBondContact O-ND2 2.92Å; H812-N815 PolarHBondContact O-N 2.89Å; I813-N815 PolarHBondContact O-N 2.92Å
816	L	43.7	Very low	50.5	Low	117 Å²	117	95.2 Å²	95.2	61%	0.613	47%	0.467	S	S	*	.	H	α-helix	trans	-104.3	-25.3	-179.4	-75.7	167.3	0	0	0	113.4	H812 I813	H812-L816 WeakPolarHBondContact O-CG 3.39Å; H812-L816 PolarHBondContact O-N 3.2Å; H812-L816 VanDerWaalsContact O-N 3.16Å; I813-L816 PolarHBondContact O-N 2.78Å
817	W	46	Very low	53.1	Low	123 Å²	123	94.8 Å²	94.8	47%	0.466	47%	0.466	S	S	.	.	S	Bend	trans	-136.4	60.8	-169.3	-59.5	79.7	0	0	0	111.7	V781 I813 N819	V781-W817 HydrophobicContact CB-CZ3 4.25Å; V781-W817 HydrophobicContact CG1-CH2 3.95Å; V781-W817 HydrophobicContact CG1-CZ3 3.76Å; V781-W817 HydrophobicContact CG2-CE3 4.24Å; V781-W817 HydrophobicContact CG2-CZ3 3.86Å; I813-W817 HydrophobicContact CG2-CB 4.38Å; I813-W817 PolarHBondContact O-N 2.89Å; W817-N819 PolarHBondContact O-N 2.75Å
818	G	34.1	Very low	55.4	Low	70 Å²	70	91.2 Å²	91.2	72%	0.722	45%	0.449	S	S	*	.			trans	-54.7	20	-166.5	0	0	0	0	0	121.1
819	N	47.2	Very low	57.7	Low	97 Å²	97	87.2 Å²	87.2	52%	0.519	43%	0.43	S	S	.	.			trans	-120.1	120.7	174.2	-74.5	-10.9	0	0	0	111.4	W817 E821 N822	W817-N819 PolarHBondContact O-N 2.75Å; N819-E821 PolarHBondContact O-N 3.38Å; N819-N822 PolarHBondContact O-N 2.84Å
820	K	48.7	Very low	59.6	Low	161 Å²	161	85.7 Å²	85.7	70%	0.7	42%	0.42	S	S	*	.	G	3₁₀ helix	trans	-55	-19.4	169	-76.8	-175.8	174.9	177.7	0	113.2	N822 E823	K820-N822 PolarHBondContact O-N 3.23Å; K820-E823 WeakPolarHBondContact O-CG 3.48Å
821	E	48.1	Very low	61	Low	153 Å²	153	88.7 Å²	88.7	72%	0.715	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-69.5	-19.1	-176.2	-59.7	-174	151.2	0	0	113.3	N819	N819-E821 PolarHBondContact O-N 3.38Å
822	N	59.8	Low	62.3	Low	32 Å²	32	86.4 Å²	86.4	17%	0.171	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-101.4	7.8	-175.5	-66.1	-14.8	0	0	0	113.7	P780 V781 N819 K820 H824 F825	P780-N822 WeakPolarHBondContact CA-OD1 3.29Å; P780-N822 WeakPolarHBondContact CB-OD1 3.09Å; P780-N822 PolarHBondContact O-ND2 2.97Å; V781-N822 HydrophobicContact CG2-CB 4.39Å; N819-N822 PolarHBondContact O-N 2.84Å; K820-N822 PolarHBondContact O-N 3.23Å; N822-H824 PolarHBondContact O-N 2.83Å; N822-F825 PolarHBondContact O-N 3.06Å; N822-F825 VanDerWaalsContact O-O 3.07Å
823	E	68.4	Low	63.7	Low	117 Å²	117	83.1 Å²	83.1	55%	0.547	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-22.3	-170.7	-76.2	-179.6	-171.6	0	0	114.6	K820	K820-E823 WeakPolarHBondContact O-CG 3.48Å
824	H	82.1	Confident	64.6	Low	29 Å²	29	82.7 Å²	82.7	13%	0.134	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-15	179.9	-56	-75.9	0	0	0	114.5	Y694 M746 I750 V796 G797 D798 N822	Y694-H824 AromaticContact CD2-ND1 3.93Å; Y694-H824 AromaticContact CE2-ND1 4Å; M746-H824 PolarHBondContact SD-NE2 3.48Å; I750-H824 HydrophobicContact CD1-CB 4.48Å; V796-H824 CarbonylContact C-O 3.57Å; V796-H824 VanDerWaalsContact CA-O 3.29Å; V796-H824 WeakPolarHBondContact CA-O 3.25Å; G797-H824 PolarHBondContact N-O 2.77Å; D798-H824 IonicContact OD1-CE1 3.41Å; D798-H824 PolarHBondContact OD1-CE1 3.05Å; D798-H824 IonicContact OD1-ND1 2.97Å; D798-H824 PolarHBondContact OD1-ND1 2.83Å; N822-H824 PolarHBondContact O-N 2.83Å
825	F	87.4	Confident	66.4	Low	5 Å²	5	77.4 Å²	77.4	2%	0.022	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	114.9	-177.9	-70.4	-96.7	0	0	0	108.5	I750 N753 L754 Y757 P780 V781 L794 V796 N822	I750-F825 HydrophobicContact CG1-CE2 4.23Å; I750-F825 HydrophobicContact CG2-CZ 4.27Å; N753-F825 HydrophobicContact CB-CE1 4.03Å; N753-F825 HydrophobicContact CB-CE2 3.76Å; N753-F825 HydrophobicContact CB-CZ 3.4Å; N753-F825 WeakPolarHBondContact ND2-CE2 3.44Å; L754-F825 HydrophobicContact CD2-CE1 4.25Å; L754-F825 HydrophobicContact CG-CE1 4.25Å; L754-F825 HydrophobicContact CG-CZ 4.31Å; Y757-F825 HydrophobicContact CD2-CE1 4.45Å; Y757-F825 AromaticContact CE2-CD1 3.91Å; Y757-F825 HydrophobicContact CE2-CD1 3.91Å; Y757-F825 AromaticContact CE2-CE1 3.95Å; Y757-F825 HydrophobicContact CE2-CE1 3.95Å; P780-F825 HydrophobicContact CB-CB 4.36Å; P780-F825 HydrophobicContact CB-CD2 4.45Å; P780-F825 HydrophobicContact CB-CG 4.39Å; P780-F825 HydrophobicContact CG-CB 4.17Å; P780-F825 HydrophobicContact CG-CD1 4.07Å; P780-F825 HydrophobicContact CG-CD2 4.11Å; P780-F825 HydrophobicContact CG-CG 3.85Å; V781-F825 HydrophobicContact CG2-CB 4.13Å; V781-F825 VanDerWaalsContact CG2-O 3.3Å; V781-F825 WeakPolarHBondContact CG2-O 3.36Å; L794-F825 HydrophobicContact CD1-CD1 4.41Å; L794-F825 HydrophobicContact CD2-CD1 4.33Å; V796-F825 HydrophobicContact CG1-CE1 4.23Å; V796-F825 HydrophobicContact CG1-CZ 4.22Å; V796-F825 HydrophobicContact CG2-CD1 3.76Å; V796-F825 HydrophobicContact CG2-CE1 3.64Å; V796-F825 HydrophobicContact CG2-CZ 4.43Å; N822-F825 PolarHBondContact O-N 3.06Å; N822-F825 VanDerWaalsContact O-O 3.07Å
826	T	86.8	Confident	68.1	Low	18 Å²	18	71.9 Å²	71.9	11%	0.11	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	152.3	-174.9	54.2	0	0	0	0	110.7	H795 E799	H795-T826 WeakPolarHBondContact CA-O 3.32Å; H795-T826 WeakPolarHBondContact CB-O 2.97Å; H795-T826 PolarHBondContact N-O 3.1Å; H795-T826 PolarHBondContact ND1-OG1 3.37Å; H795-T826 PolarHBondContact O-N 3.15Å; H795-T826 PolarHBondContact O-OG1 3.1Å; E799-T826 HydrophobicContact CG-CG2 4.34Å
827	M	87.7	Confident	69.7	Low	52 Å²	52	69.7 Å²	69.7	26%	0.256	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	130.1	172.2	-66.6	-51.3	-55.1	0	0	109.9	V781 P784 L792 Y793 L794	V781-M827 HydrophobicContact CG1-CG 3.82Å; V781-M827 HydrophobicContact CG1-SD 4.18Å; P784-M827 VanDerWaalsContact CD-CE 3.47Å; P784-M827 HydrophobicContact CG-CE 3.66Å; L792-M827 HydrophobicContact CB-CE 4.05Å; Y793-M827 VanDerWaalsContact C-CE 3.42Å; Y793-M827 VanDerWaalsContact O-CE 3.23Å; Y793-M827 WeakPolarHBondContact O-CE 3.41Å; L794-M827 HydrophobicContact CB-SD 4.42Å; L794-M827 HydrophobicContact CD1-SD 3.95Å
828	K	85.4	Confident	71.5	Confident	70 Å²	70	64.2 Å²	64.2	30%	0.304	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	158.5	174.8	-70.8	-170.6	-175	174.7	0	110.3	L792 Y793 H795	L792-K828 WeakPolarHBondContact CA-O 3.49Å; Y793-K828 HydrophobicContact CD1-CB 4.26Å; Y793-K828 WeakPolarHBondContact CD1-O 3.38Å; Y793-K828 HydrophobicContact CD2-CB 4.48Å; Y793-K828 HydrophobicContact CE1-CB 3.58Å; Y793-K828 HydrophobicContact CE2-CB 3.82Å; Y793-K828 PolarHBondContact N-O 2.77Å; Y793-K828 PolarHBondContact O-N 3.31Å; Y793-K828 WeakPolarHBondContact OH-CB 3.29Å; H795-K828 HydrophobicContact CB-CB 4.29Å; H795-K828 HydrophobicContact CB-CD 3.81Å; H795-K828 HydrophobicContact CB-CG 3.9Å; H795-K828 PolarHBondContact CD2-NZ 3.28Å; H795-K828 PolarHBondContact CE1-NZ 2.78Å; H795-K828 VanDerWaalsContact CE1-NZ 3.3Å; H795-K828 PolarHBondContact NE2-NZ 3.43Å
829	Q	84.4	Confident	73.8	Confident	75 Å²	75	61.4 Å²	61.4	35%	0.35	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.4	177.6	-172.6	169.3	21.1	0	0	109.7	S790 R791 L792 Y831	S790-Q829 WeakPolarHBondContact O-CG 3.21Å; S790-Q829 PolarHBondContact O-NE2 3.45Å; R791-Q829 HydrophobicContact CB-CG 4.11Å; L792-Q829 HydrophobicContact CD2-CB 4.17Å; Q829-Y831 HydrophobicContact CB-CD2 4.29Å; Q829-Y831 HydrophobicContact CB-CE2 3.72Å; Q829-Y831 VanDerWaalsContact CD-OH 3.31Å; Q829-Y831 HydrophobicContact CG-CD2 4.3Å; Q829-Y831 HydrophobicContact CG-CE2 3.74Å; Q829-Y831 WeakPolarHBondContact O-CD2 3.17Å; Q829-Y831 PolarHBondContact O-N 2.69Å; Q829-Y831 VanDerWaalsContact OE1-CZ 3.27Å; Q829-Y831 PolarHBondContact OE1-OH 3.01Å
830	L	81.7	Confident	75.2	Confident	16 Å²	16	58 Å²	58	8%	0.084	27%	0.272	C	S	.	.			trans	-79.6	102.1	-179.5	-179.7	72.7	0	0	0	109.2	W535 I630 L633 Y786 R791 Y793	W535-L830 HydrophobicContact CZ2-CD1 4.11Å; I630-L830 HydrophobicContact CD1-CD1 4.24Å; I630-L830 HydrophobicContact CD1-CD2 4.13Å; I630-L830 HydrophobicContact CD1-CG 4.47Å; I630-L830 HydrophobicContact CG1-CD2 3.78Å; I630-L830 HydrophobicContact CG2-CD2 4.41Å; L633-L830 HydrophobicContact CD1-CD2 4.4Å; Y786-L830 HydrophobicContact CE2-CD2 4.17Å; R791-L830 HydrophobicContact CB-CB 4.19Å; R791-L830 WeakPolarHBondContact CB-O 3.21Å; R791-L830 WeakPolarHBondContact CD-O 3.41Å; R791-L830 WeakPolarHBondContact O-CB 3.17Å; R791-L830 PolarHBondContact O-N 2.78Å; Y793-L830 HydrophobicContact CD1-CB 3.77Å; Y793-L830 HydrophobicContact CE1-CB 3.93Å
831	Y	71.9	Confident	76.3	Confident	154 Å²	154	53 Å²	53	60%	0.604	26%	0.255	S	S	*	.			trans	-91.5	121.5	169.3	-69.5	-82.7	0	0	0	109.4	Q829 S833	Q829-Y831 HydrophobicContact CB-CD2 4.29Å; Q829-Y831 HydrophobicContact CB-CE2 3.72Å; Q829-Y831 VanDerWaalsContact CD-OH 3.31Å; Q829-Y831 HydrophobicContact CG-CD2 4.3Å; Q829-Y831 HydrophobicContact CG-CE2 3.74Å; Q829-Y831 WeakPolarHBondContact O-CD2 3.17Å; Q829-Y831 PolarHBondContact O-N 2.69Å; Q829-Y831 VanDerWaalsContact OE1-CZ 3.27Å; Q829-Y831 PolarHBondContact OE1-OH 3.01Å; Y831-S833 PolarHBondContact O-N 3.37Å
832	E	68.3	Low	77.8	Confident	59 Å²	59	47.1 Å²	47.1	28%	0.276	23%	0.228	S	C	.	.			trans	-64.2	101.1	169	-166.1	177.8	-168.8	0	0	107.7	H836 K837 S840	E832-H836 HydrophobicContact CG-CB 3.45Å; E832-H836 VanDerWaalsContact CG-CB 3.45Å; E832-K837 HydrophobicContact CG-CG 3.92Å; E832-S840 WeakPolarHBondContact OE1-CB 3.25Å; E832-S840 PolarHBondContact OE1-OG 2.85Å
833	S	70.5	Confident	78.9	Confident	42 Å²	42	45.6 Å²	45.6	29%	0.294	22%	0.22	S	C	.	.			trans	-57.7	155.7	176.2	74.7	0	0	0	0	109.6	Y831 K835 H836 K837	Y831-S833 PolarHBondContact O-N 3.37Å; S833-K835 PolarHBondContact O-N 3.44Å; S833-K835 VanDerWaalsContact O-N 3.1Å; S833-K835 PolarHBondContact OG-N 2.96Å; S833-H836 PolarHBondContact N-ND1 3.31Å; S833-H836 WeakPolarHBondContact O-CB 3.33Å; S833-H836 PolarHBondContact O-N 3.04Å; S833-H836 PolarHBondContact OG-CE1 3Å; S833-H836 VanDerWaalsContact OG-CG 3.22Å; S833-H836 PolarHBondContact OG-N 2.99Å; S833-H836 VanDerWaalsContact OG-N 3.11Å; S833-H836 PolarHBondContact OG-ND1 2.98Å; S833-K837 PolarHBondContact O-N 3.48Å; S833-K837 VanDerWaalsContact O-N 3.12Å
834	D	66.5	Low	79.1	Confident	47 Å²	47	42.5 Å²	42.5	25%	0.251	21%	0.21	S	C	.	.	H	α-helix	trans	-58.6	-27.3	175.9	-62.6	-42.1	0	0	0	111.4	K837 L838 W890	D834-K837 PolarHBondContact O-N 2.72Å; D834-K837 IonicContact OD1-NZ 3.38Å; D834-K837 PolarHBondContact OD1-NZ 3Å; D834-L838 WeakPolarHBondContact O-CG 3.44Å; D834-L838 PolarHBondContact O-N 3.14Å; D834-W890 HydrophobicContact CB-CD2 3.99Å; D834-W890 HydrophobicContact CB-CE3 3.62Å; D834-W890 HydrophobicContact CB-CH2 3.98Å; D834-W890 HydrophobicContact CB-CZ2 4.31Å; D834-W890 HydrophobicContact CB-CZ3 3.62Å; D834-W890 VanDerWaalsContact OD2-CD2 3.23Å; D834-W890 VanDerWaalsContact OD2-CG 3.3Å
835	K	79	Confident	78.5	Confident	51 Å²	51	47 Å²	47	22%	0.222	23%	0.226	C	C	.	.	H	α-helix	trans	-63.9	-45.8	171.5	-57.9	-175.3	-179.7	-170.6	0	112.2	A581 Y582 S833 K837 L838	A581-K835 VanDerWaalsContact O-CE 3.27Å; A581-K835 WeakPolarHBondContact O-CE 3.3Å; Y582-K835 HydrophobicContact CD1-CD 4.22Å; Y582-K835 HydrophobicContact CE1-CD 3.89Å; Y582-K835 HydrophobicContact CE2-CB 4.46Å; Y582-K835 HydrophobicContact CE2-CD 4.43Å; S833-K835 PolarHBondContact O-N 3.44Å; S833-K835 VanDerWaalsContact O-N 3.1Å; S833-K835 PolarHBondContact OG-N 2.96Å; K835-K837 VanDerWaalsContact C-N 3.28Å; K835-K837 PolarHBondContact O-N 3.3Å; K835-L838 VanDerWaalsContact O-CB 3.28Å; K835-L838 WeakPolarHBondContact O-CB 3.28Å; K835-L838 PolarHBondContact O-N 3.43Å; K835-L838 VanDerWaalsContact O-N 3.1Å
836	H	82.8	Confident	77.8	Confident	22 Å²	22	46.8 Å²	46.8	10%	0.102	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-37.8	176.2	-59.3	150.5	0	0	0	111.9	D622 V627 E832 S833 L838 W839 S840	D622-H836 IonicContact OD1-CD2 3.26Å; D622-H836 IonicContact OD1-NE2 3.72Å; V627-H836 HydrophobicContact CG2-CB 3.98Å; E832-H836 HydrophobicContact CG-CB 3.45Å; E832-H836 VanDerWaalsContact CG-CB 3.45Å; S833-H836 PolarHBondContact N-ND1 3.31Å; S833-H836 WeakPolarHBondContact O-CB 3.33Å; S833-H836 PolarHBondContact O-N 3.04Å; S833-H836 PolarHBondContact OG-CE1 3Å; S833-H836 VanDerWaalsContact OG-CG 3.22Å; S833-H836 PolarHBondContact OG-N 2.99Å; S833-H836 VanDerWaalsContact OG-N 3.11Å; S833-H836 PolarHBondContact OG-ND1 2.98Å; H836-L838 VanDerWaalsContact C-N 3.26Å; H836-L838 PolarHBondContact O-N 3.13Å; H836-W839 PolarHBondContact O-N 2.93Å; H836-S840 PolarHBondContact O-N 2.66Å; H836-S840 PolarHBondContact O-OG 3.35Å
837	K	76.4	Confident	76.9	Confident	70 Å²	70	47.2 Å²	47.2	30%	0.304	23%	0.228	S	C	.	.	H	α-helix	trans	-63.3	-30.2	175.5	-65.3	178.6	-168.9	158	0	113	E832 S833 D834 K835 W839 S840 T841 L842	E832-K837 HydrophobicContact CG-CG 3.92Å; S833-K837 PolarHBondContact O-N 3.48Å; S833-K837 VanDerWaalsContact O-N 3.12Å; D834-K837 PolarHBondContact O-N 2.72Å; D834-K837 IonicContact OD1-NZ 3.38Å; D834-K837 PolarHBondContact OD1-NZ 3Å; K835-K837 VanDerWaalsContact C-N 3.28Å; K835-K837 PolarHBondContact O-N 3.3Å; K837-W839 VanDerWaalsContact C-N 3.32Å; K837-W839 PolarHBondContact O-N 2.82Å; K837-S840 WeakPolarHBondContact CA-OG 3.38Å; K837-T841 PolarHBondContact O-N 3.08Å; K837-T841 PolarHBondContact O-OG1 3.44Å; K837-L842 PolarHBondContact O-N 3.39Å
838	L	84.6	Confident	75.6	Confident	9 Å²	9	48.5 Å²	48.5	5%	0.047	23%	0.234	C	C	.	.	I	π-helix	trans	-58.2	-48.9	174.5	-59.4	173.7	0	0	0	110.2	I577 A581 D834 K835 H836 L842 F843	I577-L838 HydrophobicContact CG2-CD1 4.19Å; I577-L838 HydrophobicContact CG2-CD2 4.03Å; A581-L838 HydrophobicContact CB-CD1 3.44Å; A581-L838 VanDerWaalsContact CB-CD1 3.44Å; D834-L838 WeakPolarHBondContact O-CG 3.44Å; D834-L838 PolarHBondContact O-N 3.14Å; K835-L838 VanDerWaalsContact O-CB 3.28Å; K835-L838 WeakPolarHBondContact O-CB 3.28Å; K835-L838 PolarHBondContact O-N 3.43Å; K835-L838 VanDerWaalsContact O-N 3.1Å; H836-L838 VanDerWaalsContact C-N 3.26Å; H836-L838 PolarHBondContact O-N 3.13Å; L838-L842 HydrophobicContact CD2-CB 4.48Å; L838-L842 HydrophobicContact CD2-CD2 3.57Å; L838-L842 WeakPolarHBondContact O-CB 3.36Å; L838-L842 PolarHBondContact O-N 2.78Å; L838-F843 HydrophobicContact CB-CE1 4.18Å; L838-F843 HydrophobicContact CB-CE2 3.91Å; L838-F843 HydrophobicContact CB-CZ 3.72Å; L838-F843 HydrophobicContact CD1-CZ 4.5Å; L838-F843 WeakPolarHBondContact O-CD2 3.48Å; L838-F843 VanDerWaalsContact O-CG 3.27Å; L838-F843 WeakPolarHBondContact O-CG 2.9Å; L838-F843 PolarHBondContact O-N 3.15Å
839	W	83	Confident	74.2	Confident	10 Å²	10	48.2 Å²	48.2	4%	0.038	24%	0.235	C	C	.	.	I	π-helix	trans	-69.3	-43.9	178.9	-62.4	102.7	0	0	0	113.4	L562 M566 Y567 I578 Y582 I619 V627 H836 K837 F843 P844	L562-W839 HydrophobicContact CD2-CH2 4.03Å; M566-W839 HydrophobicContact CE-CE3 4.17Å; M566-W839 HydrophobicContact CE-CZ3 3.62Å; M566-W839 HydrophobicContact SD-CZ3 4.02Å; Y567-W839 HydrophobicContact CE2-CZ3 4.27Å; Y567-W839 VanDerWaalsContact OH-CE3 3.3Å; I578-W839 HydrophobicContact CD1-CH2 4.04Å; I578-W839 HydrophobicContact CD1-CZ2 4.42Å; Y582-W839 AromaticContact CZ-NE1 3.9Å; Y582-W839 PolarHBondContact OH-NE1 2.91Å; I619-W839 HydrophobicContact CG2-CH2 4.18Å; I619-W839 HydrophobicContact CG2-CZ2 3.87Å; I619-W839 WeakPolarHBondContact O-CZ2 2.98Å; V627-W839 HydrophobicContact CB-CB 4.18Å; V627-W839 HydrophobicContact CG1-CB 3.93Å; V627-W839 HydrophobicContact CG2-CB 3.8Å; V627-W839 HydrophobicContact CG2-CG 4.2Å; H836-W839 PolarHBondContact O-N 2.93Å; K837-W839 VanDerWaalsContact C-N 3.32Å; K837-W839 PolarHBondContact O-N 2.82Å; W839-F843 AromaticContact CD2-CD2 4Å; W839-F843 HydrophobicContact CD2-CD2 4Å; W839-F843 AromaticContact CD2-CE2 3.81Å; W839-F843 HydrophobicContact CD2-CE2 3.81Å; W839-F843 AromaticContact CE3-CD2 3.76Å; W839-F843 HydrophobicContact CE3-CD2 3.76Å; W839-F843 AromaticContact CE3-CE2 3.9Å; W839-F843 HydrophobicContact CE3-CE2 3.9Å; W839-F843 HydrophobicContact CG-CD2 4.37Å; W839-F843 HydrophobicContact CG-CE2 4.25Å; W839-F843 HydrophobicContact CZ2-CE2 4.46Å; W839-F843 HydrophobicContact CZ3-CD2 4.28Å; W839-F843 HydrophobicContact CZ3-CE2 4.25Å; W839-P844 VanDerWaalsContact O-CD 3.24Å; W839-P844 WeakPolarHBondContact O-CD 3.37Å; W839-P844 WeakPolarHBondContact O-CG 3.43Å
840	S	75.1	Confident	72.7	Confident	26 Å²	26	45.9 Å²	45.9	18%	0.182	23%	0.225	C	C	.	.	I	π-helix	trans	-81.8	-27.4	-172.1	69.7	0	0	0	0	113.7	E832 H836 K837	E832-S840 WeakPolarHBondContact OE1-CB 3.25Å; E832-S840 PolarHBondContact OE1-OG 2.85Å; H836-S840 PolarHBondContact O-N 2.66Å; H836-S840 PolarHBondContact O-OG 3.35Å; K837-S840 WeakPolarHBondContact CA-OG 3.38Å
841	T	72.2	Confident	70.6	Confident	57 Å²	57	52.6 Å²	52.6	35%	0.35	25%	0.249	S	C	.	.	I	π-helix	trans	-126.4	-47.5	-173.2	67.4	0	0	0	0	114.3	K837 R845	K837-T841 PolarHBondContact O-N 3.08Å; K837-T841 PolarHBondContact O-OG1 3.44Å; T841-R845 WeakPolarHBondContact O-CB 3.11Å; T841-R845 WeakPolarHBondContact O-CD 3.31Å; T841-R845 WeakPolarHBondContact O-CG 3.43Å; T841-R845 PolarHBondContact O-N 3.02Å
842	L	79.1	Confident	68.9	Low	28 Å²	28	52.3 Å²	52.3	15%	0.147	25%	0.251	C	S	.	.	I	π-helix	trans	-74.5	-59.6	-171.9	-176.8	62.9	0	0	0	111.3	I577 K837 L838 R845 L846	I577-L842 HydrophobicContact CD1-CD2 4.11Å; I577-L842 HydrophobicContact CG2-CD2 4.32Å; K837-L842 PolarHBondContact O-N 3.39Å; L838-L842 HydrophobicContact CD2-CB 4.48Å; L838-L842 HydrophobicContact CD2-CD2 3.57Å; L838-L842 WeakPolarHBondContact O-CB 3.36Å; L838-L842 PolarHBondContact O-N 2.78Å; L842-R845 WeakPolarHBondContact O-CA 3.48Å; L842-R845 WeakPolarHBondContact O-CB 3.1Å; L842-R845 PolarHBondContact O-N 3.48Å; L842-L846 HydrophobicContact CD1-CD1 4.19Å; L842-L846 HydrophobicContact CD1-CD2 4.22Å; L842-L846 HydrophobicContact CD1-CG 4.12Å; L842-L846 HydrophobicContact CD2-CD1 4.44Å; L842-L846 HydrophobicContact CG-CD1 3.87Å; L842-L846 HydrophobicContact CG-CG 4.19Å; L842-L846 WeakPolarHBondContact O-CG 3.13Å; L842-L846 PolarHBondContact O-N 3.1Å
843	F	83.1	Confident	67.2	Low	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-56.9	-42.9	-176.1	-55.7	-30.5	0	0	0	113	Y567 I574 I577 I578 L838 W839 R845 L846 T847	Y567-F843 HydrophobicContact CE1-CB 3.72Å; Y567-F843 HydrophobicContact CE2-CB 4.35Å; Y567-F843 HydrophobicContact CE2-CD2 4.28Å; Y567-F843 AromaticContact CZ-CD2 3.95Å; Y567-F843 WeakPolarHBondContact OH-CD2 3.29Å; I574-F843 HydrophobicContact CB-CD1 4.37Å; I574-F843 HydrophobicContact CD1-CB 4.46Å; I574-F843 HydrophobicContact CG1-CD1 4Å; I574-F843 HydrophobicContact CG2-CD1 3.84Å; I574-F843 HydrophobicContact CG2-CD2 4.38Å; I574-F843 HydrophobicContact CG2-CE1 3.92Å; I574-F843 HydrophobicContact CG2-CE2 4.46Å; I574-F843 HydrophobicContact CG2-CG 4.09Å; I574-F843 HydrophobicContact CG2-CZ 4.23Å; I577-F843 HydrophobicContact CB-CE1 4.08Å; I577-F843 HydrophobicContact CG2-CE1 3.71Å; I577-F843 HydrophobicContact CG2-CZ 4.09Å; I578-F843 HydrophobicContact CD1-CE2 4.12Å; I578-F843 HydrophobicContact CD1-CZ 4.14Å; I578-F843 HydrophobicContact CG1-CE1 4.45Å; I578-F843 HydrophobicContact CG1-CE2 3.89Å; I578-F843 HydrophobicContact CG1-CZ 3.51Å; L838-F843 HydrophobicContact CB-CE1 4.18Å; L838-F843 HydrophobicContact CB-CE2 3.91Å; L838-F843 HydrophobicContact CB-CZ 3.72Å; L838-F843 HydrophobicContact CD1-CZ 4.5Å; L838-F843 WeakPolarHBondContact O-CD2 3.48Å; L838-F843 VanDerWaalsContact O-CG 3.27Å; L838-F843 WeakPolarHBondContact O-CG 2.9Å; L838-F843 PolarHBondContact O-N 3.15Å; W839-F843 AromaticContact CD2-CD2 4Å; W839-F843 HydrophobicContact CD2-CD2 4Å; W839-F843 AromaticContact CD2-CE2 3.81Å; W839-F843 HydrophobicContact CD2-CE2 3.81Å; W839-F843 AromaticContact CE3-CD2 3.76Å; W839-F843 HydrophobicContact CE3-CD2 3.76Å; W839-F843 AromaticContact CE3-CE2 3.9Å; W839-F843 HydrophobicContact CE3-CE2 3.9Å; W839-F843 HydrophobicContact CG-CD2 4.37Å; W839-F843 HydrophobicContact CG-CE2 4.25Å; W839-F843 HydrophobicContact CZ2-CE2 4.46Å; W839-F843 HydrophobicContact CZ3-CD2 4.28Å; W839-F843 HydrophobicContact CZ3-CE2 4.25Å; F843-R845 VanDerWaalsContact C-N 3.31Å; F843-R845 PolarHBondContact O-N 3.21Å; F843-L846 HydrophobicContact CD1-CD1 4.29Å; F843-L846 PolarHBondContact O-N 3.4Å; F843-T847 PolarHBondContact O-N 2.78Å; F843-T847 PolarHBondContact O-OG1 3.19Å
844	P	73.3	Confident	65.4	Low	52 Å²	52	56 Å²	56	34%	0.338	26%	0.264	S	S	.	.	H	α-helix	trans	-63.3	-31.5	173.5	-24.2	35.5	0	0	0	114.1	W839 T847 M848	W839-P844 VanDerWaalsContact O-CD 3.24Å; W839-P844 WeakPolarHBondContact O-CD 3.37Å; W839-P844 WeakPolarHBondContact O-CG 3.43Å; P844-T847 PolarHBondContact O-OG1 2.98Å; P844-M848 WeakPolarHBondContact O-CG 3.4Å; P844-M848 PolarHBondContact O-N 3.08Å
845	R	69.3	Low	63.6	Low	123 Å²	123	56.9 Å²	56.9	46%	0.464	28%	0.284	S	S	.	.	H	α-helix	trans	-72.3	-40.1	174.2	-75.7	175.3	-179.5	-173.8	2.5	111.2	T841 L842 F843 T847 M848 M849	T841-R845 WeakPolarHBondContact O-CB 3.11Å; T841-R845 WeakPolarHBondContact O-CD 3.31Å; T841-R845 WeakPolarHBondContact O-CG 3.43Å; T841-R845 PolarHBondContact O-N 3.02Å; L842-R845 WeakPolarHBondContact O-CA 3.48Å; L842-R845 WeakPolarHBondContact O-CB 3.1Å; L842-R845 PolarHBondContact O-N 3.48Å; F843-R845 VanDerWaalsContact C-N 3.31Å; F843-R845 PolarHBondContact O-N 3.21Å; R845-T847 VanDerWaalsContact C-N 3.32Å; R845-T847 PolarHBondContact O-N 3.08Å; R845-M848 WeakPolarHBondContact O-CB 3.13Å; R845-M848 PolarHBondContact O-N 3.4Å; R845-M848 VanDerWaalsContact O-N 3.09Å; R845-M849 WeakPolarHBondContact O-CG 3.21Å; R845-M849 PolarHBondContact O-N 2.88Å
846	L	72	Confident	61.1	Low	2 Å²	2	63 Å²	63	1%	0.01	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-40.9	178.4	-64.7	179.2	0	0	0	111.1	N570 I574 I577 L842 F843 M848 M849 Y879	N570-L846 PolarHBondContact ND2-O 2.92Å; I574-L846 HydrophobicContact CG1-CB 4.49Å; I574-L846 HydrophobicContact CG1-CD1 4.07Å; I577-L846 HydrophobicContact CD1-CD1 3.79Å; L842-L846 HydrophobicContact CD1-CD1 4.19Å; L842-L846 HydrophobicContact CD1-CD2 4.22Å; L842-L846 HydrophobicContact CD1-CG 4.12Å; L842-L846 HydrophobicContact CD2-CD1 4.44Å; L842-L846 HydrophobicContact CG-CD1 3.87Å; L842-L846 HydrophobicContact CG-CG 4.19Å; L842-L846 WeakPolarHBondContact O-CG 3.13Å; L842-L846 PolarHBondContact O-N 3.1Å; F843-L846 HydrophobicContact CD1-CD1 4.29Å; F843-L846 PolarHBondContact O-N 3.4Å; L846-M848 PolarHBondContact O-N 3.4Å; L846-M849 HydrophobicContact CD2-CE 4.44Å; L846-M849 HydrophobicContact CD2-SD 4Å; L846-M849 PolarHBondContact O-N 3.37Å; L846-Y879 HydrophobicContact CD1-CE1 3.79Å; L846-Y879 VanDerWaalsContact CD1-OH 3.3Å; L846-Y879 WeakPolarHBondContact CD1-OH 3.48Å; L846-Y879 HydrophobicContact CD2-CD1 4.31Å; L846-Y879 HydrophobicContact CD2-CE1 3.33Å; L846-Y879 HydrophobicContact CD2-CE2 4.38Å; L846-Y879 VanDerWaalsContact CD2-OH 3.26Å; L846-Y879 WeakPolarHBondContact CD2-OH 3.31Å; L846-Y879 HydrophobicContact CG-CE1 4.13Å; L846-Y879 WeakPolarHBondContact CG-OH 3.33Å
847	T	68.5	Low	58.2	Low	27 Å²	27	66.3 Å²	66.3	17%	0.166	34%	0.337	C	S	.	.	H	α-helix	trans	-66.2	-24.7	175.2	55.9	0	0	0	0	113.8	Y567 I574 F843 P844 R845	Y567-T847 HydrophobicContact CD1-CG2 3.54Å; Y567-T847 HydrophobicContact CE1-CG2 4.48Å; Y567-T847 HydrophobicContact CG-CG2 4.14Å; I574-T847 HydrophobicContact CD1-CG2 4.25Å; F843-T847 PolarHBondContact O-N 2.78Å; F843-T847 PolarHBondContact O-OG1 3.19Å; P844-T847 PolarHBondContact O-OG1 2.98Å; R845-T847 VanDerWaalsContact C-N 3.32Å; R845-T847 PolarHBondContact O-N 3.08Å
848	M	60.6	Low	55.7	Low	79 Å²	79	71.1 Å²	71.1	39%	0.389	36%	0.362	S	S	.	.	H	α-helix	trans	-81.2	-21.4	176.8	-74	-171.7	161.9	0	0	114.2	P844 R845 L846 D850	P844-M848 WeakPolarHBondContact O-CG 3.4Å; P844-M848 PolarHBondContact O-N 3.08Å; R845-M848 WeakPolarHBondContact O-CB 3.13Å; R845-M848 PolarHBondContact O-N 3.4Å; R845-M848 VanDerWaalsContact O-N 3.09Å; L846-M848 PolarHBondContact O-N 3.4Å; M848-D850 PolarHBondContact O-N 3.26Å
849	M	56.7	Low	52.9	Low	64 Å²	64	79.4 Å²	79.4	32%	0.315	40%	0.401	S	S	.	.	H	α-helix	trans	-67.6	-36.2	-173.4	-75.8	179.2	178	0	0	113.3	R845 L846 K852 F882	R845-M849 WeakPolarHBondContact O-CG 3.21Å; R845-M849 PolarHBondContact O-N 2.88Å; L846-M849 HydrophobicContact CD2-CE 4.44Å; L846-M849 HydrophobicContact CD2-SD 4Å; L846-M849 PolarHBondContact O-N 3.37Å; M849-K852 PolarHBondContact O-N 3.04Å; M849-F882 HydrophobicContact CE-CB 4.37Å; M849-F882 HydrophobicContact CE-CD1 3.62Å; M849-F882 HydrophobicContact CE-CD2 3.56Å; M849-F882 HydrophobicContact CE-CE1 3.66Å; M849-F882 HydrophobicContact CE-CE2 3.6Å; M849-F882 HydrophobicContact CE-CG 3.57Å; M849-F882 HydrophobicContact CE-CZ 3.65Å
850	D	51.3	Low	50.3	Low	25 Å²	25	85.4 Å²	85.4	13%	0.134	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-10.4	-174.1	-152.5	37.9	0	0	0	113.5	M848 K852 T853 K854	M848-D850 PolarHBondContact O-N 3.26Å; D850-K852 PolarHBondContact O-N 2.82Å; D850-T853 VanDerWaalsContact CA-OG1 3.3Å; D850-T853 WeakPolarHBondContact CA-OG1 3.45Å; D850-T853 PolarHBondContact O-N 2.94Å; D850-T853 PolarHBondContact O-OG1 2.85Å; D850-T853 PolarHBondContact OD1-OG1 3.27Å; D850-K854 PolarHBondContact O-N 3.19Å
851	R	38.3	Very low	48	Very low	157 Å²	157	87.9 Å²	87.9	59%	0.592	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-25.4	167.8	-87	-169.9	178.3	-175	0.5	112.1	N475	N475-R851 PolarHBondContact ND2-NH1 3.26Å
852	K	35.7	Very low	45.9	Very low	149 Å²	149	92.5 Å²	92.5	65%	0.648	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-20.8	-179.4	-71.4	-168.6	170.6	-163.5	0	113.9	M849 D850	M849-K852 PolarHBondContact O-N 3.04Å; D850-K852 PolarHBondContact O-N 2.82Å
853	T	34.1	Very low	43.3	Very low	40 Å²	40	100 Å²	100	25%	0.245	52%	0.519	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-33.3	-176.7	39.7	0	0	0	0	112	D850 G855 F856	D850-T853 VanDerWaalsContact CA-OG1 3.3Å; D850-T853 WeakPolarHBondContact CA-OG1 3.45Å; D850-T853 PolarHBondContact O-N 2.94Å; D850-T853 PolarHBondContact O-OG1 2.85Å; D850-T853 PolarHBondContact OD1-OG1 3.27Å; T853-G855 PolarHBondContact O-N 3.31Å; T853-F856 PolarHBondContact O-N 2.77Å
854	K	32.4	Very low	40.7	Very low	137 Å²	137	106.9 Å²	106.9	60%	0.596	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-67.8	-13.8	174.4	-79.3	-173.2	175.8	-179	0	115.1	D850 F856	D850-K854 PolarHBondContact O-N 3.19Å; K854-F856 PolarHBondContact O-N 3.21Å
855	G	28.1	Very low	38.5	Very low	66 Å²	66	112 Å²	112	68%	0.68	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-72.7	-9.8	169.1	0	0	0	0	0	114.2	T853	T853-G855 PolarHBondContact O-N 3.31Å
856	F	25.9	Very low	36.5	Very low	180 Å²	180	114.4 Å²	114.4	79%	0.789	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-101.4	36.4	175.1	-83.9	-86.9	0	0	0	112	T853 K854 M858	T853-F856 PolarHBondContact O-N 2.77Å; K854-F856 PolarHBondContact O-N 3.21Å; F856-M858 PolarHBondContact O-N 2.77Å
857	S	23.7	Very low	34.4	Very low	91 Å²	91	122.4 Å²	122.4	64%	0.636	64%	0.639	S	S	*	*			trans	-62	107.3	161.8	60.8	0	0	0	0	107.4	H859	S857-H859 VanDerWaalsContact C-N 3.32Å; S857-H859 PolarHBondContact O-N 3.03Å
858	M	23.8	Very low	32.5	Very low	171 Å²	171	130.1 Å²	130.1	84%	0.842	67%	0.673	S	S	*	*			trans	-57.6	96.5	174.6	-68.9	-180	86.5	0	0	108.6	F856 N860	F856-M858 PolarHBondContact O-N 2.77Å; M858-N860 PolarHBondContact O-N 3.05Å
859	H	24.8	Very low	30.9	Very low	184 Å²	184	136.4 Å²	136.4	85%	0.852	69%	0.694	S	S	*	*			trans	-68.3	85.6	149.3	-103.8	-64.2	0	0	0	105.9	S857	S857-H859 VanDerWaalsContact C-N 3.32Å; S857-H859 PolarHBondContact O-N 3.03Å
860	N	29.2	Very low	29.7	Very low	136 Å²	136	136.3 Å²	136.3	73%	0.727	70%	0.698	S	S	*	*			trans	-150.6	107.1	153.2	-95.3	-15.2	0	0	0	106.2	M858 N862	M858-N860 PolarHBondContact O-N 3.05Å; N860-N862 PolarHBondContact O-N 2.85Å; N860-N862 VanDerWaalsContact O-N 3.09Å
861	G	26.3	Very low	28.7	Very low	77 Å²	77	142.5 Å²	142.5	79%	0.794	72%	0.72	S	S	*	*			trans	-61.1	108.6	169.1	0	0	0	0	0	108.4
862	N	27.4	Very low	28.4	Very low	154 Å²	154	142.8 Å²	142.8	82%	0.824	73%	0.729	S	S	*	*			trans	-169.2	90.3	143.4	-89.7	-12.4	0	0	0	104.1	N860	N860-N862 PolarHBondContact O-N 2.85Å; N860-N862 VanDerWaalsContact O-N 3.09Å
863	E	25.8	Very low	28.3	Very low	185 Å²	185	139.2 Å²	139.2	86%	0.864	71%	0.714	S	S	*	*			trans	-58	147.3	153.7	-67.5	176.5	156.3	0	0	107.1
864	D	27.7	Very low	28.4	Very low	146 Å²	146	141.4 Å²	141.4	78%	0.781	73%	0.727	S	S	*	*	S	Bend	trans	97	109.2	-173.9	-48.7	-25.9	0	0	0	114.1
865	N	26.1	Very low	28.6	Very low	160 Å²	160	137 Å²	137	86%	0.856	71%	0.71	S	S	*	*			trans	106.8	28.4	174.2	-54.4	-28	0	0	0	119	E867	N865-E867 PolarHBondContact O-N 2.91Å
866	I	28.3	Very low	29	Very low	172 Å²	172	139 Å²	139	88%	0.882	70%	0.701	S	S	*	*			trans	-87.7	89.2	162.5	-57.6	178.5	0	0	0	109
867	E	28.2	Very low	29.6	Very low	171 Å²	171	134.2 Å²	134.2	80%	0.799	68%	0.683	S	S	*	*			trans	-58.4	143.2	162.9	-81.7	-175	153.6	0	0	111.2	N865 Y869	N865-E867 PolarHBondContact O-N 2.91Å; E867-Y869 PolarHBondContact O-N 3.23Å; E867-Y869 VanDerWaalsContact O-N 3.16Å
868	Q	27.6	Very low	30.4	Very low	189 Å²	189	136.3 Å²	136.3	88%	0.883	68%	0.681	S	S	*	*			trans	-59.9	103.3	-176	-67.5	165	-42.4	0	0	113.1
869	Y	28.1	Very low	31.4	Very low	210 Å²	210	129.3 Å²	129.3	82%	0.824	65%	0.645	S	S	*	*			trans	-136.9	134.7	154.5	-84.8	-83.6	0	0	0	111.1	E867 Y871	E867-Y869 PolarHBondContact O-N 3.23Å; E867-Y869 VanDerWaalsContact O-N 3.16Å; Y869-Y871 PolarHBondContact O-N 3.22Å
870	P	31.4	Very low	32.1	Very low	62 Å²	62	122.7 Å²	122.7	40%	0.403	61%	0.614	S	S	.	*			trans	-85.6	122.3	-153.6	10.1	6.3	0	0	0	111.4	Q872 Q873	P870-Q872 PolarHBondContact O-N 3.21Å; P870-Q873 HydrophobicContact CG-CG 4.49Å; P870-Q873 PolarHBondContact O-N 3.22Å
871	Y	30.5	Very low	32.4	Very low	155 Å²	155	123.5 Å²	123.5	61%	0.608	61%	0.608	S	S	*	*	H	α-helix	trans	-49	-19.2	170.2	-162.8	-95.8	0	0	0	113.7	Y869 L875	Y869-Y871 PolarHBondContact O-N 3.22Å; Y871-L875 HydrophobicContact CE1-CD1 4.33Å
872	Q	31.4	Very low	33	Very low	164 Å²	164	124.2 Å²	124.2	77%	0.766	59%	0.589	S	S	*	*	H	α-helix	trans	-71.7	-32.4	175.1	-68.6	178.7	-25.9	0	0	114	P870 F876	P870-Q872 PolarHBondContact O-N 3.21Å; Q872-F876 PolarHBondContact O-N 2.96Å
873	Q	32.9	Very low	33.4	Very low	74 Å²	74	119.5 Å²	119.5	35%	0.346	56%	0.564	S	S	.	*	H	α-helix	trans	-73.2	-36.2	-179.5	-91.2	177.1	-15.3	0	0	112.6	P870 F876 N877 Y908	P870-Q873 HydrophobicContact CG-CG 4.49Å; P870-Q873 PolarHBondContact O-N 3.22Å; Q873-F876 PolarHBondContact O-N 3.1Å; Q873-N877 WeakPolarHBondContact O-CB 3.49Å; Q873-N877 PolarHBondContact O-N 2.8Å; Q873-Y908 PolarHBondContact NE2-OH 3.22Å
874	T	36.4	Very low	34.1	Very low	85 Å²	85	116.3 Å²	116.3	52%	0.521	55%	0.549	S	S	.	.	H	α-helix	trans	-69.4	-34	178.5	-6.5	0	0	0	0	112.1	K878	T874-K878 WeakPolarHBondContact O-CB 3.28Å; T874-K878 PolarHBondContact O-N 3.27Å; T874-K878 VanDerWaalsContact O-N 3.12Å
875	L	37.8	Very low	34.5	Very low	45 Å²	45	114 Å²	114	24%	0.236	54%	0.536	C	S	.	.	H	α-helix	trans	-69.1	-45	174.5	-132.3	93.2	0	0	0	110.8	Y871 K878 Y879	Y871-L875 HydrophobicContact CE1-CD1 4.33Å; L875-K878 PolarHBondContact O-N 3.3Å; L875-Y879 HydrophobicContact CD2-CE2 4.3Å; L875-Y879 WeakPolarHBondContact O-CB 3.15Å; L875-Y879 WeakPolarHBondContact O-CD2 3.17Å; L875-Y879 PolarHBondContact O-N 3.41Å
876	F	36.4	Very low	35	Very low	109 Å²	109	112.6 Å²	112.6	48%	0.478	52%	0.522	S	S	.	.	H	α-helix	trans	-64.5	-42.1	-180	-158.4	-94.5	0	0	0	112.2	Q872 Q873 Y879 F880	Q872-F876 PolarHBondContact O-N 2.96Å; Q873-F876 PolarHBondContact O-N 3.1Å; F876-Y879 WeakPolarHBondContact O-CB 3.37Å; F876-Y879 PolarHBondContact O-N 2.9Å; F876-F880 HydrophobicContact CE1-CD2 4.37Å; F876-F880 PolarHBondContact O-N 2.93Å
877	N	37.7	Very low	35.5	Very low	79 Å²	79	109.1 Å²	109.1	42%	0.422	50%	0.502	S	S	.	.	H	α-helix	trans	-66.2	-38	175.2	-76.7	-15	0	0	0	112.4	Q873 Y879 F880 Y881	Q873-N877 WeakPolarHBondContact O-CB 3.49Å; Q873-N877 PolarHBondContact O-N 2.8Å; N877-Y879 VanDerWaalsContact C-N 3.32Å; N877-Y879 PolarHBondContact O-N 3.11Å; N877-F880 PolarHBondContact O-N 3Å; N877-Y881 PolarHBondContact O-N 3.42Å; N877-Y881 VanDerWaalsContact O-N 3.09Å
878	K	40.3	Very low	36	Very low	135 Å²	135	103 Å²	103	59%	0.587	48%	0.476	S	S	*	.	H	α-helix	trans	-64.4	-36.6	171.1	-85.3	179.3	175.9	173.9	0	112.2	T874 L875 F882	T874-K878 WeakPolarHBondContact O-CB 3.28Å; T874-K878 PolarHBondContact O-N 3.27Å; T874-K878 VanDerWaalsContact O-N 3.12Å; L875-K878 PolarHBondContact O-N 3.3Å; K878-F882 PolarHBondContact O-N 2.9Å
879	Y	44.7	Very low	36.5	Very low	24 Å²	24	101.1 Å²	101.1	9%	0.094	47%	0.473	C	S	.	.	H	α-helix	trans	-65.1	-43.3	176.1	-106.4	-87.7	0	0	0	112.2	V573 I577 L846 L875 F876 N877 F882 L883	V573-Y879 HydrophobicContact CB-CE1 4.16Å; V573-Y879 HydrophobicContact CB-CE2 4.15Å; V573-Y879 WeakPolarHBondContact CB-OH 3.36Å; V573-Y879 HydrophobicContact CG1-CD1 3.79Å; V573-Y879 HydrophobicContact CG1-CD2 4.4Å; V573-Y879 HydrophobicContact CG1-CE1 3.19Å; V573-Y879 HydrophobicContact CG1-CE2 3.89Å; V573-Y879 HydrophobicContact CG1-CG 4.34Å; V573-Y879 WeakPolarHBondContact CG1-OH 3.35Å; V573-Y879 HydrophobicContact CG2-CE2 3.88Å; I577-Y879 HydrophobicContact CD1-CE1 4.4Å; L846-Y879 HydrophobicContact CD1-CE1 3.79Å; L846-Y879 VanDerWaalsContact CD1-OH 3.3Å; L846-Y879 WeakPolarHBondContact CD1-OH 3.48Å; L846-Y879 HydrophobicContact CD2-CD1 4.31Å; L846-Y879 HydrophobicContact CD2-CE1 3.33Å; L846-Y879 HydrophobicContact CD2-CE2 4.38Å; L846-Y879 VanDerWaalsContact CD2-OH 3.26Å; L846-Y879 WeakPolarHBondContact CD2-OH 3.31Å; L846-Y879 HydrophobicContact CG-CE1 4.13Å; L846-Y879 WeakPolarHBondContact CG-OH 3.33Å; L875-Y879 HydrophobicContact CD2-CE2 4.3Å; L875-Y879 WeakPolarHBondContact O-CB 3.15Å; L875-Y879 WeakPolarHBondContact O-CD2 3.17Å; L875-Y879 PolarHBondContact O-N 3.41Å; F876-Y879 WeakPolarHBondContact O-CB 3.37Å; F876-Y879 PolarHBondContact O-N 2.9Å; N877-Y879 VanDerWaalsContact C-N 3.32Å; N877-Y879 PolarHBondContact O-N 3.11Å; Y879-F882 PolarHBondContact O-N 2.78Å; Y879-L883 WeakPolarHBondContact O-CG 3.42Å; Y879-L883 PolarHBondContact O-N 2.85Å
880	F	40.9	Very low	37.1	Very low	45 Å²	45	96 Å²	96	20%	0.197	45%	0.452	C	S	.	.	H	α-helix	trans	-68.4	-40.1	-179.9	-139.5	-87.7	0	0	0	112.1	F876 N877 F882 L883 Q884 V895 K899 F905	F876-F880 HydrophobicContact CE1-CD2 4.37Å; F876-F880 PolarHBondContact O-N 2.93Å; N877-F880 PolarHBondContact O-N 3Å; F880-F882 VanDerWaalsContact C-N 3.28Å; F880-F882 PolarHBondContact O-N 3.34Å; F880-L883 PolarHBondContact O-N 3.48Å; F880-Q884 PolarHBondContact O-N 2.8Å; F880-V895 HydrophobicContact CE1-CG1 4.22Å; F880-V895 HydrophobicContact CE2-CG1 4.42Å; F880-V895 HydrophobicContact CZ-CG1 3.73Å; F880-K899 VanDerWaalsContact CZ-CE 3.48Å; F880-K899 HydrophobicContact CZ-CG 4.36Å; F880-F905 AromaticContact CE2-CZ 3.66Å; F880-F905 HydrophobicContact CE2-CZ 3.66Å; F880-F905 HydrophobicContact CZ-CE1 4.33Å; F880-F905 AromaticContact CZ-CZ 3.76Å; F880-F905 HydrophobicContact CZ-CZ 3.76Å
881	Y	33.8	Very low	37.6	Very low	153 Å²	153	94.7 Å²	94.7	60%	0.6	44%	0.441	S	S	*	.	H	α-helix	trans	-63	-35.5	175.6	-136.2	-90.7	0	0	0	111.9	N877 L885	N877-Y881 PolarHBondContact O-N 3.42Å; N877-Y881 VanDerWaalsContact O-N 3.09Å; Y881-L885 HydrophobicContact CD1-CD1 3.74Å; Y881-L885 HydrophobicContact CE1-CD1 4.17Å; Y881-L885 WeakPolarHBondContact O-CB 3.29Å; Y881-L885 WeakPolarHBondContact O-CD1 3.25Å; Y881-L885 WeakPolarHBondContact O-CG 3.44Å
882	F	38.7	Very low	38	Very low	92 Å²	92	90.2 Å²	90.2	40%	0.404	43%	0.428	S	S	.	.	H	α-helix	trans	-77.6	-34.3	178.5	-156.1	-92.4	0	0	0	113.1	M849 K878 Y879 F880 Q884 L885	M849-F882 HydrophobicContact CE-CB 4.37Å; M849-F882 HydrophobicContact CE-CD1 3.62Å; M849-F882 HydrophobicContact CE-CD2 3.56Å; M849-F882 HydrophobicContact CE-CE1 3.66Å; M849-F882 HydrophobicContact CE-CE2 3.6Å; M849-F882 HydrophobicContact CE-CG 3.57Å; M849-F882 HydrophobicContact CE-CZ 3.65Å; K878-F882 PolarHBondContact O-N 2.9Å; Y879-F882 PolarHBondContact O-N 2.78Å; F880-F882 VanDerWaalsContact C-N 3.28Å; F880-F882 PolarHBondContact O-N 3.34Å; F882-Q884 PolarHBondContact O-N 3.42Å; F882-L885 PolarHBondContact O-N 2.95Å; F882-L885 VanDerWaalsContact O-N 3.09Å
883	L	37.6	Very low	38.6	Very low	55 Å²	55	84 Å²	84	29%	0.288	41%	0.408	S	S	.	.	H	α-helix	trans	-60.8	-25.8	173.1	-79.5	164	0	0	0	112.4	Y879 F880 L891 V895	Y879-L883 WeakPolarHBondContact O-CG 3.42Å; Y879-L883 PolarHBondContact O-N 2.85Å; F880-L883 PolarHBondContact O-N 3.48Å; L883-L891 HydrophobicContact CD2-CD2 3.95Å; L883-V895 HydrophobicContact CD2-CG2 4.48Å
884	Q	39	Very low	39	Very low	118 Å²	118	81.8 Å²	81.8	55%	0.551	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-11.2	176.3	-118.2	171.2	-31.1	0	0	114.4	F880 F882	F880-Q884 PolarHBondContact O-N 2.8Å; F882-Q884 PolarHBondContact O-N 3.42Å
885	L	36.5	Very low	39.3	Very low	96 Å²	96	78.2 Å²	78.2	50%	0.503	38%	0.376	S	S	.	.	S	Bend	trans	-106.5	-4.5	-153.5	-99.4	176.5	0	0	0	120.4	Y881 F882	Y881-L885 HydrophobicContact CD1-CD1 3.74Å; Y881-L885 HydrophobicContact CE1-CD1 4.17Å; Y881-L885 WeakPolarHBondContact O-CB 3.29Å; Y881-L885 WeakPolarHBondContact O-CD1 3.25Å; Y881-L885 WeakPolarHBondContact O-CG 3.44Å; F882-L885 PolarHBondContact O-N 2.95Å; F882-L885 VanDerWaalsContact O-N 3.09Å
886	K	37.5	Very low	39.5	Very low	132 Å²	132	80.3 Å²	80.3	57%	0.574	39%	0.387	S	S	*	.	S	Bend	trans	-179.3	127.7	162.1	-106.3	151.7	-177	-175.7	0	114.4	F941	K886-F941 PolarHBondContact NZ-O 3.12Å
887	E	37.4	Very low	39.7	Very low	99 Å²	99	79.5 Å²	79.5	46%	0.463	38%	0.384	S	S	.	.	S	Bend	trans	74.1	35.6	149.5	-65.4	177.5	-174.2	0	0	120.4	Y947	E887-Y947 WeakPolarHBondContact CG-OH 3.37Å; E887-Y947 WeakPolarHBondContact OE1-CE2 3.33Å; E887-Y947 VanDerWaalsContact OE1-CZ 3.25Å; E887-Y947 PolarHBondContact OE1-OH 3.27Å
888	T	40.3	Very low	39.7	Very low	42 Å²	42	79 Å²	79	26%	0.258	38%	0.379	S	S	.	.			trans	-144.5	98.3	153.4	39.9	0	0	0	0	111	W890 L891 N892	T888-W890 PolarHBondContact O-N 2.8Å; T888-L891 PolarHBondContact O-N 3.37Å; T888-L891 WeakPolarHBondContact OG1-CB 3.32Å; T888-L891 WeakPolarHBondContact OG1-CD1 3.33Å; T888-N892 PolarHBondContact O-N 2.81Å
889	D	36.8	Very low	39.8	Very low	150 Å²	150	76.5 Å²	76.5	80%	0.802	37%	0.369	S	S	*	.	H	α-helix	trans	-51	-30.9	173.4	-70.9	-29.6	0	0	0	112.4	N892 G893	D889-N892 PolarHBondContact O-N 3.42Å; D889-G893 PolarHBondContact O-N 2.89Å
890	W	42.2	Very low	39.8	Very low	101 Å²	101	80.4 Å²	80.4	38%	0.383	40%	0.395	S	S	.	.	H	α-helix	trans	-65.3	-43.6	176.7	179.6	84.6	0	0	0	113.5	D834 T888 N892 G893 Q894	D834-W890 HydrophobicContact CB-CD2 3.99Å; D834-W890 HydrophobicContact CB-CE3 3.62Å; D834-W890 HydrophobicContact CB-CH2 3.98Å; D834-W890 HydrophobicContact CB-CZ2 4.31Å; D834-W890 HydrophobicContact CB-CZ3 3.62Å; D834-W890 VanDerWaalsContact OD2-CD2 3.23Å; D834-W890 VanDerWaalsContact OD2-CG 3.3Å; T888-W890 PolarHBondContact O-N 2.8Å; W890-N892 VanDerWaalsContact C-N 3.34Å; W890-G893 CarbonylContact O-C 3.57Å; W890-G893 WeakPolarHBondContact O-CA 3.14Å; W890-G893 PolarHBondContact O-N 2.62Å; W890-G893 VanDerWaalsContact O-N 3.12Å; W890-Q894 HydrophobicContact CD2-CG 4.02Å; W890-Q894 HydrophobicContact CE3-CG 4.38Å; W890-Q894 HydrophobicContact CH2-CG 4.19Å; W890-Q894 HydrophobicContact CZ2-CG 3.81Å; W890-Q894 HydrophobicContact CZ3-CG 4.46Å; W890-Q894 WeakPolarHBondContact O-CG 3.33Å; W890-Q894 PolarHBondContact O-N 3.33Å
891	L	41.5	Very low	39.7	Very low	35 Å²	35	84.1 Å²	84.1	18%	0.183	42%	0.417	C	S	.	.	H	α-helix	trans	-68.1	-36.7	178.2	-102.4	155.1	0	0	0	110.7	L883 T888 G893 Q894 V895	L883-L891 HydrophobicContact CD2-CD2 3.95Å; T888-L891 PolarHBondContact O-N 3.37Å; T888-L891 WeakPolarHBondContact OG1-CB 3.32Å; T888-L891 WeakPolarHBondContact OG1-CD1 3.33Å; L891-G893 VanDerWaalsContact C-N 3.3Å; L891-G893 PolarHBondContact O-N 3.49Å; L891-Q894 PolarHBondContact O-N 3.06Å; L891-V895 HydrophobicContact CD2-CG2 4.38Å; L891-V895 VanDerWaalsContact O-CB 3.26Å; L891-V895 WeakPolarHBondContact O-CB 3.31Å; L891-V895 WeakPolarHBondContact O-CG2 3.42Å; L891-V895 PolarHBondContact O-N 2.87Å
892	N	39.1	Very low	39.9	Very low	61 Å²	61	78.7 Å²	78.7	33%	0.326	40%	0.401	S	S	.	.	H	α-helix	trans	-60.4	-40.8	169.9	-80.4	-24.1	0	0	0	111.7	T888 D889 W890 N896	T888-N892 PolarHBondContact O-N 2.81Å; D889-N892 PolarHBondContact O-N 3.42Å; W890-N892 VanDerWaalsContact C-N 3.34Å; N892-N896 VanDerWaalsContact O-CB 3.23Å; N892-N896 WeakPolarHBondContact O-CB 3.26Å; N892-N896 PolarHBondContact O-N 2.97Å; N892-N896 PolarHBondContact O-ND2 3.34Å
893	G	43	Very low	39.6	Very low	35 Å²	35	85.3 Å²	85.3	36%	0.361	42%	0.423	S	S	.	.	H	α-helix	trans	-63.1	-38.8	173.4	0	0	0	0	0	113.9	D889 W890 L891 K897	D889-G893 PolarHBondContact O-N 2.89Å; W890-G893 CarbonylContact O-C 3.57Å; W890-G893 WeakPolarHBondContact O-CA 3.14Å; W890-G893 PolarHBondContact O-N 2.62Å; W890-G893 VanDerWaalsContact O-N 3.12Å; L891-G893 VanDerWaalsContact C-N 3.3Å; L891-G893 PolarHBondContact O-N 3.49Å; G893-K897 WeakPolarHBondContact O-CG 3.22Å; G893-K897 PolarHBondContact O-N 2.79Å; G893-K897 VanDerWaalsContact O-N 3.14Å
894	Q	41.9	Very low	39.6	Very low	27 Å²	27	89.7 Å²	89.7	13%	0.126	45%	0.446	C	S	.	.	H	α-helix	trans	-76.9	-40.5	178.5	-67.5	-62.4	-25.5	0	0	112.7	Y580 W890 L891 N896 K897 M898	Y580-Q894 PolarHBondContact OH-OE1 3.24Å; W890-Q894 HydrophobicContact CD2-CG 4.02Å; W890-Q894 HydrophobicContact CE3-CG 4.38Å; W890-Q894 HydrophobicContact CH2-CG 4.19Å; W890-Q894 HydrophobicContact CZ2-CG 3.81Å; W890-Q894 HydrophobicContact CZ3-CG 4.46Å; W890-Q894 WeakPolarHBondContact O-CG 3.33Å; W890-Q894 PolarHBondContact O-N 3.33Å; L891-Q894 PolarHBondContact O-N 3.06Å; Q894-N896 VanDerWaalsContact C-N 3.32Å; Q894-K897 CarbonylContact O-C 3.59Å; Q894-K897 WeakPolarHBondContact O-CB 3.5Å; Q894-K897 PolarHBondContact O-N 2.91Å; Q894-K897 VanDerWaalsContact O-N 3.15Å; Q894-M898 WeakPolarHBondContact O-CG 3.38Å; Q894-M898 PolarHBondContact O-N 2.93Å
895	V	41.9	Very low	39.5	Very low	9 Å²	9	86.7 Å²	86.7	6%	0.055	43%	0.432	C	S	.	.	H	α-helix	trans	-64.3	-39.3	174.4	171	0	0	0	0	110.1	F880 L883 L891 K897 M898 K899	F880-V895 HydrophobicContact CE1-CG1 4.22Å; F880-V895 HydrophobicContact CE2-CG1 4.42Å; F880-V895 HydrophobicContact CZ-CG1 3.73Å; L883-V895 HydrophobicContact CD2-CG2 4.48Å; L891-V895 HydrophobicContact CD2-CG2 4.38Å; L891-V895 VanDerWaalsContact O-CB 3.26Å; L891-V895 WeakPolarHBondContact O-CB 3.31Å; L891-V895 WeakPolarHBondContact O-CG2 3.42Å; L891-V895 PolarHBondContact O-N 2.87Å; V895-K897 VanDerWaalsContact C-N 3.34Å; V895-K897 PolarHBondContact O-N 2.79Å; V895-M898 WeakPolarHBondContact O-CB 3.35Å; V895-M898 PolarHBondContact O-N 2.83Å; V895-K899 WeakPolarHBondContact O-CG 3.39Å; V895-K899 PolarHBondContact O-N 3.36Å
896	N	42.1	Very low	39.4	Very low	89 Å²	89	89.2 Å²	89.2	48%	0.476	44%	0.441	S	S	.	.	H	α-helix	trans	-64.6	-37.7	172.6	-74.7	-20	0	0	0	112	N892 Q894 K899 T900	N892-N896 VanDerWaalsContact O-CB 3.23Å; N892-N896 WeakPolarHBondContact O-CB 3.26Å; N892-N896 PolarHBondContact O-N 2.97Å; N892-N896 PolarHBondContact O-ND2 3.34Å; Q894-N896 VanDerWaalsContact C-N 3.32Å; N896-K899 WeakPolarHBondContact O-CB 3.5Å; N896-K899 PolarHBondContact O-N 3.3Å; N896-T900 PolarHBondContact O-N 3.41Å; N896-T900 PolarHBondContact O-OG1 2.68Å
897	K	41.5	Very low	39.3	Very low	93 Å²	93	89.9 Å²	89.9	40%	0.404	45%	0.451	S	S	.	.	H	α-helix	trans	-65.9	-35.3	171.6	-76.5	177.9	178.8	-175.7	0	113.2	F588 G893 Q894 V895 T900 N901	F588-K897 HydrophobicContact CD1-CD 4.29Å; F588-K897 HydrophobicContact CE1-CB 4.36Å; F588-K897 HydrophobicContact CE1-CD 4.21Å; G893-K897 WeakPolarHBondContact O-CG 3.22Å; G893-K897 PolarHBondContact O-N 2.79Å; G893-K897 VanDerWaalsContact O-N 3.14Å; Q894-K897 CarbonylContact O-C 3.59Å; Q894-K897 WeakPolarHBondContact O-CB 3.5Å; Q894-K897 PolarHBondContact O-N 2.91Å; Q894-K897 VanDerWaalsContact O-N 3.15Å; V895-K897 VanDerWaalsContact C-N 3.34Å; V895-K897 PolarHBondContact O-N 2.79Å; K897-T900 WeakPolarHBondContact CA-OG1 3.42Å; K897-T900 PolarHBondContact O-N 2.95Å; K897-T900 PolarHBondContact O-OG1 3.47Å; K897-N901 PolarHBondContact O-N 3.05Å
898	M	36.8	Very low	39.3	Very low	67 Å²	67	90.8 Å²	90.8	33%	0.33	45%	0.451	S	S	.	.	H	α-helix	trans	-66.6	-39.6	173.3	-71.4	-175.6	-152.3	0	0	111.7	Y580 Q894 V895 T900 S902	Y580-M898 HydrophobicContact CD1-CE 3.55Å; Y580-M898 HydrophobicContact CD2-CE 3.86Å; Y580-M898 HydrophobicContact CE1-CE 3.2Å; Y580-M898 HydrophobicContact CE2-CE 3.54Å; Y580-M898 HydrophobicContact CE2-CG 3.86Å; Y580-M898 HydrophobicContact CE2-SD 4.15Å; Y580-M898 HydrophobicContact CG-CE 3.88Å; Q894-M898 WeakPolarHBondContact O-CG 3.38Å; Q894-M898 PolarHBondContact O-N 2.93Å; V895-M898 WeakPolarHBondContact O-CB 3.35Å; V895-M898 PolarHBondContact O-N 2.83Å; M898-T900 VanDerWaalsContact C-N 3.26Å; M898-T900 PolarHBondContact O-N 3.4Å; M898-S902 WeakPolarHBondContact O-CB 3.25Å
899	K	42.1	Very low	39.2	Very low	84 Å²	84	93.3 Å²	93.3	37%	0.365	46%	0.463	S	S	.	.	H	α-helix	trans	-60.4	-34.9	175.3	-76.5	-178.7	177.9	-176.3	0	112.2	F880 V895 N896 F905	F880-K899 VanDerWaalsContact CZ-CE 3.48Å; F880-K899 HydrophobicContact CZ-CG 4.36Å; V895-K899 WeakPolarHBondContact O-CG 3.39Å; V895-K899 PolarHBondContact O-N 3.36Å; N896-K899 WeakPolarHBondContact O-CB 3.5Å; N896-K899 PolarHBondContact O-N 3.3Å; K899-F905 HydrophobicContact CG-CD1 4.44Å; K899-F905 HydrophobicContact CG-CE1 3.95Å; K899-F905 HydrophobicContact CG-CZ 4.09Å
900	T	45.1	Very low	39.1	Very low	105 Å²	105	93.6 Å²	93.6	64%	0.644	46%	0.459	S	S	*	.	H	α-helix	trans	-84.3	-27.8	-175.7	50.4	0	0	0	0	115	N896 K897 M898	N896-T900 PolarHBondContact O-N 3.41Å; N896-T900 PolarHBondContact O-OG1 2.68Å; K897-T900 WeakPolarHBondContact CA-OG1 3.42Å; K897-T900 PolarHBondContact O-N 2.95Å; K897-T900 PolarHBondContact O-OG1 3.47Å; M898-T900 VanDerWaalsContact C-N 3.26Å; M898-T900 PolarHBondContact O-N 3.4Å
901	N	39.5	Very low	38.8	Very low	124 Å²	124	93.4 Å²	93.4	66%	0.663	47%	0.466	S	S	*	.	H	α-helix	trans	-109	6.5	-168.4	-83.1	-0.9	0	0	0	115.7	K897	K897-N901 PolarHBondContact O-N 3.05Å
902	S	37.7	Very low	38.5	Very low	38 Å²	38	94.5 Å²	94.5	27%	0.266	47%	0.474	S	S	.	.			trans	-108.6	109.5	-175.7	170.3	0	0	0	0	110.6	M898 L904 F905	M898-S902 WeakPolarHBondContact O-CB 3.25Å; S902-L904 PolarHBondContact O-N 3.02Å; S902-L904 VanDerWaalsContact O-N 3.13Å; S902-L904 VanDerWaalsContact OG-CB 3.3Å; S902-L904 WeakPolarHBondContact OG-CB 3.49Å; S902-L904 PolarHBondContact OG-N 2.89Å; S902-F905 VanDerWaalsContact O-CB 3.31Å; S902-F905 WeakPolarHBondContact O-CB 3.5Å; S902-F905 PolarHBondContact O-N 2.83Å; S902-F905 PolarHBondContact OG-N 3.25Å
903	R	32.8	Very low	38.3	Very low	231 Å²	231	98 Å²	98	87%	0.872	49%	0.488	S	S	*	.	H	α-helix	trans	-55.5	-22.4	164	-90	-177.6	174.7	169.6	-1	112.1	F905	R903-F905 VanDerWaalsContact C-N 3.27Å; R903-F905 PolarHBondContact O-N 3.34Å
904	L	36.2	Very low	37.9	Very low	147 Å²	147	101.5 Å²	101.5	77%	0.77	50%	0.499	S	S	*	.	H	α-helix	trans	-70.3	-21.1	172.6	-75.6	154.5	0	0	0	112.7	S902	S902-L904 PolarHBondContact O-N 3.02Å; S902-L904 VanDerWaalsContact O-N 3.13Å; S902-L904 VanDerWaalsContact OG-CB 3.3Å; S902-L904 WeakPolarHBondContact OG-CB 3.49Å; S902-L904 PolarHBondContact OG-N 2.89Å
905	F	38.1	Very low	37.3	Very low	55 Å²	55	104.4 Å²	104.4	24%	0.241	51%	0.514	C	S	.	.	H	α-helix	trans	-79.1	-30.2	176	-112.1	-85.7	0	0	0	113.2	F880 K899 S902 R903 N907 Y908	F880-F905 AromaticContact CE2-CZ 3.66Å; F880-F905 HydrophobicContact CE2-CZ 3.66Å; F880-F905 HydrophobicContact CZ-CE1 4.33Å; F880-F905 AromaticContact CZ-CZ 3.76Å; F880-F905 HydrophobicContact CZ-CZ 3.76Å; K899-F905 HydrophobicContact CG-CD1 4.44Å; K899-F905 HydrophobicContact CG-CE1 3.95Å; K899-F905 HydrophobicContact CG-CZ 4.09Å; S902-F905 VanDerWaalsContact O-CB 3.31Å; S902-F905 WeakPolarHBondContact O-CB 3.5Å; S902-F905 PolarHBondContact O-N 2.83Å; S902-F905 PolarHBondContact OG-N 3.25Å; R903-F905 VanDerWaalsContact C-N 3.27Å; R903-F905 PolarHBondContact O-N 3.34Å; F905-N907 PolarHBondContact O-N 2.93Å; F905-Y908 PolarHBondContact O-N 3.37Å
906	Q	34.3	Very low	36.9	Very low	149 Å²	149	108.5 Å²	108.5	70%	0.696	54%	0.535	S	S	*	.	H	α-helix	trans	-68.8	-35	-175.8	-79.3	-170	-28	0	0	113.5	Y908	Q906-Y908 VanDerWaalsContact C-N 3.27Å; Q906-Y908 PolarHBondContact O-N 3.3Å
907	N	35.7	Very low	36.4	Very low	147 Å²	147	108.7 Å²	108.7	79%	0.786	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-14.1	176.5	-89.8	-4.1	0	0	0	114	F905	F905-N907 PolarHBondContact O-N 2.93Å
908	Y	35.8	Very low	35.8	Very low	118 Å²	118	109.7 Å²	109.7	46%	0.463	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-20	-179.6	-108.1	-89.1	0	0	0	113.1	Q873 F905 Q906 Q910 N911 V912	Q873-Y908 PolarHBondContact NE2-OH 3.22Å; F905-Y908 PolarHBondContact O-N 3.37Å; Q906-Y908 VanDerWaalsContact C-N 3.27Å; Q906-Y908 PolarHBondContact O-N 3.3Å; Y908-Q910 VanDerWaalsContact C-N 3.34Å; Y908-Q910 PolarHBondContact O-N 3.1Å; Y908-N911 PolarHBondContact O-N 2.79Å; Y908-V912 WeakPolarHBondContact O-CG2 2.97Å; Y908-V912 PolarHBondContact O-N 3.14Å
909	N	38.9	Very low	35.7	Very low	94 Å²	94	109.7 Å²	109.7	50%	0.503	55%	0.549	S	S	.	.	H	α-helix	trans	-64.7	-28.8	-172.9	-87	-14.8	0	0	0	114.6	N911 V912 E913	N909-N911 VanDerWaalsContact C-N 3.32Å; N909-N911 PolarHBondContact O-N 3.3Å; N909-V912 PolarHBondContact O-N 2.82Å; N909-E913 PolarHBondContact O-N 2.85Å
910	Q	35.5	Very low	35.2	Very low	156 Å²	156	111.4 Å²	111.4	73%	0.729	56%	0.559	S	S	*	*	H	α-helix	trans	-68.1	-31	179.2	-142.9	93.4	21.6	0	0	113	Y908	Y908-Q910 VanDerWaalsContact C-N 3.34Å; Y908-Q910 PolarHBondContact O-N 3.1Å
911	N	34.4	Very low	34.5	Very low	98 Å²	98	112.1 Å²	112.1	52%	0.524	56%	0.559	S	S	.	*	H	α-helix	trans	-87	-23.4	179.6	-74.5	-22	0	0	0	112.3	Y908 N909 L915	Y908-N911 PolarHBondContact O-N 2.79Å; N909-N911 VanDerWaalsContact C-N 3.32Å; N909-N911 PolarHBondContact O-N 3.3Å; N911-L915 WeakPolarHBondContact O-CB 3.09Å; N911-L915 PolarHBondContact O-N 3.01Å
912	V	37.1	Very low	34.1	Very low	58 Å²	58	108.9 Å²	108.9	35%	0.352	55%	0.545	S	S	.	.	H	α-helix	trans	-74.6	-34	179.3	175.8	0	0	0	0	111.5	Y908 N909 L915 L916	Y908-V912 WeakPolarHBondContact O-CG2 2.97Å; Y908-V912 PolarHBondContact O-N 3.14Å; N909-V912 PolarHBondContact O-N 2.82Å; V912-L915 PolarHBondContact O-N 2.88Å; V912-L916 HydrophobicContact CG1-CD1 3.81Å; V912-L916 HydrophobicContact CG1-CG 4.34Å; V912-L916 WeakPolarHBondContact O-CB 3.33Å; V912-L916 WeakPolarHBondContact O-CD1 3.07Å; V912-L916 VanDerWaalsContact O-CG 3.29Å; V912-L916 WeakPolarHBondContact O-CG 3.48Å; V912-L916 PolarHBondContact O-N 3.36Å
913	E	33.1	Very low	33.7	Very low	135 Å²	135	116.1 Å²	116.1	63%	0.631	57%	0.567	S	S	*	*	H	α-helix	trans	-67.2	-41	174.8	-85.6	-167.4	155.9	0	0	113.3	N909 L915 L916 N917	N909-E913 PolarHBondContact O-N 2.85Å; E913-L915 VanDerWaalsContact C-N 3.31Å; E913-L915 PolarHBondContact O-N 3.24Å; E913-L916 PolarHBondContact O-N 2.88Å; E913-N917 PolarHBondContact O-N 3.48Å; E913-N917 VanDerWaalsContact O-N 3.11Å
914	N	35.1	Very low	33.4	Very low	108 Å²	108	111.1 Å²	111.1	58%	0.578	56%	0.557	S	S	*	*	H	α-helix	trans	-67.2	-33.3	174.9	-77.3	-21.9	0	0	0	112.3	L918	N914-L918 PolarHBondContact O-N 3.27Å
915	L	30.6	Very low	33	Very low	87 Å²	87	112.8 Å²	112.8	46%	0.455	55%	0.554	S	S	.	*	H	α-helix	trans	-73.3	-32.3	173.3	-88.4	157.9	0	0	0	112.5	N911 V912 E913 L918 V919	N911-L915 WeakPolarHBondContact O-CB 3.09Å; N911-L915 PolarHBondContact O-N 3.01Å; V912-L915 PolarHBondContact O-N 2.88Å; E913-L915 VanDerWaalsContact C-N 3.31Å; E913-L915 PolarHBondContact O-N 3.24Å; L915-L918 PolarHBondContact O-N 3.33Å; L915-V919 VanDerWaalsContact O-CG2 3.23Å; L915-V919 WeakPolarHBondContact O-CG2 2.93Å; L915-V919 PolarHBondContact O-N 2.91Å
916	L	33.1	Very low	32.5	Very low	95 Å²	95	118.4 Å²	118.4	50%	0.497	58%	0.581	S	S	.	*	H	α-helix	trans	-65.5	-38.5	173.8	-82.3	159.8	0	0	0	111.6	V912 E913 V919 E920	V912-L916 HydrophobicContact CG1-CD1 3.81Å; V912-L916 HydrophobicContact CG1-CG 4.34Å; V912-L916 WeakPolarHBondContact O-CB 3.33Å; V912-L916 WeakPolarHBondContact O-CD1 3.07Å; V912-L916 VanDerWaalsContact O-CG 3.29Å; V912-L916 WeakPolarHBondContact O-CG 3.48Å; V912-L916 PolarHBondContact O-N 3.36Å; E913-L916 PolarHBondContact O-N 2.88Å; L916-V919 PolarHBondContact O-N 3.01Å; L916-E920 PolarHBondContact O-N 3.08Å
917	N	31.2	Very low	32.2	Very low	93 Å²	93	115.9 Å²	115.9	50%	0.497	58%	0.576	S	S	.	*	H	α-helix	trans	-68.1	-31.6	172.7	-80.1	-20.4	0	0	0	113.4	E913 N921	E913-N917 PolarHBondContact O-N 3.48Å; E913-N917 VanDerWaalsContact O-N 3.11Å; N917-N921 PolarHBondContact O-N 3.33Å; N917-N921 PolarHBondContact O-ND2 2.81Å
918	L	29.7	Very low	31.8	Very low	114 Å²	114	113.7 Å²	113.7	60%	0.597	57%	0.568	S	S	*	*	H	α-helix	trans	-71.7	-35.5	172.1	-87	156	0	0	0	112.1	N914 L915 N921 S922	N914-L918 PolarHBondContact O-N 3.27Å; L915-L918 PolarHBondContact O-N 3.33Å; L918-N921 PolarHBondContact O-N 3.44Å; L918-S922 WeakPolarHBondContact O-CB 3.36Å; L918-S922 PolarHBondContact O-N 2.97Å
919	V	33.6	Very low	31.3	Very low	67 Å²	67	115.3 Å²	115.3	41%	0.406	58%	0.58	S	S	.	*	H	α-helix	trans	-70.4	-35.6	176.1	172.6	0	0	0	0	111.1	L915 L916 S922 R923	L915-V919 VanDerWaalsContact O-CG2 3.23Å; L915-V919 WeakPolarHBondContact O-CG2 2.93Å; L915-V919 PolarHBondContact O-N 2.91Å; L916-V919 PolarHBondContact O-N 3.01Å; V919-S922 WeakPolarHBondContact CA-OG 3.31Å; V919-S922 PolarHBondContact O-N 2.99Å; V919-S922 PolarHBondContact O-OG 3.35Å; V919-R923 PolarHBondContact O-N 3.2Å
920	E	30.9	Very low	30.7	Very low	120 Å²	120	114.4 Å²	114.4	56%	0.561	58%	0.581	S	S	*	*	H	α-helix	trans	-67.8	-34.4	173.3	-76.2	-171.6	160	0	0	113.1	L916 R923	L916-E920 PolarHBondContact O-N 3.08Å; E920-R923 WeakPolarHBondContact O-CB 2.8Å
921	N	30.2	Very low	30.2	Very low	121 Å²	121	111.5 Å²	111.5	65%	0.647	58%	0.584	S	S	*	*	H	α-helix	trans	-77.6	-25	172.3	-75.5	-39.2	0	0	0	113.4	N917 L918 R923 L924	N917-N921 PolarHBondContact O-N 3.33Å; N917-N921 PolarHBondContact O-ND2 2.81Å; L918-N921 PolarHBondContact O-N 3.44Å; N921-R923 PolarHBondContact O-N 3.13Å; N921-L924 PolarHBondContact O-N 3.39Å
922	S	31.3	Very low	29.8	Very low	55 Å²	55	113.4 Å²	113.4	39%	0.385	59%	0.592	S	S	.	*	G	3₁₀ helix	trans	-73.2	-7.4	174.5	76.2	0	0	0	0	113.9	L918 V919 L924 Y925	L918-S922 WeakPolarHBondContact O-CB 3.36Å; L918-S922 PolarHBondContact O-N 2.97Å; V919-S922 WeakPolarHBondContact CA-OG 3.31Å; V919-S922 PolarHBondContact O-N 2.99Å; V919-S922 PolarHBondContact O-OG 3.35Å; S922-L924 PolarHBondContact O-N 2.63Å; S922-L924 VanDerWaalsContact O-N 3.13Å; S922-Y925 WeakPolarHBondContact O-CB 3.37Å; S922-Y925 PolarHBondContact O-N 2.77Å
923	R	30.5	Very low	29	Very low	190 Å²	190	114 Å²	114	72%	0.717	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-62.4	-11.6	168.1	-81.5	-177.7	167	166.8	-0.9	113.6	V919 E920 N921	V919-R923 PolarHBondContact O-N 3.2Å; E920-R923 WeakPolarHBondContact O-CB 2.8Å; N921-R923 PolarHBondContact O-N 3.13Å
924	L	26.7	Very low	28.7	Very low	127 Å²	127	109.9 Å²	109.9	67%	0.665	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-82.4	-18.4	168.1	-96.4	105.8	0	0	0	114.4	N921 S922 E926 T927	N921-L924 PolarHBondContact O-N 3.39Å; S922-L924 PolarHBondContact O-N 2.63Å; S922-L924 VanDerWaalsContact O-N 3.13Å; L924-E926 PolarHBondContact O-N 3.07Å; L924-T927 PolarHBondContact O-N 2.74Å; L924-T927 PolarHBondContact O-OG1 3.1Å
925	Y	27.4	Very low	28.2	Very low	181 Å²	181	109 Å²	109	71%	0.71	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-9.4	-178.9	-105.9	-88.6	0	0	0	114	S922 T927	S922-Y925 WeakPolarHBondContact O-CB 3.37Å; S922-Y925 PolarHBondContact O-N 2.77Å; Y925-T927 VanDerWaalsContact C-N 3.26Å; Y925-T927 PolarHBondContact O-N 3.19Å
926	E	27.7	Very low	28	Very low	173 Å²	173	109.3 Å²	109.3	81%	0.808	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-1.6	172.8	-71.1	-174.6	154.3	0	0	113.3	L924	L924-E926 PolarHBondContact O-N 3.07Å
927	T	28.7	Very low	27.5	Very low	97 Å²	97	114 Å²	114	60%	0.595	60%	0.602	S	S	*	*	S	Bend	trans	-111.4	-0.1	-177.8	54.2	0	0	0	0	116.1	L924 Y925	L924-T927 PolarHBondContact O-N 2.74Å; L924-T927 PolarHBondContact O-OG1 3.1Å; Y925-T927 VanDerWaalsContact C-N 3.26Å; Y925-T927 PolarHBondContact O-N 3.19Å
928	T	25.4	Very low	27.2	Very low	100 Å²	100	115.5 Å²	115.5	61%	0.613	62%	0.619	S	S	*	*	S	Bend	trans	-109.3	0.4	175.5	44	0	0	0	0	114.6	S930	T928-S930 VanDerWaalsContact C-N 3.29Å; T928-S930 PolarHBondContact O-N 2.69Å
929	H	26.3	Very low	26.9	Very low	152 Å²	152	113.2 Å²	113.2	70%	0.704	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	26.7	171	-100.8	-52.6	0	0	0	114.8
930	S	25.3	Very low	26.5	Very low	75 Å²	75	116.3 Å²	116.3	52%	0.524	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.9	14.4	174.3	63.6	0	0	0	0	115.7	T928	T928-S930 VanDerWaalsContact C-N 3.29Å; T928-S930 PolarHBondContact O-N 2.69Å
931	A	25.7	Very low	26.1	Very low	96 Å²	96	118.5 Å²	118.5	79%	0.793	65%	0.646	S	S	*	*	S	Bend	trans	-117.3	-3	170.5	0	0	0	0	0	114.4
932	I	25.2	Very low	25.8	Very low	137 Å²	137	116.6 Å²	116.6	70%	0.703	64%	0.642	S	S	*	*	S	Bend	trans	-122.6	91.1	165.4	-64	176.6	0	0	0	106.8
933	S	21	Very low	25.5	Very low	72 Å²	72	121.6 Å²	121.6	50%	0.503	66%	0.659	S	S	.	*	S	Bend	trans	45.7	109.7	166.2	62.4	0	0	0	0	119.8
934	N	26.9	Very low	25.2	Very low	48 Å²	48	119.1 Å²	119.1	26%	0.257	66%	0.659	S	S	.	*			trans	94.2	35.3	144.2	-58.2	-5.7	0	0	0	119.1	Y486	Y486-N934 HydrophobicContact CD1-CB 3.51Å; Y486-N934 HydrophobicContact CE1-CB 3.67Å; Y486-N934 WeakPolarHBondContact CE1-O 2.92Å; Y486-N934 HydrophobicContact CG-CB 4.4Å; Y486-N934 VanDerWaalsContact CZ-O 3.28Å; Y486-N934 PolarHBondContact OH-O 2.9Å
935	V	23.8	Very low	25.1	Very low	89 Å²	89	116.5 Å²	116.5	54%	0.539	65%	0.65	S	S	.	*				22.1	114.1	128.3	-171.6	0	0	0	0	118.2
936	S	26.7	Very low	24.9	Very low	94 Å²	94	112.7 Å²	112.7	66%	0.657	64%	0.641	S	S	*	*			trans	63.5	96.5	149.3	67.1	0	0	0	0	117.5
937	Y	23.7	Very low	24.8	Very low	194 Å²	194	112.3 Å²	112.3	76%	0.761	63%	0.634	S	S	*	*				51.2	82.8	61.8	-79.7	-85	0	0	0	115.3	F941	Y937-F941 HydrophobicContact CE1-CE2 4.5Å
938	S	23.6	Very low	24.8	Very low	123 Å²	123	116.2 Å²	116.2	86%	0.86	64%	0.642	S	S	*	*			trans	-155.9	108.5	154.6	61.5	0	0	0	0	108
939	G	24.8	Very low	24.8	Very low	66 Å²	66	118 Å²	118	68%	0.68	64%	0.644	S	S	*	*			trans	173.8	95.5	179.4	0	0	0	0	0	114.6	F941	G939-F941 PolarHBondContact O-N 3.02Å
940	N	24	Very low	24.8	Very low	133 Å²	133	115 Å²	115	71%	0.711	64%	0.64	S	S	*	*			trans	6.3	95.3	162	-85.8	-24	0	0	0	117.6	S942	N940-S942 PolarHBondContact O-N 3.44Å
941	F	22.9	Very low	24.9	Very low	166 Å²	166	116.7 Å²	116.7	73%	0.728	64%	0.643	S	S	*	*	S	Bend	trans	-76.4	60.5	167.7	-93.8	-90.9	0	0	0	112	K886 Y937 G939	K886-F941 PolarHBondContact NZ-O 3.12Å; Y937-F941 HydrophobicContact CE1-CE2 4.5Å; G939-F941 PolarHBondContact O-N 3.02Å
942	S	23.7	Very low	25.2	Very low	80 Å²	80	117.7 Å²	117.7	56%	0.559	63%	0.634	S	S	*	*			trans	-159	46.9	179.1	61.6	0	0	0	0	114.3	N940	N940-S942 PolarHBondContact O-N 3.44Å
943	Q	25.5	Very low	25.6	Very low	160 Å²	160	117.9 Å²	117.9	75%	0.748	64%	0.636	S	S	*	*			trans	-144.6	80.9	174.1	-69.4	-172.9	-6.9	0	0	112.7
944	L	24.3	Very low	25.9	Very low	138 Å²	138	119.7 Å²	119.7	72%	0.723	65%	0.646	S	S	*	*	S	Bend	trans	-123.5	121.6	154.4	-90.6	157.4	0	0	0	105.8	L946	L944-L946 PolarHBondContact O-N 3.45Å
945	P	23.9	Very low	25.8	Very low	73 Å²	73	124.9 Å²	124.9	47%	0.474	67%	0.674	S	S	.	*	S	Bend	trans	-74.3	97.2	-168.3	28.9	-31.3	0	0	0	110.7
946	L	24	Very low	26.2	Very low	101 Å²	101	126.7 Å²	126.7	53%	0.529	69%	0.691	S	S	.	*			trans	-127.8	59.9	154.1	-85.6	171.1	0	0	0	107.5	L944	L944-L946 PolarHBondContact O-N 3.45Å
947	Y	26.2	Very low	26.1	Very low	165 Å²	165	127.4 Å²	127.4	65%	0.647	69%	0.687	S	S	*	*			trans	-135.4	131.5	178	-75.1	-77.1	0	0	0	113.4	E887 E949	E887-Y947 WeakPolarHBondContact CG-OH 3.37Å; E887-Y947 WeakPolarHBondContact OE1-CE2 3.33Å; E887-Y947 VanDerWaalsContact OE1-CZ 3.25Å; E887-Y947 PolarHBondContact OE1-OH 3.27Å; Y947-E949 PolarHBondContact O-N 2.71Å
948	K	26.9	Very low	26.2	Very low	178 Å²	178	126.4 Å²	126.4	77%	0.774	69%	0.693	S	S	*	*			trans	-52.6	124	177.1	-68.8	174.3	171.3	-179.7	0	110.1	S950	K948-S950 PolarHBondContact O-N 2.96Å
949	E	26	Very low	26.2	Very low	139 Å²	139	126 Å²	126	65%	0.65	68%	0.68	S	S	*	*			trans	-72.9	101	166.3	-92.7	169.9	165.2	0	0	109.5	R644 Y947	R644-E949 IonicContact CZ-OE1 2.6Å; R644-E949 IonicContact NE-OE1 2.85Å; R644-E949 IonicContact NH2-OE1 3.68Å; R644-E949 PolarHBondContact NH2-OE1 3.47Å; R644-E949 IonicContact NH2-OE2 2.94Å; R644-E949 PolarHBondContact NH2-OE2 2.94Å; Y947-E949 PolarHBondContact O-N 2.71Å
950	S	26	Very low	26.3	Very low	89 Å²	89	131.1 Å²	131.1	62%	0.622	69%	0.69	S	S	*	*			trans	-164.3	128.4	147.1	1.9	0	0	0	0	105.1	K948	K948-S950 PolarHBondContact O-N 2.96Å
951	D	28.3	Very low	26.2	Very low	109 Å²	109	133.1 Å²	133.1	58%	0.583	70%	0.695	S	S	*	*			trans	99.9	99.6	166.1	-47.7	-23.6	0	0	0	116.2
952	I	32.2	Very low	26.3	Very low	118 Å²	118	131.1 Å²	131.1	61%	0.605	70%	0.696	S	S	*	*			trans	117.4	97	130.7	-59.3	151.4	0	0	0	117.9	T1035 L1038	I952-T1035 HydrophobicContact CD1-CG2 4.17Å; I952-L1038 HydrophobicContact CD1-CD1 4.37Å
953	D	33.5	Very low	26.5	Very low	141 Å²	141	133.2 Å²	133.2	75%	0.754	71%	0.708	S	S	*	*				66.8	111	127.5	-140.1	0.5	0	0	0	121.5
954	P	26.2	Very low	26.5	Very low	110 Å²	110	135.4 Å²	135.4	71%	0.714	72%	0.715	S	S	*	*			trans	-101.1	88.6	176.2	36.4	-25	0	0	0	111
955	N	26.6	Very low	26.7	Very low	156 Å²	156	136.8 Å²	136.8	83%	0.834	72%	0.718	S	S	*	*			trans	-171.8	97.6	161	-90.3	-33.7	0	0	0	113
956	S	30.4	Very low	27	Very low	127 Å²	127	139.3 Å²	139.3	89%	0.888	73%	0.728	S	S	*	*			trans	-174.4	107.1	145.6	38.2	0	0	0	0	112.1
957	N	24.9	Very low	27.2	Very low	109 Å²	109	141.7 Å²	141.7	58%	0.583	74%	0.741	S	S	*	*			trans	-103.9	140.1	168.1	-82.8	-27.6	0	0	0	109.3
958	I	27.3	Very low	27.2	Very low	173 Å²	173	143.3 Å²	143.3	89%	0.887	75%	0.751	S	S	*	*			trans	-140	130.8	155.5	-60	-176.9	0	0	0	109.2
959	I	22.7	Very low	27.1	Very low	114 Å²	114	141.8 Å²	141.8	59%	0.585	75%	0.751	S	S	*	*			trans	-110.3	147	-171.7	-65.1	161.6	0	0	0	109.4	E961	I959-E961 HydrophobicContact CG2-CG 4.38Å
960	I	26.6	Very low	27	Very low	175 Å²	175	141.9 Å²	141.9	90%	0.897	76%	0.755	S	S	*	*			trans	-147.3	142	149.8	-55.3	-175	0	0	0	111
961	E	22.5	Very low	26.8	Very low	174 Å²	174	142 Å²	142	81%	0.813	75%	0.747	S	S	*	*			trans	-98.4	175.6	-156.8	-71.7	174.1	141.2	0	0	119.3	I959	I959-E961 HydrophobicContact CG2-CG 4.38Å
962	V	24.4	Very low	26.7	Very low	124 Å²	124	142.8 Å²	142.8	75%	0.752	75%	0.747	S	S	*	*			trans	-54.9	178.3	179.7	-130.2	0	0	0	0	117.8
963	P	27.5	Very low	26.4	Very low	124 Å²	124	140.7 Å²	140.7	81%	0.805	74%	0.742	S	S	*	*				-149.3	172.3	52.7	34.8	-9	0	0	0	119.2
964	F	25.6	Very low	25.9	Very low	206 Å²	206	140.8 Å²	140.8	90%	0.904	74%	0.743	S	S	*	*			trans	-138	153	175	-104.5	-81.6	0	0	0	111.6
965	E	28.8	Very low	26	Very low	168 Å²	168	142.4 Å²	142.4	79%	0.785	75%	0.745	S	S	*	*			trans	-149.9	138.3	169	-107.7	-168.9	-166.8	0	0	116.7
966	N	29.7	Very low	25.8	Very low	126 Å²	126	139 Å²	139	67%	0.674	73%	0.733	S	S	*	*			trans	96.3	90.8	140.5	-61	-22.3	0	0	0	126.5
967	N	28.5	Very low	25.6	Very low	150 Å²	150	139.5 Å²	139.5	80%	0.802	73%	0.726	S	S	*	*				22.1	132.8	125.7	-68	-26	0	0	0	126.1
968	K	27.5	Very low	25.6	Very low	200 Å²	200	143.5 Å²	143.5	87%	0.87	74%	0.738	S	S	*	*				168.7	123.4	109.9	-101.6	-179.5	176	175.3	0	117.7
969	L	23.6	Very low	25.5	Very low	145 Å²	145	139 Å²	139	76%	0.759	72%	0.722	S	S	*	*			trans	6.8	138.2	143.3	-83	139.3	0	0	0	126.1
970	L	25.1	Very low	25.7	Very low	141 Å²	141	142.3 Å²	142.3	74%	0.738	74%	0.735	S	S	*	*				170.6	162.3	112.6	-98.7	153.5	0	0	0	115.8
971	M	21.9	Very low	25.7	Very low	92 Å²	92	138.1 Å²	138.1	45%	0.453	72%	0.721	S	S	.	*			trans	-94.4	-179.4	-155.2	-59.7	-172.2	-177.9	0	0	119.1	Q496 Q498	Q496-M971 VanDerWaalsContact CD-C 3.46Å; Q498-M971 PolarHBondContact NE2-SD 3.34Å
972	H	25.7	Very low	25.9	Very low	126 Å²	126	136.2 Å²	136.2	58%	0.583	72%	0.715	S	S	*	*			trans	102.9	94.2	147.8	-80.4	-65.3	0	0	0	125.6	Q496	Q496-H972 VanDerWaalsContact CD-CA 3.44Å; Q496-H972 VanDerWaalsContact NE2-CA 3.28Å; Q496-H972 PolarHBondContact NE2-O 3.25Å; Q496-H972 VanDerWaalsContact OE1-CA 3.26Å
973	S	24.6	Very low	26	Very low	73 Å²	73	136.6 Å²	136.6	51%	0.51	71%	0.713	S	S	.	*				65	135.2	124.4	65.3	0	0	0	0	122.6
974	N	24.9	Very low	26.1	Very low	143 Å²	143	137.4 Å²	137.4	77%	0.765	71%	0.711	S	S	*	*				105.3	133.8	125	-86.8	-5.1	0	0	0	121.9
975	L	27.4	Very low	26.3	Very low	144 Å²	144	135.5 Å²	135.5	75%	0.754	71%	0.705	S	S	*	*			trans	88	95.9	141.1	-70.2	154.4	0	0	0	120.1
976	S	23.1	Very low	26.2	Very low	84 Å²	84	133.2 Å²	133.2	59%	0.587	70%	0.702	S	S	*	*				28.5	138	118	69.6	0	0	0	0	121.6
977	N	24.6	Very low	26	Very low	138 Å²	138	133.8 Å²	133.8	74%	0.738	71%	0.706	S	S	*	*			trans	113.3	130.7	132	-76.9	-22.9	0	0	0	117.7
978	K	26.3	Very low	26.3	Very low	194 Å²	194	134.3 Å²	134.3	84%	0.843	71%	0.707	S	S	*	*			trans	72	141.5	151.5	-73.1	174.3	178.5	-177.1	0	114.4
979	S	25.8	Very low	26.3	Very low	79 Å²	79	132.1 Å²	132.1	55%	0.552	70%	0.699	S	S	*	*			cis	170.3	148.8	7.4	40.6	0	0	0	0	105.1
980	Q	26.2	Very low	26.4	Very low	182 Å²	182	130.7 Å²	130.7	85%	0.85	69%	0.691	S	S	*	*			trans	63.1	147.9	146.4	-74.1	161.1	-40	0	0	115.9
981	S	25.7	Very low	26.4	Very low	87 Å²	87	132.2 Å²	132.2	61%	0.608	70%	0.695	S	S	*	*			cis	171.4	153	5.9	47.3	0	0	0	0	105.1
982	I	27.5	Very low	26.6	Very low	134 Å²	134	132.5 Å²	132.5	69%	0.687	71%	0.706	S	S	*	*			trans	71.8	102.4	144.5	-63.3	157.9	0	0	0	114.3
983	D	26.3	Very low	26.5	Very low	133 Å²	133	135.8 Å²	135.8	71%	0.711	72%	0.715	S	S	*	*				71.2	119.8	98	-54.6	-36	0	0	0	111.9
984	D	30.3	Very low	26.6	Very low	140 Å²	140	136.8 Å²	136.8	75%	0.749	72%	0.721	S	S	*	*				175	130.3	123.4	-84.1	-21.7	0	0	0	112.4
985	E	29.6	Very low	26.7	Very low	167 Å²	167	138 Å²	138	78%	0.78	72%	0.722	S	S	*	*			trans	59.4	98.5	140.5	-64.5	-178.6	147.2	0	0	118.7
986	T	25.8	Very low	26.7	Very low	120 Å²	120	136.2 Å²	136.2	74%	0.736	72%	0.722	S	S	*	*				33.5	139.9	83.4	56.2	0	0	0	0	118
987	N	26.9	Very low	27	Very low	138 Å²	138	137.8 Å²	137.8	74%	0.738	72%	0.723	S	S	*	*			trans	86.1	105.6	162	-59.2	-28.6	0	0	0	117.9
988	I	33.1	Very low	27.1	Very low	161 Å²	161	141.5 Å²	141.5	83%	0.826	73%	0.727	S	S	*	*				-179.2	91	115.5	-82.7	151	0	0	0	103.7
989	E	28.2	Very low	27.3	Very low	153 Å²	153	139.1 Å²	139.1	72%	0.715	73%	0.729	S	S	*	*				47.1	101.8	95.8	-81.6	-163.2	148.1	0	0	112.4
990	I	25.7	Very low	27.6	Very low	115 Å²	115	141.3 Å²	141.3	59%	0.59	74%	0.744	S	S	*	*				90.2	129	101.9	-75.6	171.7	0	0	0	111.4
991	Q	25.4	Very low	27.9	Very low	173 Å²	173	135.6 Å²	135.6	81%	0.808	73%	0.734	S	S	*	*			trans	59.1	105.1	158.5	-71.6	158.8	1.7	0	0	114.8
992	S	24.9	Very low	28.1	Very low	99 Å²	99	140.2 Å²	140.2	69%	0.692	75%	0.745	S	S	*	*				152.3	171.6	65.9	51.6	0	0	0	0	107
993	Y	25.3	Very low	28.4	Very low	195 Å²	195	141.1 Å²	141.1	77%	0.765	75%	0.751	S	S	*	*			trans	76.8	86.7	161.6	-90	-95.5	0	0	0	117.1
994	S	26.2	Very low	28.7	Very low	93 Å²	93	140.6 Å²	140.6	65%	0.65	76%	0.758	S	S	*	*				-17.2	139.3	121.3	52.2	0	0	0	0	114.5
995	Q	26.1	Very low	29.1	Very low	169 Å²	169	141.6 Å²	141.6	79%	0.79	75%	0.752	S	S	*	*			trans	91	64.9	168.9	-58	170.5	-49	0	0	117.6
996	S	28.9	Very low	30	Very low	106 Å²	106	136.7 Å²	136.7	74%	0.741	74%	0.736	S	S	*	*			trans	-140	93.8	134.9	64.2	0	0	0	0	108.7
997	L	27.4	Very low	31.2	Very low	117 Å²	117	140.3 Å²	140.3	61%	0.613	74%	0.738	S	S	*	*				65	97.2	89	-67.3	160.6	0	0	0	108.7
998	R	27.9	Very low	33.1	Very low	216 Å²	216	137.1 Å²	137.1	82%	0.815	73%	0.726	S	S	*	*				88.5	146.3	88.4	-86.4	-176.9	-164	162.4	1.6	110
999	T	31	Very low	34.6	Very low	144 Å²	144	131.9 Å²	131.9	88%	0.883	70%	0.702	S	S	*	*			trans	81.7	116.9	-178.5	77.3	0	0	0	0	110.8
1000	S	31.8	Very low	36.3	Very low	125 Å²	125	128.9 Å²	128.9	87%	0.874	69%	0.69	S	S	*	*			cis	-161.8	153.3	23.6	50.3	0	0	0	0	107.2
1001	G	31.1	Very low	38.6	Very low	62 Å²	62	127.5 Å²	127.5	64%	0.639	68%	0.683	S	S	*	*			cis	-174.1	148.1	-1.9	0	0	0	0	0	109.1
1002	H	30.5	Very low	40.9	Very low	184 Å²	184	127.4 Å²	127.4	85%	0.852	68%	0.676	S	S	*	*			trans	63.3	99.5	152.9	-60.9	-78.9	0	0	0	121.1
1003	L	33.3	Very low	43.2	Very low	154 Å²	154	127.5 Å²	127.5	81%	0.806	67%	0.667	S	S	*	*				-164.7	96.4	124.9	-101.4	139.4	0	0	0	108.6	Y1005	L1003-Y1005 PolarHBondContact O-N 3.33Å
1004	S	32.5	Very low	45.6	Very low	121 Å²	121	123.3 Å²	123.3	85%	0.846	66%	0.657	S	S	*	*			trans	-79.9	103.1	179.2	54.7	0	0	0	0	110.7
1005	Y	40.5	Very low	48	Very low	161 Å²	161	123.3 Å²	123.3	63%	0.631	65%	0.649	S	S	*	*			trans	-85.5	128	156.9	-78	-83.9	0	0	0	108.2	L1003	L1003-Y1005 PolarHBondContact O-N 3.33Å
1006	S	46.5	Very low	50.5	Low	64 Å²	64	118.4 Å²	118.4	45%	0.448	63%	0.631	S	S	.	*			trans	-65.5	148	177.1	78.9	0	0	0	0	109.8	S1008 T1009 L1010	S1006-S1008 PolarHBondContact O-N 3.16Å; S1006-S1008 WeakPolarHBondContact OG-CB 3.45Å; S1006-T1009 PolarHBondContact N-OG1 3.33Å; S1006-T1009 VanDerWaalsContact N-OG1 3.09Å; S1006-T1009 WeakPolarHBondContact O-CA 3.45Å; S1006-T1009 PolarHBondContact O-N 3.16Å; S1006-T1009 PolarHBondContact O-OG1 2.94Å; S1006-T1009 PolarHBondContact OG-N 3.36Å; S1006-L1010 PolarHBondContact O-N 2.8Å
1007	Y	51.2	Low	52.7	Low	196 Å²	196	115.3 Å²	115.3	77%	0.769	62%	0.616	S	S	*	*	H	α-helix	trans	-52.1	-32.2	175.1	-124.2	-92.4	0	0	0	112	L1010 I1011	Y1007-L1010 PolarHBondContact O-N 3.06Å; Y1007-I1011 HydrophobicContact CD1-CD1 4.1Å; Y1007-I1011 WeakPolarHBondContact O-CB 3.36Å; Y1007-I1011 VanDerWaalsContact O-CG1 3.28Å; Y1007-I1011 WeakPolarHBondContact O-CG1 3.48Å; Y1007-I1011 PolarHBondContact O-N 3.01Å
1008	S	67.6	Low	55.1	Low	71 Å²	71	112.6 Å²	112.6	50%	0.497	61%	0.606	S	S	.	*	H	α-helix	trans	-59.5	-44.8	171.5	165.5	0	0	0	0	112.7	S1006 I1011 W1012	S1006-S1008 PolarHBondContact O-N 3.16Å; S1006-S1008 WeakPolarHBondContact OG-CB 3.45Å; S1008-I1011 PolarHBondContact O-N 3.37Å; S1008-W1012 WeakPolarHBondContact O-CB 3.44Å; S1008-W1012 PolarHBondContact O-N 3.36Å
1009	T	64.6	Low	57.7	Low	52 Å²	52	106.8 Å²	106.8	32%	0.319	59%	0.591	S	S	.	*	H	α-helix	trans	-68	-37.5	178.7	50.9	0	0	0	0	112.8	S1006 W1012 I1013	S1006-T1009 PolarHBondContact N-OG1 3.33Å; S1006-T1009 VanDerWaalsContact N-OG1 3.09Å; S1006-T1009 WeakPolarHBondContact O-CA 3.45Å; S1006-T1009 PolarHBondContact O-N 3.16Å; S1006-T1009 PolarHBondContact O-OG1 2.94Å; S1006-T1009 PolarHBondContact OG-N 3.36Å; T1009-W1012 PolarHBondContact O-N 2.84Å; T1009-I1013 WeakPolarHBondContact O-CD1 3.36Å; T1009-I1013 WeakPolarHBondContact O-CG1 3.32Å; T1009-I1013 PolarHBondContact O-N 2.98Å
1010	L	64.1	Low	60	Low	89 Å²	89	105.5 Å²	105.5	47%	0.466	58%	0.578	S	S	.	*	H	α-helix	trans	-66.3	-41.5	174.7	-102.9	153.9	0	0	0	112	S1006 Y1007 I1013 I1014	S1006-L1010 PolarHBondContact O-N 2.8Å; Y1007-L1010 PolarHBondContact O-N 3.06Å; L1010-I1013 PolarHBondContact O-N 3.3Å; L1010-I1014 VanDerWaalsContact O-CG1 3.29Å; L1010-I1014 WeakPolarHBondContact O-CG1 3.5Å; L1010-I1014 PolarHBondContact O-N 2.99Å
1011	I	73.4	Confident	62.1	Low	86 Å²	86	106.5 Å²	106.5	44%	0.441	57%	0.566	S	S	.	*	H	α-helix	trans	-63.4	-42.4	174.5	-71	167.4	0	0	0	110.7	Y1007 S1008 I1014 L1015	Y1007-I1011 HydrophobicContact CD1-CD1 4.1Å; Y1007-I1011 WeakPolarHBondContact O-CB 3.36Å; Y1007-I1011 VanDerWaalsContact O-CG1 3.28Å; Y1007-I1011 WeakPolarHBondContact O-CG1 3.48Å; Y1007-I1011 PolarHBondContact O-N 3.01Å; S1008-I1011 PolarHBondContact O-N 3.37Å; I1011-I1014 PolarHBondContact O-N 2.91Å; I1011-L1015 HydrophobicContact CG2-CD1 3.66Å; I1011-L1015 VanDerWaalsContact O-CB 3.32Å; I1011-L1015 WeakPolarHBondContact O-CB 3.35Å; I1011-L1015 PolarHBondContact O-N 3.28Å
1012	W	74	Confident	64.4	Low	172 Å²	172	108.7 Å²	108.7	65%	0.652	56%	0.563	S	S	*	*	H	α-helix	trans	-64.5	-38.8	175.1	-95.5	95	0	0	0	113	S1008 T1009 T1016	S1008-W1012 WeakPolarHBondContact O-CB 3.44Å; S1008-W1012 PolarHBondContact O-N 3.36Å; T1009-W1012 PolarHBondContact O-N 2.84Å; W1012-T1016 HydrophobicContact CE3-CG2 3.8Å; W1012-T1016 HydrophobicContact CZ3-CG2 4.19Å; W1012-T1016 VanDerWaalsContact O-CB 3.3Å; W1012-T1016 WeakPolarHBondContact O-CB 3.42Å; W1012-T1016 WeakPolarHBondContact O-CG2 3.33Å; W1012-T1016 PolarHBondContact O-N 2.79Å; W1012-T1016 PolarHBondContact O-OG1 3.24Å
1013	I	73	Confident	66.9	Low	100 Å²	100	104.6 Å²	104.6	51%	0.513	55%	0.547	S	S	.	.	H	α-helix	trans	-66.2	-41.7	175.8	-69	163.4	0	0	0	110.7	T1009 L1010 T1016 G1017	T1009-I1013 WeakPolarHBondContact O-CD1 3.36Å; T1009-I1013 WeakPolarHBondContact O-CG1 3.32Å; T1009-I1013 PolarHBondContact O-N 2.98Å; L1010-I1013 PolarHBondContact O-N 3.3Å; I1013-T1016 WeakPolarHBondContact CA-OG1 3.39Å; I1013-T1016 PolarHBondContact O-OG1 3.43Å; I1013-G1017 PolarHBondContact O-N 3.35Å
1014	I	75.9	Confident	68.9	Low	108 Å²	108	101.9 Å²	101.9	55%	0.554	53%	0.533	S	S	*	.	H	α-helix	trans	-69.2	-43.3	178.5	-65.9	166.6	0	0	0	110.7	L1010 I1011 G1017 S1018	L1010-I1014 VanDerWaalsContact O-CG1 3.29Å; L1010-I1014 WeakPolarHBondContact O-CG1 3.5Å; L1010-I1014 PolarHBondContact O-N 2.99Å; I1011-I1014 PolarHBondContact O-N 2.91Å; I1014-G1017 PolarHBondContact O-N 3.39Å; I1014-S1018 WeakPolarHBondContact O-CB 3.49Å; I1014-S1018 PolarHBondContact O-N 2.73Å; I1014-S1018 PolarHBondContact O-OG 3.36Å
1015	L	77	Confident	71.1	Confident	92 Å²	92	98.7 Å²	98.7	48%	0.482	51%	0.509	S	S	.	.	H	α-helix	trans	-64.2	-46.4	177.1	-89.7	158.5	0	0	0	111.9	I1011 S1018 I1019	I1011-L1015 HydrophobicContact CG2-CD1 3.66Å; I1011-L1015 VanDerWaalsContact O-CB 3.32Å; I1011-L1015 WeakPolarHBondContact O-CB 3.35Å; I1011-L1015 PolarHBondContact O-N 3.28Å; L1015-S1018 PolarHBondContact O-N 3.45Å; L1015-I1019 WeakPolarHBondContact O-CB 3.33Å; L1015-I1019 VanDerWaalsContact O-CG1 3.25Å; L1015-I1019 WeakPolarHBondContact O-CG1 3.49Å; L1015-I1019 PolarHBondContact O-N 2.82Å
1016	T	78.8	Confident	73.1	Confident	66 Å²	66	96.5 Å²	96.5	41%	0.405	51%	0.507	S	S	.	.	H	α-helix	trans	-65.3	-40.1	177.9	53.1	0	0	0	0	111.5	W1012 I1013 S1018 I1019 L1020	W1012-T1016 HydrophobicContact CE3-CG2 3.8Å; W1012-T1016 HydrophobicContact CZ3-CG2 4.19Å; W1012-T1016 VanDerWaalsContact O-CB 3.3Å; W1012-T1016 WeakPolarHBondContact O-CB 3.42Å; W1012-T1016 WeakPolarHBondContact O-CG2 3.33Å; W1012-T1016 PolarHBondContact O-N 2.79Å; W1012-T1016 PolarHBondContact O-OG1 3.24Å; I1013-T1016 WeakPolarHBondContact CA-OG1 3.39Å; I1013-T1016 PolarHBondContact O-OG1 3.43Å; T1016-S1018 PolarHBondContact O-N 2.88Å; T1016-I1019 PolarHBondContact O-N 3.39Å; T1016-L1020 WeakPolarHBondContact O-CB 3.35Å; T1016-L1020 PolarHBondContact O-N 2.76Å
1017	G	74.7	Confident	74.8	Confident	41 Å²	41	97.4 Å²	97.4	42%	0.423	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-40.3	173.9	0	0	0	0	0	113.4	I1013 I1014 F1021	I1013-G1017 PolarHBondContact O-N 3.35Å; I1014-G1017 PolarHBondContact O-N 3.39Å; G1017-F1021 WeakPolarHBondContact O-CB 3.44Å; G1017-F1021 PolarHBondContact O-N 3.16Å
1018	S	78.5	Confident	75.8	Confident	60 Å²	60	94.7 Å²	94.7	42%	0.42	50%	0.499	S	S	.	.	H	α-helix	trans	-68.2	-42.8	178.2	-53.4	0	0	0	0	112	I1014 L1015 T1016 F1021 L1022	I1014-S1018 WeakPolarHBondContact O-CB 3.49Å; I1014-S1018 PolarHBondContact O-N 2.73Å; I1014-S1018 PolarHBondContact O-OG 3.36Å; L1015-S1018 PolarHBondContact O-N 3.45Å; T1016-S1018 PolarHBondContact O-N 2.88Å; S1018-F1021 PolarHBondContact O-N 3.48Å; S1018-L1022 PolarHBondContact O-N 3.2Å
1019	I	82.3	Confident	76.3	Confident	95 Å²	95	96.5 Å²	96.5	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-65	-44.1	177	-68.1	165.7	0	0	0	110	L1015 T1016 F1021 L1022 L1023	L1015-I1019 WeakPolarHBondContact O-CB 3.33Å; L1015-I1019 VanDerWaalsContact O-CG1 3.25Å; L1015-I1019 WeakPolarHBondContact O-CG1 3.49Å; L1015-I1019 PolarHBondContact O-N 2.82Å; T1016-I1019 PolarHBondContact O-N 3.39Å; I1019-F1021 VanDerWaalsContact C-N 3.3Å; I1019-F1021 PolarHBondContact O-N 2.95Å; I1019-L1022 PolarHBondContact O-N 3.38Å; I1019-L1023 HydrophobicContact CG2-CD1 4.33Å; I1019-L1023 WeakPolarHBondContact O-CB 3.13Å; I1019-L1023 PolarHBondContact O-N 2.8Å
1020	L	77.9	Confident	76.9	Confident	117 Å²	117	96.6 Å²	96.6	61%	0.613	51%	0.507	S	S	*	.	H	α-helix	trans	-64.1	-36.9	178.6	-146.1	79.9	0	0	0	111.8	T1016 N1024	T1016-L1020 WeakPolarHBondContact O-CB 3.35Å; T1016-L1020 PolarHBondContact O-N 2.76Å; L1020-N1024 WeakPolarHBondContact O-CB 3.4Å; L1020-N1024 PolarHBondContact O-N 2.58Å
1021	F	76	Confident	77.5	Confident	145 Å²	145	96.6 Å²	96.6	64%	0.636	51%	0.507	S	S	*	.	H	α-helix	trans	-66.1	-44.3	175.1	-174	-96.6	0	0	0	112.2	G1017 S1018 I1019 N1024 T1025	G1017-F1021 WeakPolarHBondContact O-CB 3.44Å; G1017-F1021 PolarHBondContact O-N 3.16Å; S1018-F1021 PolarHBondContact O-N 3.48Å; I1019-F1021 VanDerWaalsContact C-N 3.3Å; I1019-F1021 PolarHBondContact O-N 2.95Å; F1021-N1024 PolarHBondContact O-N 3.22Å; F1021-T1025 HydrophobicContact CE1-CG2 4.31Å; F1021-T1025 HydrophobicContact CZ-CG2 4.45Å; F1021-T1025 PolarHBondContact O-N 3.46Å; F1021-T1025 PolarHBondContact O-OG1 3.18Å
1022	L	80.8	Confident	77.5	Confident	108 Å²	108	99.7 Å²	99.7	57%	0.565	51%	0.514	S	S	*	.	H	α-helix	trans	-64.7	-40.7	175.9	-78.5	168.2	0	0	0	112.3	S1018 I1019 T1025 L1026	S1018-L1022 PolarHBondContact O-N 3.2Å; I1019-L1022 PolarHBondContact O-N 3.38Å; L1022-T1025 VanDerWaalsContact CA-OG1 3.3Å; L1022-T1025 WeakPolarHBondContact CA-OG1 3.3Å; L1022-T1025 PolarHBondContact O-N 3.02Å; L1022-T1025 PolarHBondContact O-OG1 3.21Å; L1022-T1025 VanDerWaalsContact O-OG1 3.11Å; L1022-L1026 WeakPolarHBondContact O-CB 3.44Å; L1022-L1026 WeakPolarHBondContact O-CG 3.41Å; L1022-L1026 PolarHBondContact O-N 2.93Å
1023	L	81.8	Confident	77.5	Confident	98 Å²	98	98.8 Å²	98.8	51%	0.513	51%	0.512	S	S	.	.	H	α-helix	trans	-65.6	-43.4	177.3	-128.7	124.5	0	0	0	111	I1019 T1025 L1026 I1027	I1019-L1023 HydrophobicContact CG2-CD1 4.33Å; I1019-L1023 WeakPolarHBondContact O-CB 3.13Å; I1019-L1023 PolarHBondContact O-N 2.8Å; L1023-T1025 PolarHBondContact O-N 2.8Å; L1023-L1026 PolarHBondContact O-N 3.07Å; L1023-I1027 HydrophobicContact CD2-CD1 4.01Å; L1023-I1027 WeakPolarHBondContact O-CB 3.47Å; L1023-I1027 VanDerWaalsContact O-CG1 3.25Å; L1023-I1027 WeakPolarHBondContact O-CG1 3.23Å; L1023-I1027 PolarHBondContact O-N 2.55Å
1024	N	76.5	Confident	77.4	Confident	98 Å²	98	100.3 Å²	100.3	52%	0.524	52%	0.517	S	S	.	.	H	α-helix	trans	-65.3	-37.5	176.1	-85.8	-26.5	0	0	0	112.7	L1020 F1021 F1028	L1020-N1024 WeakPolarHBondContact O-CB 3.4Å; L1020-N1024 PolarHBondContact O-N 2.58Å; F1021-N1024 PolarHBondContact O-N 3.22Å; N1024-F1028 WeakPolarHBondContact O-CB 3.15Å; N1024-F1028 PolarHBondContact O-N 2.64Å
1025	T	77.3	Confident	76.9	Confident	54 Å²	54	98 Å²	98	33%	0.331	51%	0.507	S	S	.	.	H	α-helix	trans	-68.9	-39.9	175.1	27.4	0	0	0	0	112.1	F1021 L1022 L1023 F1028 I1029	F1021-T1025 HydrophobicContact CE1-CG2 4.31Å; F1021-T1025 HydrophobicContact CZ-CG2 4.45Å; F1021-T1025 PolarHBondContact O-N 3.46Å; F1021-T1025 PolarHBondContact O-OG1 3.18Å; L1022-T1025 VanDerWaalsContact CA-OG1 3.3Å; L1022-T1025 WeakPolarHBondContact CA-OG1 3.3Å; L1022-T1025 PolarHBondContact O-N 3.02Å; L1022-T1025 PolarHBondContact O-OG1 3.21Å; L1022-T1025 VanDerWaalsContact O-OG1 3.11Å; L1023-T1025 PolarHBondContact O-N 2.8Å; T1025-F1028 PolarHBondContact O-N 3.41Å; T1025-I1029 VanDerWaalsContact O-CG1 3.3Å; T1025-I1029 WeakPolarHBondContact O-CG1 3.32Å; T1025-I1029 PolarHBondContact O-N 2.95Å
1026	L	83	Confident	76.4	Confident	115 Å²	115	97.8 Å²	97.8	60%	0.602	50%	0.504	S	S	*	.	H	α-helix	trans	-64.3	-42.1	174.4	-76.4	170.4	0	0	0	112.3	L1022 L1023 F1028 I1029 A1030	L1022-L1026 WeakPolarHBondContact O-CB 3.44Å; L1022-L1026 WeakPolarHBondContact O-CG 3.41Å; L1022-L1026 PolarHBondContact O-N 2.93Å; L1023-L1026 PolarHBondContact O-N 3.07Å; L1026-F1028 VanDerWaalsContact C-N 3.31Å; L1026-F1028 PolarHBondContact O-N 3.37Å; L1026-I1029 PolarHBondContact O-N 3.48Å; L1026-A1030 WeakPolarHBondContact O-CB 3.46Å; L1026-A1030 PolarHBondContact O-N 2.86Å
1027	I	81.4	Confident	75.9	Confident	82 Å²	82	98.1 Å²	98.1	42%	0.421	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-43.2	174	-70.2	166.1	0	0	0	110.2	L1023 I1029 A1030 I1031	L1023-I1027 HydrophobicContact CD2-CD1 4.01Å; L1023-I1027 WeakPolarHBondContact O-CB 3.47Å; L1023-I1027 VanDerWaalsContact O-CG1 3.25Å; L1023-I1027 WeakPolarHBondContact O-CG1 3.23Å; L1023-I1027 PolarHBondContact O-N 2.55Å; I1027-I1029 PolarHBondContact O-N 3.28Å; I1027-A1030 PolarHBondContact O-N 3.48Å; I1027-I1031 HydrophobicContact CG2-CD1 3.65Å; I1027-I1031 HydrophobicContact CG2-CG1 4.31Å; I1027-I1031 VanDerWaalsContact O-CG1 3.28Å; I1027-I1031 WeakPolarHBondContact O-CG1 3.45Å; I1027-I1031 PolarHBondContact O-N 3.25Å
1028	F	72.2	Confident	75.2	Confident	140 Å²	140	100.7 Å²	100.7	61%	0.614	51%	0.505	S	S	*	.	H	α-helix	trans	-64	-40.5	178.7	-151.7	-87.9	0	0	0	112.3	N1024 T1025 L1026 Y1032	N1024-F1028 WeakPolarHBondContact O-CB 3.15Å; N1024-F1028 PolarHBondContact O-N 2.64Å; T1025-F1028 PolarHBondContact O-N 3.41Å; L1026-F1028 VanDerWaalsContact C-N 3.31Å; L1026-F1028 PolarHBondContact O-N 3.37Å; F1028-Y1032 VanDerWaalsContact O-CB 3.29Å; F1028-Y1032 WeakPolarHBondContact O-CB 3.37Å; F1028-Y1032 PolarHBondContact O-N 2.84Å
1029	I	78.8	Confident	73.8	Confident	109 Å²	109	104.8 Å²	104.8	56%	0.559	51%	0.511	S	S	*	.	H	α-helix	trans	-65.8	-41.5	175	-67.7	165.7	0	0	0	110.8	T1025 L1026 I1027 Y1032 Y1033	T1025-I1029 VanDerWaalsContact O-CG1 3.3Å; T1025-I1029 WeakPolarHBondContact O-CG1 3.32Å; T1025-I1029 PolarHBondContact O-N 2.95Å; L1026-I1029 PolarHBondContact O-N 3.48Å; I1027-I1029 PolarHBondContact O-N 3.28Å; I1029-Y1032 PolarHBondContact O-N 3.34Å; I1029-Y1033 WeakPolarHBondContact O-CB 3.41Å; I1029-Y1033 PolarHBondContact O-N 3.1Å
1030	A	78.3	Confident	72.4	Confident	53 Å²	53	106.5 Å²	106.5	44%	0.438	52%	0.515	S	S	.	.	H	α-helix	trans	-63.8	-45.2	177.5	0	0	0	0	0	111.9	L1026 I1027 Y1033 Q1034	L1026-A1030 WeakPolarHBondContact O-CB 3.46Å; L1026-A1030 PolarHBondContact O-N 2.86Å; I1027-A1030 PolarHBondContact O-N 3.48Å; A1030-Y1033 PolarHBondContact O-N 3.01Å; A1030-Q1034 WeakPolarHBondContact O-CB 3.45Å; A1030-Q1034 PolarHBondContact O-N 3.49Å
1031	I	76.3	Confident	71.4	Confident	89 Å²	89	105.6 Å²	105.6	46%	0.456	51%	0.51	S	S	.	.	H	α-helix	trans	-63.4	-42.4	175.5	-66.8	168.8	0	0	0	110.5	I1027 Y1033 Q1034 T1035	I1027-I1031 HydrophobicContact CG2-CD1 3.65Å; I1027-I1031 HydrophobicContact CG2-CG1 4.31Å; I1027-I1031 VanDerWaalsContact O-CG1 3.28Å; I1027-I1031 WeakPolarHBondContact O-CG1 3.45Å; I1027-I1031 PolarHBondContact O-N 3.25Å; I1031-Y1033 VanDerWaalsContact C-N 3.34Å; I1031-Y1033 PolarHBondContact O-N 3.12Å; I1031-Q1034 PolarHBondContact O-N 3.23Å; I1031-T1035 HydrophobicContact CG2-CG2 4.29Å; I1031-T1035 WeakPolarHBondContact O-CB 3.45Å; I1031-T1035 WeakPolarHBondContact O-CG2 3.45Å; I1031-T1035 PolarHBondContact O-N 3.19Å; I1031-T1035 PolarHBondContact O-OG1 2.98Å
1032	Y	72.3	Confident	70	Confident	152 Å²	152	100.7 Å²	100.7	60%	0.596	49%	0.494	S	S	*	.	H	α-helix	trans	-61.3	-42.5	175.6	-176.3	-94.7	0	0	0	111.8	F1028 I1029 T1035 H1036	F1028-Y1032 VanDerWaalsContact O-CB 3.29Å; F1028-Y1032 WeakPolarHBondContact O-CB 3.37Å; F1028-Y1032 PolarHBondContact O-N 2.84Å; I1029-Y1032 PolarHBondContact O-N 3.34Å; Y1032-T1035 WeakPolarHBondContact CA-OG1 3.41Å; Y1032-T1035 PolarHBondContact O-OG1 3.48Å; Y1032-H1036 VanDerWaalsContact O-CB 3.28Å; Y1032-H1036 WeakPolarHBondContact O-CB 3.36Å; Y1032-H1036 PolarHBondContact O-N 3.22Å
1033	Y	74.6	Confident	68.4	Low	153 Å²	153	100.6 Å²	100.6	60%	0.6	49%	0.493	S	S	*	.	H	α-helix	trans	-69.1	-42	178.5	-160.8	-97.3	0	0	0	112.1	I1029 A1030 I1031 H1036 Q1037	I1029-Y1033 WeakPolarHBondContact O-CB 3.41Å; I1029-Y1033 PolarHBondContact O-N 3.1Å; A1030-Y1033 PolarHBondContact O-N 3.01Å; I1031-Y1033 VanDerWaalsContact C-N 3.34Å; I1031-Y1033 PolarHBondContact O-N 3.12Å; Y1033-H1036 PolarHBondContact O-N 3.03Å; Y1033-Q1037 HydrophobicContact CD1-CG 4.17Å; Y1033-Q1037 HydrophobicContact CE1-CG 4Å; Y1033-Q1037 WeakPolarHBondContact O-CG 3.44Å; Y1033-Q1037 PolarHBondContact O-N 3.06Å; Y1033-Q1037 PolarHBondContact OH-NE2 2.73Å
1034	Q	71.3	Confident	66.6	Low	132 Å²	132	103 Å²	103	62%	0.617	50%	0.497	S	S	*	.	H	α-helix	trans	-63.8	-46.1	175.4	-99.4	178.6	-40.7	0	0	112.2	A1030 I1031 H1036 Q1037 L1038	A1030-Q1034 WeakPolarHBondContact O-CB 3.45Å; A1030-Q1034 PolarHBondContact O-N 3.49Å; I1031-Q1034 PolarHBondContact O-N 3.23Å; Q1034-H1036 VanDerWaalsContact C-N 3.34Å; Q1034-H1036 PolarHBondContact O-N 3.11Å; Q1034-Q1037 PolarHBondContact O-N 3.03Å; Q1034-L1038 WeakPolarHBondContact O-CG 3.21Å; Q1034-L1038 PolarHBondContact O-N 3.23Å
1035	T	64.1	Low	65.2	Low	58 Å²	58	104.7 Å²	104.7	36%	0.356	50%	0.501	S	S	.	.	H	α-helix	trans	-64.2	-38.3	177.6	50	0	0	0	0	111.7	I952 I1031 Y1032 L1038 R1039	I952-T1035 HydrophobicContact CD1-CG2 4.17Å; I1031-T1035 HydrophobicContact CG2-CG2 4.29Å; I1031-T1035 WeakPolarHBondContact O-CB 3.45Å; I1031-T1035 WeakPolarHBondContact O-CG2 3.45Å; I1031-T1035 PolarHBondContact O-N 3.19Å; I1031-T1035 PolarHBondContact O-OG1 2.98Å; Y1032-T1035 WeakPolarHBondContact CA-OG1 3.41Å; Y1032-T1035 PolarHBondContact O-OG1 3.48Å; T1035-L1038 PolarHBondContact O-N 3.33Å; T1035-R1039 WeakPolarHBondContact O-CB 3.2Å; T1035-R1039 PolarHBondContact O-N 3.28Å
1036	H	67.6	Low	63.5	Low	88 Å²	88	108 Å²	108	41%	0.407	51%	0.513	S	S	.	.	H	α-helix	trans	-66.8	-36.4	175	-166.8	-66.9	0	0	0	112.7	Y1032 Y1033 Q1034 K1040	Y1032-H1036 VanDerWaalsContact O-CB 3.28Å; Y1032-H1036 WeakPolarHBondContact O-CB 3.36Å; Y1032-H1036 PolarHBondContact O-N 3.22Å; Y1033-H1036 PolarHBondContact O-N 3.03Å; Q1034-H1036 VanDerWaalsContact C-N 3.34Å; Q1034-H1036 PolarHBondContact O-N 3.11Å; H1036-K1040 PolarHBondContact O-N 3.04Å; H1036-K1040 VanDerWaalsContact O-N 3.13Å
1037	Q	67.3	Low	61.4	Low	74 Å²	74	105.4 Å²	105.4	35%	0.346	50%	0.504	S	S	.	.	H	α-helix	trans	-70.6	-41.5	175	-71.1	-66	-7.7	0	0	112.2	Y1033 Q1034 R1039 K1040 N1041	Y1033-Q1037 HydrophobicContact CD1-CG 4.17Å; Y1033-Q1037 HydrophobicContact CE1-CG 4Å; Y1033-Q1037 WeakPolarHBondContact O-CG 3.44Å; Y1033-Q1037 PolarHBondContact O-N 3.06Å; Y1033-Q1037 PolarHBondContact OH-NE2 2.73Å; Q1034-Q1037 PolarHBondContact O-N 3.03Å; Q1037-R1039 VanDerWaalsContact C-N 3.34Å; Q1037-R1039 PolarHBondContact O-N 3.31Å; Q1037-K1040 PolarHBondContact O-N 3.28Å; Q1037-N1041 PolarHBondContact O-N 3.38Å
1038	L	61.4	Low	59.4	Low	95 Å²	95	106.7 Å²	106.7	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-62.5	-40.3	174.8	-73.7	168.5	0	0	0	111.6	I952 Q1034 T1035 K1040 N1041 S1042	I952-L1038 HydrophobicContact CD1-CD1 4.37Å; Q1034-L1038 WeakPolarHBondContact O-CG 3.21Å; Q1034-L1038 PolarHBondContact O-N 3.23Å; T1035-L1038 PolarHBondContact O-N 3.33Å; L1038-K1040 PolarHBondContact O-N 3.46Å; L1038-N1041 PolarHBondContact O-N 3.4Å; L1038-S1042 PolarHBondContact O-N 3.19Å
1039	R	48.3	Very low	57.8	Low	146 Å²	146	102.9 Å²	102.9	55%	0.551	50%	0.497	S	S	*	.	H	α-helix	trans	-66.4	-36	176.2	-153.7	179.3	-164	171	9.9	112.9	T1035 Q1037 S1042 I1043	T1035-R1039 WeakPolarHBondContact O-CB 3.2Å; T1035-R1039 PolarHBondContact O-N 3.28Å; Q1037-R1039 VanDerWaalsContact C-N 3.34Å; Q1037-R1039 PolarHBondContact O-N 3.31Å; R1039-S1042 PolarHBondContact O-OG 2.69Å; R1039-I1043 HydrophobicContact CG-CD1 4.23Å; R1039-I1043 WeakPolarHBondContact O-CB 3.4Å; R1039-I1043 WeakPolarHBondContact O-CD1 3.22Å; R1039-I1043 WeakPolarHBondContact O-CG1 3.4Å; R1039-I1043 PolarHBondContact O-N 3.4Å; R1039-I1043 VanDerWaalsContact O-N 3.11Å
1040	K	52.5	Low	55.8	Low	131 Å²	131	103 Å²	103	57%	0.57	50%	0.499	S	S	*	.	H	α-helix	trans	-65	-41.1	171.4	-99	-176	173.5	178	0	111.6	H1036 Q1037 L1038 Y1044	H1036-K1040 PolarHBondContact O-N 3.04Å; H1036-K1040 VanDerWaalsContact O-N 3.13Å; Q1037-K1040 PolarHBondContact O-N 3.28Å; L1038-K1040 PolarHBondContact O-N 3.46Å; K1040-Y1044 WeakPolarHBondContact O-CB 3.24Å; K1040-Y1044 PolarHBondContact O-N 3.39Å
1041	N	57.1	Low	53.6	Low	97 Å²	97	108.1 Å²	108.1	52%	0.519	52%	0.516	S	S	.	.	H	α-helix	trans	-73.4	-35.1	179.2	-78.3	-14.6	0	0	0	113.2	Q1037 L1038 Y1044 Q1045	Q1037-N1041 PolarHBondContact O-N 3.38Å; L1038-N1041 PolarHBondContact O-N 3.4Å; N1041-Y1044 PolarHBondContact O-N 2.55Å; N1041-Q1045 WeakPolarHBondContact O-CB 3.48Å; N1041-Q1045 VanDerWaalsContact O-CG 3.27Å; N1041-Q1045 WeakPolarHBondContact O-CG 3.38Å; N1041-Q1045 PolarHBondContact O-N 3.23Å
1042	S	46.8	Very low	51.7	Low	43 Å²	43	112 Å²	112	30%	0.301	53%	0.529	S	S	.	.	H	α-helix	trans	-70.2	-41.8	176	74.5	0	0	0	0	111.3	L1038 R1039 Y1044 Q1045 Q1046	L1038-S1042 PolarHBondContact O-N 3.19Å; R1039-S1042 PolarHBondContact O-OG 2.69Å; S1042-Y1044 VanDerWaalsContact C-N 3.29Å; S1042-Y1044 PolarHBondContact O-N 2.65Å; S1042-Q1045 PolarHBondContact O-N 2.87Å; S1042-Q1046 VanDerWaalsContact O-CB 3.23Å; S1042-Q1046 WeakPolarHBondContact O-CB 3.28Å; S1042-Q1046 PolarHBondContact O-N 3.07Å
1043	I	48.3	Very low	49.9	Very low	105 Å²	105	110.3 Å²	110.3	54%	0.538	54%	0.535	S	S	.	.	H	α-helix	trans	-62.5	-37.9	172.5	-66.2	168.2	0	0	0	110.7	R1039 S1047	R1039-I1043 HydrophobicContact CG-CD1 4.23Å; R1039-I1043 WeakPolarHBondContact O-CB 3.4Å; R1039-I1043 WeakPolarHBondContact O-CD1 3.22Å; R1039-I1043 WeakPolarHBondContact O-CG1 3.4Å; R1039-I1043 PolarHBondContact O-N 3.4Å; R1039-I1043 VanDerWaalsContact O-N 3.11Å; I1043-S1047 VanDerWaalsContact O-CB 3.29Å; I1043-S1047 WeakPolarHBondContact O-CB 3.42Å; I1043-S1047 PolarHBondContact O-N 2.8Å; I1043-S1047 PolarHBondContact O-OG 3.32Å
1044	Y	43.8	Very low	47.9	Very low	150 Å²	150	106.3 Å²	106.3	59%	0.588	53%	0.53	S	S	*	.	H	α-helix	trans	-68.1	-43	175.2	-164.7	-98.5	0	0	0	112.3	K1040 N1041 S1042 S1047 K1048	K1040-Y1044 WeakPolarHBondContact O-CB 3.24Å; K1040-Y1044 PolarHBondContact O-N 3.39Å; N1041-Y1044 PolarHBondContact O-N 2.55Å; S1042-Y1044 VanDerWaalsContact C-N 3.29Å; S1042-Y1044 PolarHBondContact O-N 2.65Å; Y1044-S1047 PolarHBondContact O-N 3.01Å; Y1044-S1047 PolarHBondContact O-OG 2.85Å; Y1044-K1048 WeakPolarHBondContact O-CB 3.42Å; Y1044-K1048 PolarHBondContact O-N 2.78Å
1045	Q	46.8	Very low	45.9	Very low	133 Å²	133	106.1 Å²	106.1	62%	0.621	54%	0.543	S	S	*	.	H	α-helix	trans	-67.4	-41.5	176.8	-76.7	-91.8	-2.2	0	0	112.3	N1041 S1042 S1047 K1048 S1049	N1041-Q1045 WeakPolarHBondContact O-CB 3.48Å; N1041-Q1045 VanDerWaalsContact O-CG 3.27Å; N1041-Q1045 WeakPolarHBondContact O-CG 3.38Å; N1041-Q1045 PolarHBondContact O-N 3.23Å; S1042-Q1045 PolarHBondContact O-N 2.87Å; Q1045-S1047 VanDerWaalsContact C-N 3.34Å; Q1045-K1048 CarbonylContact O-C 3.51Å; Q1045-K1048 WeakPolarHBondContact O-CA 2.99Å; Q1045-K1048 PolarHBondContact O-N 3.31Å; Q1045-S1049 PolarHBondContact O-N 2.9Å; Q1045-S1049 PolarHBondContact O-OG 2.86Å
1046	Q	41.4	Very low	44.5	Very low	123 Å²	123	107.8 Å²	107.8	58%	0.575	55%	0.549	S	S	*	.	H	α-helix	trans	-71.4	-30.6	178.6	-146.8	166.1	23	0	0	111.4	S1042 K1048 S1049 N1050	S1042-Q1046 VanDerWaalsContact O-CB 3.23Å; S1042-Q1046 WeakPolarHBondContact O-CB 3.28Å; S1042-Q1046 PolarHBondContact O-N 3.07Å; Q1046-K1048 VanDerWaalsContact C-N 3.32Å; Q1046-S1049 WeakPolarHBondContact CA-OG 3.33Å; Q1046-S1049 PolarHBondContact O-OG 3.27Å; Q1046-N1050 VanDerWaalsContact O-CB 3.23Å; Q1046-N1050 WeakPolarHBondContact O-CB 3.37Å; Q1046-N1050 VanDerWaalsContact O-CG 3.24Å; Q1046-N1050 PolarHBondContact O-N 2.95Å; Q1046-N1050 VanDerWaalsContact O-N 3.1Å; Q1046-N1050 PolarHBondContact O-ND2 2.78Å
1047	S	39.5	Very low	42.8	Very low	60 Å²	60	110.6 Å²	110.6	42%	0.42	57%	0.567	S	S	.	*	H	α-helix	trans	-69.1	-30	167.7	80.1	0	0	0	0	112.8	I1043 Y1044 Q1045 M1051	I1043-S1047 VanDerWaalsContact O-CB 3.29Å; I1043-S1047 WeakPolarHBondContact O-CB 3.42Å; I1043-S1047 PolarHBondContact O-N 2.8Å; I1043-S1047 PolarHBondContact O-OG 3.32Å; Y1044-S1047 PolarHBondContact O-N 3.01Å; Y1044-S1047 PolarHBondContact O-OG 2.85Å; Q1045-S1047 VanDerWaalsContact C-N 3.34Å; S1047-M1051 WeakPolarHBondContact O-CB 3.41Å; S1047-M1051 VanDerWaalsContact O-CG 3.29Å; S1047-M1051 WeakPolarHBondContact O-CG 3.41Å; S1047-M1051 PolarHBondContact O-N 3.4Å
1048	K	38.1	Very low	41.2	Very low	110 Å²	110	117.1 Å²	117.1	48%	0.478	59%	0.594	S	S	.	*	H	α-helix	trans	-86.5	-28.5	-179.1	-159	174.3	-175.3	178.5	0	113.1	Y1044 Q1045 Q1046	Y1044-K1048 WeakPolarHBondContact O-CB 3.42Å; Y1044-K1048 PolarHBondContact O-N 2.78Å; Q1045-K1048 CarbonylContact O-C 3.51Å; Q1045-K1048 WeakPolarHBondContact O-CA 2.99Å; Q1045-K1048 PolarHBondContact O-N 3.31Å; Q1046-K1048 VanDerWaalsContact C-N 3.32Å
1049	S	39.5	Very low	39.9	Very low	59 Å²	59	114.9 Å²	114.9	41%	0.413	59%	0.594	S	S	.	*	H	α-helix	trans	-79.7	-40	173.5	64.7	0	0	0	0	111.5	Q1045 Q1046 M1051 K1052 T1053	Q1045-S1049 PolarHBondContact O-N 2.9Å; Q1045-S1049 PolarHBondContact O-OG 2.86Å; Q1046-S1049 WeakPolarHBondContact CA-OG 3.33Å; Q1046-S1049 PolarHBondContact O-OG 3.27Å; S1049-M1051 PolarHBondContact O-N 3.12Å; S1049-K1052 PolarHBondContact O-N 2.92Å; S1049-T1053 PolarHBondContact O-N 2.95Å; S1049-T1053 PolarHBondContact O-OG1 3.17Å
1050	N	36.4	Very low	39.3	Very low	111 Å²	111	111.2 Å²	111.2	59%	0.594	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	-17	171.5	-70.6	-16	0	0	0	112.9	Q1046	Q1046-N1050 VanDerWaalsContact O-CB 3.23Å; Q1046-N1050 WeakPolarHBondContact O-CB 3.37Å; Q1046-N1050 VanDerWaalsContact O-CG 3.24Å; Q1046-N1050 PolarHBondContact O-N 2.95Å; Q1046-N1050 VanDerWaalsContact O-N 3.1Å; Q1046-N1050 PolarHBondContact O-ND2 2.78Å
1051	M	32.9	Very low	38.5	Very low	161 Å²	161	114 Å²	114	79%	0.793	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-10.3	168.4	-84.9	-170.3	167	0	0	114.3	S1047 S1049	S1047-M1051 WeakPolarHBondContact O-CB 3.41Å; S1047-M1051 VanDerWaalsContact O-CG 3.29Å; S1047-M1051 WeakPolarHBondContact O-CG 3.41Å; S1047-M1051 PolarHBondContact O-N 3.4Å; S1049-M1051 PolarHBondContact O-N 3.12Å
1052	K	36.7	Very low	37.4	Very low	170 Å²	170	116.9 Å²	116.9	74%	0.739	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	-7.6	-177.6	-81.3	-174.7	172.5	-170.8	0	114.6	S1049	S1049-K1052 PolarHBondContact O-N 2.92Å
1053	T	33.8	Very low	36.8	Very low	117 Å²	117	121.8 Å²	121.8	72%	0.718	63%	0.63	S	S	*	*	S	Bend	trans	-125.1	52	178.2	51.9	0	0	0	0	112.1	S1049	S1049-T1053 PolarHBondContact O-N 2.95Å; S1049-T1053 PolarHBondContact O-OG1 3.17Å
1054	S	31.5	Very low	36.2	Very low	70 Å²	70	123.5 Å²	123.5	49%	0.49	64%	0.64	S	S	.	*	S	Bend	trans	-150	131.8	152.7	62.8	0	0	0	0	108.9	I1056	S1054-I1056 VanDerWaalsContact C-N 3.31Å; S1054-I1056 PolarHBondContact O-N 2.95Å
1055	S	30.3	Very low	35.8	Very low	127 Å²	127	126.8 Å²	126.8	89%	0.888	65%	0.651	S	S	*	*			trans	-68.1	85.8	179.7	52.4	0	0	0	0	110.4
1056	I	34.1	Very low	35.4	Very low	94 Å²	94	127 Å²	127	48%	0.482	66%	0.655	S	S	.	*			trans	-127.2	68	166.4	-51.3	179.4	0	0	0	107.4	S1054 T1060	S1054-I1056 VanDerWaalsContact C-N 3.31Å; S1054-I1056 PolarHBondContact O-N 2.95Å; I1056-T1060 HydrophobicContact CG2-CG2 3.93Å; I1056-T1060 PolarHBondContact O-OG1 3.01Å
1057	D	32.6	Very low	35	Very low	147 Å²	147	130.6 Å²	130.6	79%	0.786	67%	0.669	S	S	*	*			trans	-120.7	84.2	170.2	-150.6	13.7	0	0	0	108.5
1058	K	33.4	Very low	34.8	Very low	211 Å²	211	136.1 Å²	136.1	92%	0.917	69%	0.688	S	S	*	*	S	Bend	trans	171.6	-10.5	155.2	-96.5	168.1	-176.4	-179.3	0	115
1059	G	33.5	Very low	34.5	Very low	47 Å²	47	139.7 Å²	139.7	49%	0.485	70%	0.703	S	S	.	*	S	Bend	trans	-105.5	-19.7	-179.4	0	0	0	0	0	116.5
1060	T	36.8	Very low	34	Very low	69 Å²	69	148.3 Å²	148.3	42%	0.423	73%	0.727	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.1	-7.7	-164.8	20.2	0	0	0	0	114.8	I1056	I1056-T1060 HydrophobicContact CG2-CG2 3.93Å; I1056-T1060 PolarHBondContact O-OG1 3.01Å
1061	K	34.8	Very low	33.7	Very low	189 Å²	189	150.2 Å²	150.2	82%	0.822	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	-6.8	171.6	-86.3	178.1	177.5	170.1	0	114.8
1062	Q	35.4	Very low	33.6	Very low	159 Å²	159	146.9 Å²	146.9	74%	0.743	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-24.4	175.6	-122.2	168.1	-0.3	0	0	113.6
1063	M	32.8	Very low	33.3	Very low	146 Å²	146	146.1 Å²	146.1	72%	0.719	74%	0.738	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.5	-14.1	177.9	-88.6	-157.2	-73.3	0	0	115.1
1064	L	36.4	Very low	33	Very low	141 Å²	141	148.3 Å²	148.3	74%	0.738	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	0.8	177.2	-87.6	158	0	0	0	114.7
1065	R	35.5	Very low	32.9	Very low	219 Å²	219	152.5 Å²	152.5	83%	0.826	76%	0.761	S	S	*	*	S	Bend	trans	-101.8	-5.9	169.8	-79	-176	-179.4	166.7	0.6	114.7
1066	I	38	Very low	33	Very low	137 Å²	137	151 Å²	151	70%	0.703	75%	0.751	S	S	*	*	S	Bend	trans	-101.9	-10	-174.7	-63.1	177.4	0	0	0	113.2
1067	K	32.3	Very low	32.7	Very low	199 Å²	199	154 Å²	154	87%	0.865	77%	0.767	S	S	*	*	S	Bend	trans	-106.1	4.7	177.1	-83.6	-173.6	173.6	-177	0	116.6
1068	Q	37	Very low	32.5	Very low	175 Å²	175	154.1 Å²	154.1	82%	0.818	77%	0.767	S	S	*	*	S	Bend	trans	-104.5	12.2	172.2	-86	-179.7	-23.3	0	0	114.2
1069	K	31.3	Very low	32.4	Very low	185 Å²	185	153 Å²	153	80%	0.804	76%	0.763	S	S	*	*	S	Bend	trans	-114.9	22.6	-176	-127.6	179.3	-175.4	-175.6	0	115.3
1070	R	28.8	Very low	32.1	Very low	240 Å²	240	157.8 Å²	157.8	91%	0.906	78%	0.777	S	S	*	*	S	Bend	trans	-133.7	19.5	-177.1	-114.1	-178.3	-174.1	171.8	1.9	117.1
1071	V	29.2	Very low	31.8	Very low	151 Å²	151	163 Å²	163	92%	0.915	80%	0.797	S	S	*	*	S	Bend	trans	-128.1	17.8	175	-169.8	0	0	0	0	112.9
1072	S	30.8	Very low	31.2	Very low	91 Å²	91	158.8 Å²	158.8	64%	0.636	79%	0.791	S	S	*	*	S	Bend	trans	-134.9	90.5	167.1	58.8	0	0	0	0	108.6
1073	N	30.3	Very low	30.8	Very low	154 Å²	154	163.6 Å²	163.6	82%	0.824	80%	0.802	S	S	*	*			trans	160.4	63	157.6	-81.8	-3.5	0	0	0	108.7
1074	I	29.2	Very low	30.4	Very low	164 Å²	164	164.6 Å²	164.6	84%	0.841	81%	0.806	S	S	*	*			trans	-125.5	82.8	154.2	-63.5	177.2	0	0	0	103.6
1075	N	29.1	Very low	30	Very low	157 Å²	157	163.9 Å²	163.9	84%	0.84	80%	0.801	S	S	*	*	S	Bend	trans	175.3	75.1	163.7	-89.8	-12.7	0	0	0	107.8
1076	S	31.3	Very low	29.8	Very low	97 Å²	97	161.1 Å²	161.1	68%	0.678	80%	0.803	S	S	*	*			trans	178.6	116.4	149.7	27.5	0	0	0	0	110
1077	L	28.9	Very low	29.5	Very low	155 Å²	155	163.3 Å²	163.3	81%	0.812	81%	0.81	S	S	*	*			trans	64.5	101.1	130.4	-60.6	157	0	0	0	116
1078	N	28.5	Very low	29.6	Very low	150 Å²	150	162.8 Å²	162.8	80%	0.802	81%	0.808	S	S	*	*				55.4	132.8	88.9	-86.3	-10.4	0	0	0	115.7
1079	K	31.7	Very low	29.7	Very low	187 Å²	187	162.1 Å²	162.1	81%	0.813	81%	0.81	S	S	*	*			trans	87.5	103.1	169.1	-62.9	179.5	177	-177.7	0	114.4
1080	N	26.4	Very low	29.6	Very low	148 Å²	148	156.8 Å²	156.8	79%	0.791	81%	0.808	S	S	*	*				86.3	139	85	-86.1	7.5	0	0	0	112.4
1081	E	29.4	Very low	29.6	Very low	179 Å²	179	155 Å²	155	84%	0.836	81%	0.806	S	S	*	*			trans	102.1	124.8	159	-67.5	167.4	-153.7	0	0	119.9
1082	S	23.3	Very low	29.6	Very low	100 Å²	100	154.7 Å²	154.7	70%	0.699	80%	0.798	S	S	*	*			trans	-88.1	149.1	-175.3	47.4	0	0	0	0	113.5
1083	W	26.8	Very low	29.6	Very low	260 Å²	260	157.9 Å²	157.9	99%	0.985	81%	0.806	S	S	*	*			trans	-145.9	144.4	151.1	-76.4	93.4	0	0	0	111.3
1084	Q	25.2	Very low	29.4	Very low	168 Å²	168	155.4 Å²	155.4	79%	0.785	80%	0.797	S	S	*	*			trans	-122.7	152.8	-165.2	-119.2	-166.7	-22.4	0	0	111.7
1085	I	27.5	Very low	29.2	Very low	126 Å²	126	158.4 Å²	158.4	65%	0.646	80%	0.799	S	S	*	*			trans	75.4	124.7	145.1	-58.2	160.8	0	0	0	121.2
1086	N	30.8	Very low	29.2	Very low	161 Å²	161	155.2 Å²	155.2	86%	0.861	79%	0.787	S	S	*	*				-167.2	121.4	115.9	-118.1	-23.8	0	0	0	113.5
1087	E	32.2	Very low	29	Very low	182 Å²	182	157 Å²	157	85%	0.85	79%	0.789	S	S	*	*			trans	-93.5	147.2	169.7	-70.2	179.8	149.8	0	0	110.5
1088	K	33	Very low	28.9	Very low	188 Å²	188	155.4 Å²	155.4	82%	0.817	79%	0.785	S	S	*	*			trans	-166.5	128.8	151.8	-107.1	166.5	-172.8	-176.1	0	111.8
1089	D	39.2	Very low	28.6	Very low	161 Å²	161	152.4 Å²	152.4	86%	0.861	78%	0.776	S	S	*	*			trans	81.7	113	158.2	-44.6	-26.6	0	0	0	118.5
1090	G	30	Very low	28.3	Very low	74 Å²	74	150.5 Å²	150.5	76%	0.763	78%	0.775	S	S	*	*			cis	149.1	117.2	2	0	0	0	0	0	111.8
1091	K	29.7	Very low	28.3	Very low	201 Å²	201	148.5 Å²	148.5	87%	0.874	77%	0.773	S	S	*	*			trans	141.2	89.3	160.1	-82.4	174.2	178.7	-178.4	0	111.9
1092	I	27.4	Very low	28	Very low	145 Å²	145	146.9 Å²	146.9	74%	0.744	77%	0.769	S	S	*	*				68.6	115.4	77.3	-54.8	169.1	0	0	0	112
1093	I	30.8	Very low	28.2	Very low	158 Å²	158	153.4 Å²	153.4	81%	0.81	78%	0.78	S	S	*	*				-148.2	106.2	70.4	-64.2	161.3	0	0	0	108.8
1094	T	25.9	Very low	28	Very low	102 Å²	102	145.2 Å²	145.2	63%	0.626	76%	0.762	S	S	*	*				48.1	111.4	87.1	62.2	0	0	0	0	118.4
1095	Y	27	Very low	28	Very low	228 Å²	228	143.2 Å²	143.2	89%	0.894	76%	0.761	S	S	*	*				-154.1	151.7	107.6	-98.8	-85.9	0	0	0	110
1096	P	27.9	Very low	27.8	Very low	89 Å²	89	143.7 Å²	143.7	58%	0.578	77%	0.765	S	S	*	*			trans	-120.1	-161.4	-148.2	36.1	-17.2	0	0	0	113
1097	D	26.7	Very low	27.3	Very low	135 Å²	135	142.1 Å²	142.1	72%	0.722	76%	0.761	S	S	*	*			trans	86.4	115.1	148	-68.3	-10.1	0	0	0	118.3
1098	V	27.4	Very low	27	Very low	121 Å²	121	138.4 Å²	138.4	73%	0.733	76%	0.755	S	S	*	*				97.9	126.3	63.9	163.5	0	0	0	0	110.4
1099	S	23	Very low	26.4	Very low	88 Å²	88	134.5 Å²	134.5	62%	0.615	75%	0.752	S	S	*	*			trans	-41.2	159.9	164.4	46.8	0	0	0	0	115.6
1100	N	24.2	Very low	25.8	Very low	146 Å²	146	131.9 Å²	131.9	78%	0.781	75%	0.746	S	S	*	*			trans	105.5	114.8	162.3	-61	-23.2	0	0	0	115.7
1101	S	26.7	Very low	25.5	Very low	107 Å²	107	134.7 Å²	134.7	75%	0.748	75%	0.749	S	S	*	*				167.4	104.1	111.4	44.3	0	0	0	0	108.5
1102	L	24.2	Very low	25.3	Very low	144 Å²	144	129 Å²	129	75%	0.754	74%	0.738	S	S	*	*				74.7	98.5	93.5	-74.2	158.9	0	0	0	112.4
1103	Y	26.3	Very low	25.1	Very low	238 Å²	238	128 Å²	128	93%	0.933	74%	0.739	S	S	*	*				-141.3	106.4	119.4	-96	-78.3	0	0	0	108.3
1104	S	22.7	Very low	24.8	Very low	88 Å²	88	125.5 Å²	125.5	62%	0.615	74%	0.736	S	S	*	*			trans	-55.4	151.4	157.9	42.5	0	0	0	0	110.6
1105	V	25	Very low	24.9	Very low	125 Å²	125	126 Å²	126	76%	0.758	74%	0.744	S	S	*	*				-177.4	114.9	118.7	165.9	0	0	0	0	108.8
1106	N	22.9	Very low	24.8	Very low	137 Å²	137	119.3 Å²	119.3	73%	0.733	74%	0.735	S	S	*	*			trans	38.5	117.5	139.9	-67	-11.9	0	0	0	120.1
1107	V	22	Very low	24.7	Very low	128 Å²	128	120.9 Å²	120.9	78%	0.776	74%	0.743	S	S	*	*				64.8	105.7	79.7	178.3	0	0	0	0	112.3
1108	S	24.2	Very low	24.5	Very low	103 Å²	103	121.1 Å²	121.1	72%	0.72	75%	0.745	S	S	*	*			trans	168	104	132.4	38.3	0	0	0	0	107.3
1109	S	22.3	Very low	24.3	Very low	107 Å²	107	119.2 Å²	119.2	75%	0.748	74%	0.735	S	S	*	*				62.8	103.7	85	71.8	0	0	0	0	113
1110	S	25.3	Very low	24.4	Very low	105 Å²	105	125.2 Å²	125.2	73%	0.734	75%	0.746	S	S	*	*			trans	173	101.8	131.8	34.9	0	0	0	0	107.3
1111	T	23.4	Very low	24.4	Very low	134 Å²	134	122 Å²	122	82%	0.822	74%	0.74	S	S	*	*				60.1	112.6	89.3	60.7	0	0	0	0	112
1112	A	25.1	Very low	24.3	Very low	80 Å²	80	124.2 Å²	124.2	66%	0.661	74%	0.743	S	S	*	*				172.5	112.2	108.9	0	0	0	0	0	108.2
1113	T	24.8	Very low	24.3	Very low	125 Å²	125	123.4 Å²	123.4	77%	0.767	74%	0.739	S	S	*	*				85.8	100.1	109.1	58.2	0	0	0	0	111.8
1114	S	24.1	Very low	24.3	Very low	106 Å²	106	119.8 Å²	119.8	74%	0.741	74%	0.736	S	S	*	*				84.6	115	76.5	75	0	0	0	0	112.1
1115	S	27.6	Very low	24.4	Very low	112 Å²	112	122.5 Å²	122.5	78%	0.783	74%	0.743	S	S	*	*			trans	165.3	102.6	130.6	56.6	0	0	0	0	105.5
1116	A	26.1	Very low	24.4	Very low	87 Å²	87	120.8 Å²	120.8	72%	0.719	74%	0.736	S	S	*	*				92.6	103	86	0	0	0	0	0	108.1
1117	V	24.6	Very low	24.5	Very low	122 Å²	122	124.5 Å²	124.5	74%	0.739	74%	0.741	S	S	*	*				78.5	131.8	71	170.5	0	0	0	0	109.6
1118	D	23.5	Very low	24.6	Very low	141 Å²	141	122.3 Å²	122.3	75%	0.754	73%	0.732	S	S	*	*			trans	80.5	143.3	162.9	-62.6	-18.4	0	0	0	118.3
1119	C	22.1	Very low	24.6	Very low	80 Å²	80	124.2 Å²	124.2	54%	0.541	73%	0.733	S	S	.	*			cis	177.2	167.8	-15.3	-110.1	0	0	0	0	105.6
1120	Y	25.1	Very low	25	Very low	215 Å²	215	127.9 Å²	127.9	84%	0.843	74%	0.738	S	S	*	*			trans	70.4	111.4	157.1	-62.8	-63.6	0	0	0	116.8
1121	A	24.4	Very low	25	Very low	79 Å²	79	131.1 Å²	131.1	65%	0.653	74%	0.742	S	S	*	*				88.4	153.6	64.7	0	0	0	0	0	113.2
1122	L	25.4	Very low	25.5	Very low	153 Å²	153	130.2 Å²	130.2	80%	0.801	74%	0.738	S	S	*	*			trans	95.9	96.6	168.7	-55.3	165.5	0	0	0	113.4
1123	N	24	Very low	25.6	Very low	127 Å²	127	133.4 Å²	133.4	68%	0.679	74%	0.739	S	S	*	*				62.5	108.2	80.6	-79.8	-11.9	0	0	0	112.4
1124	D	26.9	Very low	25.8	Very low	162 Å²	162	134.9 Å²	134.9	87%	0.866	74%	0.737	S	S	*	*			trans	-163.9	92.7	139.1	-87.5	-25.8	0	0	0	104.5
1125	L	23.6	Very low	26	Very low	144 Å²	144	135.4 Å²	135.4	75%	0.754	74%	0.736	S	S	*	*				44.3	110.5	73.2	-111.7	155.8	0	0	0	111.3
1126	S	24.3	Very low	25.9	Very low	90 Å²	90	135.4 Å²	135.4	63%	0.629	73%	0.731	S	S	*	*				131.2	141	126.7	75.4	0	0	0	0	116.2
1127	Y	26.6	Very low	25.9	Very low	214 Å²	214	140.9 Å²	140.9	84%	0.839	74%	0.739	S	S	*	*			trans	68.1	144.8	160.7	-67.6	-85.5	0	0	0	118.9
1128	S	24.3	Very low	25.8	Very low	82 Å²	82	141.8 Å²	141.8	57%	0.573	74%	0.739	S	S	*	*			cis	174.9	144.9	-19	52.6	0	0	0	0	107
1129	L	24.4	Very low	25.9	Very low	144 Å²	144	141 Å²	141	75%	0.754	74%	0.74	S	S	*	*			trans	43.6	115.1	136.6	-71.8	149.3	0	0	0	119.7
1130	H	29.5	Very low	26	Very low	184 Å²	184	143 Å²	143	85%	0.852	75%	0.753	S	S	*	*				-174.9	117.4	104.1	-90.5	-39.7	0	0	0	112.9
1131	Q	25.5	Very low	26.1	Very low	172 Å²	172	143.2 Å²	143.2	80%	0.804	75%	0.752	S	S	*	*			trans	-87.5	174.3	153.6	-76.6	-164.9	-24.5	0	0	109.8
1132	P	33	Very low	26.2	Very low	115 Å²	115	146.2 Å²	146.2	75%	0.747	76%	0.758	S	S	*	*				-134.4	127	112.8	23.9	-5.5	0	0	0	113.6
1133	Q	27.9	Very low	26.2	Very low	147 Å²	147	148 Å²	148	69%	0.687	76%	0.759	S	S	*	*				75.3	125.8	100.3	-64.9	-179.1	-5.9	0	0	113.9
1134	H	29.8	Very low	26.5	Very low	157 Å²	157	150.1 Å²	150.1	73%	0.727	77%	0.769	S	S	*	*				-163.5	140.3	66.2	-96.8	-79.9	0	0	0	115.3
1135	V	28.5	Very low	26.5	Very low	117 Å²	117	148.5 Å²	148.5	71%	0.709	77%	0.765	S	S	*	*			trans	72.6	99.1	140	-173.7	0	0	0	0	117.3
1136	V	24.3	Very low	27.1	Very low	111 Å²	111	147.2 Å²	147.2	67%	0.673	77%	0.765	S	S	*	*				66.1	106.2	62.1	-165.6	0	0	0	0	114.5
1137	F	26.2	Very low	27.3	Very low	203 Å²	203	146.9 Å²	146.9	89%	0.89	77%	0.767	S	S	*	*				-178.2	137.4	107.4	-111.5	-79.7	0	0	0	111.7
1138	N	23.2	Very low	27.4	Very low	141 Å²	141	144.3 Å²	144.3	75%	0.754	77%	0.768	S	S	*	*			trans	-105.4	164.2	-177.3	-131.4	-10.8	0	0	0	109.7
1139	T	24.5	Very low	27.8	Very low	125 Å²	125	147.4 Å²	147.4	77%	0.767	77%	0.773	S	S	*	*			trans	86.6	144.7	151.4	50	0	0	0	0	123.2
1140	C	25.6	Very low	28.2	Very low	121 Å²	121	148.3 Å²	148.3	82%	0.818	77%	0.773	S	S	*	*			trans	76.7	147.1	171.9	-64.8	0	0	0	0	117.7
1141	R	25.7	Very low	28.2	Very low	219 Å²	219	146.2 Å²	146.2	83%	0.826	77%	0.767	S	S	*	*			cis	-178.6	126.3	-18.7	175.9	179.2	-149	177	5.6	105.6
1142	N	26.1	Very low	28.5	Very low	143 Å²	143	143.5 Å²	143.5	77%	0.765	76%	0.764	S	S	*	*			trans	36	139.5	149.3	-70.6	-15.3	0	0	0	123.6
1143	K	25.4	Very low	28.2	Very low	191 Å²	191	143.9 Å²	143.9	83%	0.83	76%	0.764	S	S	*	*			trans	83.1	117.8	150.2	-71.8	174.1	177.4	-173.6	0	118.1
1144	I	30.5	Very low	28.3	Very low	171 Å²	171	143.9 Å²	143.9	88%	0.877	77%	0.774	S	S	*	*				168.9	111.4	116.1	-79.6	154.8	0	0	0	109.5
1145	T	26.9	Very low	28.1	Very low	128 Å²	128	141.7 Å²	141.7	79%	0.785	77%	0.772	S	S	*	*			trans	-74.1	-176.7	159.1	27.8	0	0	0	0	111.4
1146	P	36.4	Very low	28.2	Very low	116 Å²	116	142.1 Å²	142.1	75%	0.753	78%	0.775	S	S	*	*				-132.1	-171.8	-50.4	38.3	-20.1	0	0	0	111.5
1147	A	28.9	Very low	28.3	Very low	83 Å²	83	143.6 Å²	143.6	69%	0.686	78%	0.779	S	S	*	*			trans	133.7	131.3	144.4	0	0	0	0	0	116.5
1148	L	29.5	Very low	28.5	Very low	161 Å²	161	141.4 Å²	141.4	84%	0.843	78%	0.776	S	S	*	*			trans	161.4	96.5	134.9	-85.5	156.9	0	0	0	108
1149	H	32.9	Very low	28.7	Very low	147 Å²	147	143.1 Å²	143.1	68%	0.681	77%	0.773	S	S	*	*				64.9	126	91	-88.7	-75.4	0	0	0	112.1
1150	E	31.3	Very low	28.8	Very low	163 Å²	163	143.5 Å²	143.5	76%	0.762	77%	0.77	S	S	*	*			cis	-165.5	133.4	39.5	-98.6	156.6	-172	0	0	109.7
1151	I	29.3	Very low	29.1	Very low	140 Å²	140	143.4 Å²	143.4	72%	0.718	77%	0.766	S	S	*	*				76.8	139	85.6	-65.6	179.4	0	0	0	114.7
1152	P	32.9	Very low	29.2	Very low	114 Å²	114	138.4 Å²	138.4	74%	0.74	76%	0.76	S	S	*	*			cis	-145.3	-173.6	-36.8	43.1	-21.2	0	0	0	114.6
1153	T	26.2	Very low	29.4	Very low	124 Å²	124	137.8 Å²	137.8	76%	0.761	76%	0.756	S	S	*	*			trans	-60.4	149.8	172.2	46	0	0	0	0	118.1
1154	V	29.9	Very low	29.7	Very low	146 Å²	146	134.2 Å²	134.2	89%	0.885	75%	0.747	S	S	*	*			trans	-138.7	123.1	148.2	178.9	0	0	0	0	111.3
1155	T	25.7	Very low	29.5	Very low	112 Å²	112	135.6 Å²	135.6	69%	0.687	75%	0.746	S	S	*	*			trans	-84	158.1	172	42.5	0	0	0	0	113
1156	T	30.7	Very low	29.5	Very low	125 Å²	125	132.9 Å²	132.9	77%	0.767	74%	0.744	S	S	*	*			trans	149.5	111	134.3	46.9	0	0	0	0	111.1
1157	N	26.9	Very low	28.9	Very low	142 Å²	142	132.4 Å²	132.4	76%	0.759	74%	0.743	S	S	*	*				57.3	118.6	90.2	-81.6	-7.7	0	0	0	115.3
1158	L	29.1	Very low	28.7	Very low	157 Å²	157	136.3 Å²	136.3	82%	0.822	75%	0.751	S	S	*	*				-177.9	107.7	126.6	-90.4	138.6	0	0	0	110.9
1159	Y	28.2	Very low	28.4	Very low	178 Å²	178	134.1 Å²	134.1	70%	0.698	75%	0.749	S	S	*	*				85	111	97.2	-90.1	-90.1	0	0	0	114.3
1160	N	26.3	Very low	28.1	Very low	132 Å²	132	137 Å²	137	71%	0.706	76%	0.76	S	S	*	*				66.7	128.3	111.5	-76.5	0.9	0	0	0	114.5
1161	T	31.5	Very low	27.6	Very low	120 Å²	120	133.8 Å²	133.8	74%	0.736	76%	0.755	S	S	*	*				-170.7	143.1	62.3	34.2	0	0	0	0	112.4
1162	T	27.6	Very low	27.4	Very low	113 Å²	113	136.5 Å²	136.5	69%	0.693	76%	0.757	S	S	*	*			trans	19.3	136.1	137.4	59.6	0	0	0	0	119.2
1163	D	31.3	Very low	27.2	Very low	130 Å²	130	136 Å²	136	70%	0.695	75%	0.749	S	S	*	*				-178.2	153.1	56.3	-116.8	-22.2	0	0	0	113.7
1164	N	31.1	Very low	27.2	Very low	117 Å²	117	138.8 Å²	138.8	63%	0.626	75%	0.75	S	S	*	*			trans	67.3	104.8	145.8	-69.8	-40.2	0	0	0	124.8
1165	K	26	Very low	26.9	Very low	200 Å²	200	137.2 Å²	137.2	87%	0.87	74%	0.744	S	S	*	*				50.6	117.5	121.9	-67.3	179	179.2	174.5	0	120
1166	G	27.3	Very low	27	Very low	71 Å²	71	140.5 Å²	140.5	73%	0.732	75%	0.75	S	S	*	*			trans	164.3	86.5	155.3	0	0	0	0	0	115.5
1167	S	25.1	Very low	26.8	Very low	106 Å²	106	139.8 Å²	139.8	74%	0.741	75%	0.745	S	S	*	*			trans	40.2	113.9	148.6	58.2	0	0	0	0	121.9
1168	I	23.5	Very low	26.8	Very low	165 Å²	165	139.4 Å²	139.4	85%	0.846	74%	0.743	S	S	*	*				61.5	103.3	126.5	-55.1	166.2	0	0	0	117.9
1169	S	23.9	Very low	26.6	Very low	115 Å²	115	138.2 Å²	138.2	80%	0.804	74%	0.737	S	S	*	*			trans	130.9	103.2	143.6	75.8	0	0	0	0	111.4
1170	K	25.4	Very low	26.6	Very low	208 Å²	208	140 Å²	140	90%	0.904	74%	0.742	S	S	*	*			trans	-132.4	101.5	172.1	-92.8	-173.9	177.1	-179	0	110.5
1171	S	22.5	Very low	26.6	Very low	95 Å²	95	140 Å²	140	66%	0.664	74%	0.742	S	S	*	*			trans	-61.4	163.5	131.3	-169.1	0	0	0	0	110
1172	Y	24.8	Very low	26.3	Very low	196 Å²	196	142 Å²	142	77%	0.769	75%	0.745	S	S	*	*			trans	98.4	108.4	165.9	-72	-81	0	0	0	120.9
1173	D	26.9	Very low	26.4	Very low	105 Å²	105	144.1 Å²	144.1	56%	0.561	75%	0.752	S	S	*	*				84.4	130.3	113.8	-89.1	7.1	0	0	0	124.9
1174	K	26.3	Very low	26.2	Very low	181 Å²	181	143 Å²	143	79%	0.787	75%	0.754	S	S	*	*				60.7	134.2	129.8	-71.4	173.6	-178.9	134.3	0	121.1
1175	C	24.2	Very low	26.2	Very low	113 Å²	113	143 Å²	143	76%	0.764	76%	0.761	S	S	*	*				-163.2	151.3	117	-130	0	0	0	0	114.5
1176	F	27.8	Very low	26.2	Very low	182 Å²	182	140.1 Å²	140.1	80%	0.798	76%	0.76	S	S	*	*			trans	98.8	68.2	162.9	-76.8	-80.2	0	0	0	122.4
1177	V	27.3	Very low	26.3	Very low	110 Å²	110	143.1 Å²	143.1	67%	0.667	76%	0.764	S	S	*	*				30.6	117.9	100	-179.8	0	0	0	0	118.9
1178	N	26.3	Very low	26.2	Very low	134 Å²	134	145.9 Å²	145.9	72%	0.717	77%	0.769	S	S	*	*				178	135.6	101.5	-112	-21.2	0	0	0	115.9
1179	L	24.9	Very low	26.3	Very low	132 Å²	132	141.1 Å²	141.1	69%	0.691	76%	0.761	S	S	*	*			trans	83	103.8	138	-71.8	160.3	0	0	0	122
1180	W	27.8	Very low	26.3	Very low	216 Å²	216	144.4 Å²	144.4	82%	0.818	76%	0.763	S	S	*	*			trans	133	94	130	-82	36.2	0	0	0	117
1181	N	27.4	Very low	26.3	Very low	132 Å²	132	140 Å²	140	71%	0.706	75%	0.754	S	S	*	*				49.9	109.7	128.9	-67.8	-0.3	0	0	0	119.8
1182	M	24.9	Very low	26.5	Very low	162 Å²	162	141 Å²	141	80%	0.798	76%	0.756	S	S	*	*				82.2	104.4	83.2	-80.3	-152.1	160.2	0	0	112.5
1183	D	29.9	Very low	26.6	Very low	156 Å²	156	138.4 Å²	138.4	83%	0.834	76%	0.756	S	S	*	*				171.6	130.3	102.2	-85.6	-29.6	0	0	0	112.5
1184	S	25.9	Very low	26.4	Very low	106 Å²	106	137.9 Å²	137.9	74%	0.741	76%	0.76	S	S	*	*			trans	-111.9	152.4	163.5	55.5	0	0	0	0	108.3
1185	P	32.9	Very low	26.4	Very low	117 Å²	117	136.2 Å²	136.2	76%	0.76	76%	0.759	S	S	*	*			trans	-138	120.4	141	29.7	-11.9	0	0	0	113.6
1186	T	24.3	Very low	26.5	Very low	140 Å²	140	138.4 Å²	138.4	86%	0.859	76%	0.758	S	S	*	*			trans	-56.5	124.9	144	34.4	0	0	0	0	110.3
1187	V	29.4	Very low	26.4	Very low	135 Å²	135	135.2 Å²	135.2	82%	0.818	75%	0.754	S	S	*	*			trans	-140.4	127.9	155	-178.8	0	0	0	0	111
1188	I	24.6	Very low	26.4	Very low	163 Å²	163	137.7 Å²	137.7	84%	0.836	76%	0.756	S	S	*	*			trans	-69.3	136.2	170.9	-69.3	158.4	0	0	0	109.8
1189	G	24.1	Very low	26.5	Very low	66 Å²	66	140.5 Å²	140.5	68%	0.68	76%	0.757	S	S	*	*			trans	85.6	124	141	0	0	0	0	0	119.3
1190	Q	25.6	Very low	26.4	Very low	183 Å²	183	140.4 Å²	140.4	86%	0.855	76%	0.757	S	S	*	*			trans	88.9	103.1	142.9	-67.1	-174.2	-19.7	0	0	120.6
1191	T	24.7	Very low	26.3	Very low	115 Å²	115	136 Å²	136	71%	0.706	75%	0.748	S	S	*	*				70.5	115.5	126.8	54.3	0	0	0	0	121.7
1192	T	25.6	Very low	26.4	Very low	116 Å²	116	138.4 Å²	138.4	71%	0.712	76%	0.755	S	S	*	*			trans	84	115.3	131.2	54.4	0	0	0	0	121.2
1193	N	26.9	Very low	26.5	Very low	142 Å²	142	141 Å²	141	76%	0.759	76%	0.758	S	S	*	*			trans	83.5	100.6	130.7	-71.5	-0	0	0	0	121
1194	S	23.9	Very low	26.5	Very low	94 Å²	94	139 Å²	139	66%	0.657	75%	0.753	S	S	*	*				78.5	131.7	111.5	73.5	0	0	0	0	120.9
1195	L	26.3	Very low	26.8	Very low	146 Å²	146	146 Å²	146	76%	0.764	77%	0.773	S	S	*	*			trans	74.6	138.3	156.7	-57.3	146.6	0	0	0	113.6
1196	E	27	Very low	26.5	Very low	160 Å²	160	147.4 Å²	147.4	75%	0.748	77%	0.774	S	S	*	*			cis	-167.5	149.8	10.6	-126.3	169.1	-169.9	0	0	107.9
1197	T	24.9	Very low	26.6	Very low	114 Å²	114	147.8 Å²	147.8	70%	0.699	77%	0.769	S	S	*	*			trans	0.8	133.2	156.1	53.5	0	0	0	0	120.7
1198	K	27.3	Very low	26.5	Very low	163 Å²	163	148.5 Å²	148.5	71%	0.709	77%	0.767	S	S	*	*				164.2	129.2	111.3	-96.6	173.9	177.5	172.5	0	114.3
1199	Y	27.7	Very low	26.6	Very low	192 Å²	192	147.6 Å²	147.6	75%	0.753	76%	0.763	S	S	*	*			trans	63.5	148.7	148.2	-61.6	-55.2	0	0	0	117.8
1200	L	24.5	Very low	26.7	Very low	131 Å²	131	152.8 Å²	152.8	69%	0.686	77%	0.768	S	S	*	*			cis	-171.3	153	-9.4	-125.8	151.7	0	0	0	103.6
1201	I	25.6	Very low	26.8	Very low	123 Å²	123	150.7 Å²	150.7	63%	0.631	76%	0.762	S	S	*	*			trans	92.2	124.3	146.8	-60.8	158.8	0	0	0	120
1202	Q	28.2	Very low	27	Very low	183 Å²	183	153.3 Å²	153.3	86%	0.855	77%	0.766	S	S	*	*			trans	87.5	106.3	147.4	-83.1	155.8	0.4	0	0	122.1
1203	Y	26.6	Very low	27.1	Very low	217 Å²	217	156.2 Å²	156.2	85%	0.851	77%	0.77	S	S	*	*			trans	-53.4	155.4	151.4	-82.7	-83.1	0	0	0	112.3
1204	P	30.6	Very low	27.1	Very low	112 Å²	112	157.3 Å²	157.3	73%	0.727	77%	0.771	S	S	*	*				-153	138.5	70.3	37	-15.5	0	0	0	118
1205	H	32.4	Very low	27.4	Very low	253 Å²	253	163.1 Å²	163.1	100%	1.171	78%	0.781	S	S	*	*				-175.8	0	124.2	-106.5	-58.3	0	0	0	112.7

Retrieved 1,205 of 1,205 residues in 1796.5 ms (Link to these results)

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