A0A3Q0KVE5_SCHMA Loading...

RNA helicase AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KVE5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 975 aa.

						>A0A3Q0KVE5_SCHMA|A0A3Q0KVE5
MIRPFKVIRESAECICLRHPHEMKAVSKKPANQSELLQTRQSLPVWKHKDVLIDTIMKSEHCVIVGSTGSGKTTQIPQFLYEKNLTNEGIIAITQPRRVAAISIALRVADEMDRGPVGIGPVGYSVRFEDMSSDKSTHLKYMTDGMLLREAILDPNLSRYRFIILDEAHERSLNTDILFGVVLSAAKRRSKLHSLRENPNNSLLPSKLNGIRKDIQNNKTFLPLLKIIVMSATIDPTPFLNFLGPDHTQVVYIEGRRHPIKILNVSQSLTDYVADAASVCIRIHNSKNSPLDRGILIFLTGEEEIMRCCSLIKQLSHSTNIDQMNSIKNGLAVFPLFSSLPQIQQLKALNFCDNNQRKVIVSTNLAETSITIPGIRYVIDCGRAKIKDWDPKTGFECLRVQWISKGQAWQRSGRAGREAAGVCLRLYTDSEYKNMPLQPRPQILQAPLSGVLLNLVSMNIKNPTEFPWLSSPKPSSIEAGIKLLLQLGAVVVNDDEAEPLSSKCAQEAITSTDSNELNDSVKIPYPLSLTVLGRLMSAFPLEPRFSRTLISAAYLGCLIEILSIISMLYVCPVFYVPVEKRNEFSDVQSRFRHPSGDLVSLLLVYRGFVKATKDARSQKSINSKNHSQSTIDSSIQSPSKCKMSKRNSKIQWCRANFINRSRLETAVRVRGQLKQIAQSIGLTDYMHSCGTNVEKIVQAFLLSGFQDQVVILSELSKSYKGGDTQRLVKNSHHPIYVHGKTINLSTNSPQELLIHPESQLYTSSLNNPPPCLLFIEAVTSSEYKFQSNNPIEQNDRVFMRHVSIIDQSWLSLIENIPKSIMNTNSYLPNQTNRKLSLKMKITSSNFEQTPSNKKRRTINNSDDNHNVNDNSNDKLTSFQPTSNDTTPNNNNMNNSSTTIHINNTLFTNCNGLIKSEYINRLSEKSMCTQLSRSQKRRLAKRRKRNLTLPFVNNNNTNTTTNNNTTDNNNSSNNTH
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	32.6	Very low	32	Very low	248 Å²	248	161.7 Å²	161.7	100%	1.222	79%	0.787	S	S	*	*				0	101.4	0	-74.7	-179.3	-179	0	0	108.3
2	I	31.4	Very low	31.8	Very low	150 Å²	150	156.6 Å²	156.6	77%	0.769	79%	0.791	S	S	*	*			trans	-113.4	115.1	-174.9	-60.5	170.8	0	0	0	106.7	F5	I2-F5 HydrophobicContact CG2-CE2 3.86Å
3	R	34.8	Very low	31.4	Very low	227 Å²	227	159.5 Å²	159.5	86%	0.857	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68.1	151.1	174.8	-75.2	-177.5	177.7	-174.9	-0.1	110.3
4	P	38.3	Very low	30.9	Very low	129 Å²	129	156.4 Å²	156.4	84%	0.838	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-75.8	137.6	-161.8	29.8	-33.2	0	0	0	113.1
5	F	34.2	Very low	30.7	Very low	125 Å²	125	157 Å²	157	55%	0.548	80%	0.802	S	S	.	*	P	Polyproline II helix	trans	-76	131.2	175.4	-69.9	-85.9	0	0	0	111.2	I2 V7	I2-F5 HydrophobicContact CG2-CE2 3.86Å; F5-V7 PolarHBondContact O-N 3.19Å
6	K	33.6	Very low	30.2	Very low	177 Å²	177	154.2 Å²	154.2	77%	0.77	80%	0.799	S	S	*	*			trans	-86.3	98.4	174.2	-155	175.1	-172.6	178.7	0	109.5	I8	K6-I8 HydrophobicContact CG-CG1 4.31Å
7	V	30	Very low	30	Very low	107 Å²	107	154.5 Å²	154.5	65%	0.648	80%	0.801	S	S	*	*			trans	-101	120.8	167.8	178.8	0	0	0	0	107.1	F5 R9	F5-V7 PolarHBondContact O-N 3.19Å; V7-R9 HydrophobicContact CG1-CG 4.37Å
8	I	33.7	Very low	30.2	Very low	109 Å²	109	159.2 Å²	159.2	56%	0.559	81%	0.807	S	S	*	*			trans	-110.6	111.5	175.4	-55.8	175.8	0	0	0	106.7	K6	K6-I8 HydrophobicContact CG-CG1 4.31Å
9	R	26	Very low	30.3	Very low	210 Å²	210	160.5 Å²	160.5	79%	0.792	81%	0.809	S	S	*	*			trans	-102.2	134.8	171.7	-76.9	179.1	172.9	173.7	-1.7	107.8	V7	V7-R9 HydrophobicContact CG1-CG 4.37Å
10	E	31.4	Very low	30.4	Very low	181 Å²	181	158.4 Å²	158.4	85%	0.846	81%	0.807	S	S	*	*			trans	-154.6	128.8	156.2	-114.6	168.2	-156	0	0	110.5
11	S	26.1	Very low	30.5	Very low	116 Å²	116	158.9 Å²	158.9	81%	0.811	81%	0.806	S	S	*	*			trans	-70.1	141.4	-178.2	45.6	0	0	0	0	112.7
12	A	30	Very low	30.4	Very low	100 Å²	100	155 Å²	155	83%	0.826	79%	0.785	S	S	*	*			trans	-152.8	129.6	154.3	0	0	0	0	0	111.4
13	E	26.2	Very low	30.4	Very low	194 Å²	194	157.2 Å²	157.2	91%	0.907	79%	0.794	S	S	*	*			trans	-79.5	170.4	-177.1	-67.9	175.4	138.2	0	0	113.8
14	C	23.6	Very low	30.2	Very low	117 Å²	117	155.6 Å²	155.6	79%	0.791	79%	0.793	S	S	*	*			trans	-25.3	153.1	177	-71.5	0	0	0	0	120.3
15	I	28.5	Very low	29.7	Very low	165 Å²	165	154.6 Å²	154.6	85%	0.846	80%	0.796	S	S	*	*				-176.3	130.9	102.4	-84.2	152	0	0	0	109.9
16	C	23.5	Very low	29.6	Very low	112 Å²	112	153.5 Å²	153.5	76%	0.757	80%	0.799	S	S	*	*			trans	-87.5	179.3	170.3	-70.7	0	0	0	0	111.7
17	L	26.9	Very low	29.3	Very low	160 Å²	160	150.9 Å²	150.9	84%	0.838	80%	0.803	S	S	*	*			trans	107.1	126	174.4	-55.7	168.5	0	0	0	110.6
18	R	32.4	Very low	29.3	Very low	238 Å²	238	153.6 Å²	153.6	90%	0.898	81%	0.806	S	S	*	*			cis	-154.7	166.7	36.1	-69	179.3	-177.3	-178.4	-0.6	112.7
19	H	32.5	Very low	29.2	Very low	185 Å²	185	158.6 Å²	158.6	86%	0.856	82%	0.824	S	S	*	*			trans	-64.7	160.9	-178.2	-77.4	-23.4	0	0	0	117.1
20	P	31.5	Very low	29.7	Very low	117 Å²	117	153.5 Å²	153.5	76%	0.76	82%	0.818	S	S	*	*			trans	-96.3	144.7	178.1	37.2	-28.9	0	0	0	112.5
21	H	34.3	Very low	30.4	Very low	170 Å²	170	148.1 Å²	148.1	79%	0.787	80%	0.804	S	S	*	*			trans	-131.5	131.8	161.4	-105.6	-90.1	0	0	0	110.1
22	E	29.4	Very low	32.2	Very low	165 Å²	165	147.6 Å²	147.6	77%	0.771	79%	0.792	S	S	*	*			trans	53	119.7	154.9	-61	-174.1	146.6	0	0	119.1
23	M	31.8	Very low	34	Very low	197 Å²	197	147.7 Å²	147.7	97%	0.97	78%	0.776	S	S	*	*				-155.6	127.2	127.9	-85.3	-138.6	162.6	0	0	112.7
24	K	30.6	Very low	36.2	Very low	194 Å²	194	141.8 Å²	141.8	84%	0.843	76%	0.756	S	S	*	*			trans	-65.5	155.5	173.2	-71.6	167	175.4	168.5	0	111.6	V26	K24-V26 PolarHBondContact O-N 3.38Å
25	A	27.3	Very low	38.9	Very low	107 Å²	107	141.9 Å²	141.9	88%	0.884	75%	0.745	S	S	*	*			trans	-49.6	113.9	177.1	0	0	0	0	0	113.3
26	V	31.5	Very low	41.4	Very low	103 Å²	103	135.1 Å²	135.1	62%	0.624	71%	0.71	S	S	*	*			trans	-139.3	129.3	161.9	-177.8	0	0	0	0	108.2	K24 K28	K24-V26 PolarHBondContact O-N 3.38Å; V26-K28 HydrophobicContact CG1-CG 4.36Å; V26-K28 PolarHBondContact O-N 3.38Å
27	S	28.4	Very low	44.3	Very low	121 Å²	121	133.5 Å²	133.5	85%	0.846	69%	0.694	S	S	*	*			trans	-46.6	99.1	166.4	49.3	0	0	0	0	112.4
28	K	28.8	Very low	47.2	Very low	165 Å²	165	132 Å²	132	72%	0.717	68%	0.682	S	S	*	*			trans	-144.4	102.7	172.9	-76.3	-173.3	177.7	178.1	0	112.2	V26	V26-K28 HydrophobicContact CG1-CG 4.36Å; V26-K28 PolarHBondContact O-N 3.38Å
29	K	32.3	Very low	49.6	Very low	214 Å²	214	122.8 Å²	122.8	93%	0.93	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	105.7	140.4	-74.8	-179.9	170.8	-172.5	0	104
30	P	37.8	Very low	52.3	Low	103 Å²	103	114.8 Å²	114.8	67%	0.669	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn		-155.8	33.8	76.3	38.1	-13.7	0	0	0	115.4	N32	P30-N32 VanDerWaalsContact C-N 3.34Å; P30-N32 PolarHBondContact O-N 3.31Å
31	A	44.6	Very low	55.1	Low	67 Å²	67	113.6 Å²	113.6	55%	0.554	60%	0.599	S	S	*	*	S	Bend	trans	-77.5	-13.5	-176.6	0	0	0	0	0	115
32	N	64	Low	57.6	Low	105 Å²	105	108.9 Å²	108.9	56%	0.561	59%	0.585	S	S	*	*	H	α-helix	trans	-85.8	-22.3	-166.6	-150.6	1.8	0	0	0	114	P30 L36	P30-N32 VanDerWaalsContact C-N 3.34Å; P30-N32 PolarHBondContact O-N 3.31Å; N32-L36 WeakPolarHBondContact O-CB 3.32Å; N32-L36 WeakPolarHBondContact O-CG 3.46Å; N32-L36 PolarHBondContact O-N 3.37Å; N32-L36 VanDerWaalsContact O-N 3.1Å
33	Q	68.4	Low	60.3	Low	103 Å²	103	101.8 Å²	101.8	48%	0.481	55%	0.552	S	S	.	*	H	α-helix	trans	-76.5	-41.2	-172.8	-74.3	-179.5	8.9	0	0	113.7	E35 L36 L37 D113	Q33-E35 VanDerWaalsContact C-N 3.33Å; Q33-L36 PolarHBondContact O-N 2.97Å; Q33-L37 WeakPolarHBondContact O-CB 3.48Å; Q33-L37 PolarHBondContact O-N 3.18Å; Q33-D113 PolarHBondContact NE2-OD1 3.44Å; Q33-D113 PolarHBondContact NE2-OD2 3.32Å
34	S	72.9	Confident	63	Low	70 Å²	70	93.5 Å²	93.5	49%	0.49	51%	0.513	S	S	.	.	H	α-helix	trans	-63.1	-42	177.1	50.3	0	0	0	0	111.1	L37 Q38	S34-L37 PolarHBondContact O-N 2.86Å; S34-Q38 WeakPolarHBondContact O-CG 3.4Å; S34-Q38 PolarHBondContact O-N 3.14Å
35	E	80.3	Confident	65.8	Low	119 Å²	119	84.2 Å²	84.2	56%	0.556	47%	0.473	S	S	*	.	H	α-helix	trans	-63.6	-42.6	175.6	-170.2	-179.9	176.5	0	0	111.9	Q33 Q38 T39	Q33-E35 VanDerWaalsContact C-N 3.33Å; E35-Q38 PolarHBondContact O-N 3.44Å; E35-T39 WeakPolarHBondContact O-CB 3.46Å; E35-T39 PolarHBondContact O-N 2.99Å; E35-T39 PolarHBondContact O-OG1 3.43Å
36	L	81.1	Confident	68.9	Low	23 Å²	23	82 Å²	82	12%	0.12	44%	0.442	C	S	.	.	H	α-helix	trans	-63.3	-41.5	174.3	-75	171.6	0	0	0	111.8	N32 Q33 T39 R40	N32-L36 WeakPolarHBondContact O-CB 3.32Å; N32-L36 WeakPolarHBondContact O-CG 3.46Å; N32-L36 PolarHBondContact O-N 3.37Å; N32-L36 VanDerWaalsContact O-N 3.1Å; Q33-L36 PolarHBondContact O-N 2.97Å; L36-T39 WeakPolarHBondContact O-CB 3.46Å; L36-T39 PolarHBondContact O-N 3.31Å; L36-R40 WeakPolarHBondContact O-CG 3.49Å; L36-R40 PolarHBondContact O-N 3.36Å
37	L	84.6	Confident	71.7	Confident	78 Å²	78	85.6 Å²	85.6	41%	0.408	45%	0.449	S	S	.	.	H	α-helix	trans	-65	-44.8	177.3	-174.5	65.3	0	0	0	111.7	Q33 S34 T39 R40 Q41	Q33-L37 WeakPolarHBondContact O-CB 3.48Å; Q33-L37 PolarHBondContact O-N 3.18Å; S34-L37 PolarHBondContact O-N 2.86Å; L37-T39 VanDerWaalsContact C-N 3.26Å; L37-T39 PolarHBondContact O-N 3.09Å; L37-R40 WeakPolarHBondContact O-CB 3.22Å; L37-R40 PolarHBondContact O-N 3.17Å; L37-R40 VanDerWaalsContact O-N 3.12Å; L37-Q41 WeakPolarHBondContact O-CG 3.36Å; L37-Q41 PolarHBondContact O-N 3.21Å
38	Q	86	Confident	74.6	Confident	128 Å²	128	83.6 Å²	83.6	60%	0.598	43%	0.426	S	S	*	.	H	α-helix	trans	-60.1	-39.1	173	-72.2	174.5	-0	0	0	111.4	S34 E35 R40 Q41 S42	S34-Q38 WeakPolarHBondContact O-CG 3.4Å; S34-Q38 PolarHBondContact O-N 3.14Å; E35-Q38 PolarHBondContact O-N 3.44Å; Q38-R40 VanDerWaalsContact C-N 3.33Å; Q38-R40 PolarHBondContact O-N 3.43Å; Q38-Q41 PolarHBondContact O-N 3.19Å; Q38-S42 WeakPolarHBondContact O-CB 3.02Å; Q38-S42 PolarHBondContact O-N 2.92Å; Q38-S42 PolarHBondContact O-OG 3.16Å
39	T	83.8	Confident	77.7	Confident	44 Å²	44	77.7 Å²	77.7	27%	0.27	40%	0.4	S	S	.	.	H	α-helix	trans	-64.1	-37.2	175	-59.1	0	0	0	0	111.9	E35 L36 L37 S42 R257	E35-T39 WeakPolarHBondContact O-CB 3.46Å; E35-T39 PolarHBondContact O-N 2.99Å; E35-T39 PolarHBondContact O-OG1 3.43Å; L36-T39 WeakPolarHBondContact O-CB 3.46Å; L36-T39 PolarHBondContact O-N 3.31Å; L37-T39 VanDerWaalsContact C-N 3.26Å; L37-T39 PolarHBondContact O-N 3.09Å; T39-S42 WeakPolarHBondContact CA-OG 3.47Å; T39-S42 PolarHBondContact O-OG 3.41Å; T39-R257 PolarHBondContact O-NH2 2.88Å
40	R	88.6	Confident	80.6	Confident	17 Å²	17	71.5 Å²	71.5	6%	0.064	38%	0.378	C	S	.	.	H	α-helix	trans	-68.2	-47.3	174.7	-71	175.2	68.4	-167.9	-5.9	111.3	L36 L37 Q38 S42 L43 W46 E82 E111	L36-R40 WeakPolarHBondContact O-CG 3.49Å; L36-R40 PolarHBondContact O-N 3.36Å; L37-R40 WeakPolarHBondContact O-CB 3.22Å; L37-R40 PolarHBondContact O-N 3.17Å; L37-R40 VanDerWaalsContact O-N 3.12Å; Q38-R40 VanDerWaalsContact C-N 3.33Å; Q38-R40 PolarHBondContact O-N 3.43Å; R40-S42 VanDerWaalsContact C-N 3.26Å; R40-S42 PolarHBondContact O-N 3.38Å; R40-L43 WeakPolarHBondContact O-CB 3.23Å; R40-L43 PolarHBondContact O-N 3Å; R40-W46 HydrophobicContact CB-CE3 4.18Å; R40-W46 HydrophobicContact CB-CZ3 4.03Å; R40-E82 IonicContact CZ-OE1 3.92Å; R40-E82 IonicContact NH1-OE1 3.39Å; R40-E82 IonicContact NH2-OE1 3.53Å; R40-E82 PolarHBondContact NH2-OE1 3.24Å; R40-E111 HydrophobicContact CG-CG 4.28Å; R40-E111 PolarHBondContact NH1-O 3.21Å
41	Q	90	Very high	83.3	Confident	93 Å²	93	70.6 Å²	70.6	44%	0.435	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-30.2	-178.5	-72.2	177.9	-3.4	0	0	113.3	L37 Q38 L43 W46	L37-Q41 WeakPolarHBondContact O-CG 3.36Å; L37-Q41 PolarHBondContact O-N 3.21Å; Q38-Q41 PolarHBondContact O-N 3.19Å; Q41-L43 VanDerWaalsContact C-N 3.28Å; Q41-L43 PolarHBondContact O-N 3.11Å; Q41-W46 HydrophobicContact CB-CD2 4.4Å; Q41-W46 HydrophobicContact CB-CG 4.49Å; Q41-W46 HydrophobicContact CG-CD2 4.09Å; Q41-W46 HydrophobicContact CG-CH2 4.17Å; Q41-W46 HydrophobicContact CG-CZ2 3.63Å
42	S	87	Confident	85.6	Confident	71 Å²	71	67.5 Å²	67.5	50%	0.497	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-1.5	175.6	56	0	0	0	0	114	Q38 T39 R40 R257	Q38-S42 WeakPolarHBondContact O-CB 3.02Å; Q38-S42 PolarHBondContact O-N 2.92Å; Q38-S42 PolarHBondContact O-OG 3.16Å; T39-S42 WeakPolarHBondContact CA-OG 3.47Å; T39-S42 PolarHBondContact O-OG 3.41Å; R40-S42 VanDerWaalsContact C-N 3.26Å; R40-S42 PolarHBondContact O-N 3.38Å; S42-R257 PolarHBondContact O-NE 3.06Å; S42-R257 PolarHBondContact O-NH2 3.28Å; S42-R257 VanDerWaalsContact O-NH2 3.11Å; S42-R257 PolarHBondContact OG-NH2 3.17Å
43	L	86.5	Confident	87.1	Confident	15 Å²	15	62.8 Å²	62.8	8%	0.079	32%	0.319	C	S	.	.	S	Bend	trans	-75.1	139.2	177.6	-72.9	166.3	0	0	0	109.7	R40 Q41 V45 W46 Q75 R257	R40-L43 WeakPolarHBondContact O-CB 3.23Å; R40-L43 PolarHBondContact O-N 3Å; Q41-L43 VanDerWaalsContact C-N 3.28Å; Q41-L43 PolarHBondContact O-N 3.11Å; L43-V45 HydrophobicContact CB-CG1 4.25Å; L43-V45 PolarHBondContact O-N 2.7Å; L43-V45 VanDerWaalsContact O-N 3.13Å; L43-W46 VanDerWaalsContact O-CB 3.24Å; L43-W46 WeakPolarHBondContact O-CB 3.42Å; L43-W46 PolarHBondContact O-N 3.17Å; L43-Q75 HydrophobicContact CD1-CG 3.41Å; L43-Q75 VanDerWaalsContact CD1-CG 3.41Å; L43-R257 VanDerWaalsContact CA-NH2 3.27Å
44	P	87.8	Confident	88.4	Confident	23 Å²	23	61.8 Å²	61.8	15%	0.149	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-52.1	-38.6	179.4	-30	35.5	0	0	0	114.4	W46 I253 E254 R257	P44-W46 PolarHBondContact O-N 3.34Å; P44-I253 HydrophobicContact CB-CG2 4.27Å; P44-E254 WeakPolarHBondContact CB-O 3.47Å; P44-R257 HydrophobicContact CG-CG 4.31Å
45	V	91.2	Very high	89.4	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-65.3	-23	178.6	71.1	0	0	0	0	113.9	L43 K47 H48 L52 S70 Q75 I76 F79 I253	L43-V45 HydrophobicContact CB-CG1 4.25Å; L43-V45 PolarHBondContact O-N 2.7Å; L43-V45 VanDerWaalsContact O-N 3.13Å; V45-K47 PolarHBondContact O-N 3.32Å; V45-H48 PolarHBondContact O-N 2.99Å; V45-L52 HydrophobicContact CG2-CD2 4Å; V45-S70 WeakPolarHBondContact CB-O 3.38Å; V45-S70 VanDerWaalsContact CG1-O 3.3Å; V45-S70 WeakPolarHBondContact CG1-O 3.47Å; V45-S70 PolarHBondContact N-O 3.32Å; V45-Q75 HydrophobicContact CG1-CB 3.69Å; V45-Q75 HydrophobicContact CG1-CG 3.8Å; V45-I76 HydrophobicContact CG2-CD1 4.25Å; V45-I76 HydrophobicContact CG2-CG1 3.99Å; V45-F79 HydrophobicContact CG1-CE2 4.36Å; V45-F79 HydrophobicContact CG2-CE2 4.22Å; V45-I253 HydrophobicContact CB-CD1 4.24Å; V45-I253 HydrophobicContact CB-CG2 4.42Å; V45-I253 HydrophobicContact CG2-CD1 3.67Å
46	W	92	Very high	90.1	Very high	60 Å²	60	54.4 Å²	54.4	23%	0.227	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-63.5	-41.6	-175.2	-175.4	-86.7	0	0	0	112.4	R40 Q41 L43 P44 H48 K49 F79	R40-W46 HydrophobicContact CB-CE3 4.18Å; R40-W46 HydrophobicContact CB-CZ3 4.03Å; Q41-W46 HydrophobicContact CB-CD2 4.4Å; Q41-W46 HydrophobicContact CB-CG 4.49Å; Q41-W46 HydrophobicContact CG-CD2 4.09Å; Q41-W46 HydrophobicContact CG-CH2 4.17Å; Q41-W46 HydrophobicContact CG-CZ2 3.63Å; L43-W46 VanDerWaalsContact O-CB 3.24Å; L43-W46 WeakPolarHBondContact O-CB 3.42Å; L43-W46 PolarHBondContact O-N 3.17Å; P44-W46 PolarHBondContact O-N 3.34Å; W46-H48 PolarHBondContact O-N 3.18Å; W46-K49 WeakPolarHBondContact O-CB 3.35Å; W46-K49 PolarHBondContact O-N 3.47Å; W46-K49 VanDerWaalsContact O-N 3.13Å; W46-F79 HydrophobicContact CD2-CZ 4.37Å; W46-F79 AromaticContact CE3-CE1 3.7Å; W46-F79 HydrophobicContact CE3-CE1 3.7Å; W46-F79 AromaticContact CE3-CZ 3.77Å; W46-F79 HydrophobicContact CE3-CZ 3.77Å; W46-F79 AromaticContact CZ3-CE1 3.78Å; W46-F79 HydrophobicContact CZ3-CE1 3.78Å; W46-F79 HydrophobicContact CZ3-CZ 4.33Å
47	K	89.8	Confident	90.8	Very high	178 Å²	178	56.5 Å²	56.5	77%	0.774	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-58.3	-23.5	179.3	-63.6	-175	179.2	-174.9	0	113.1	V45	V45-K47 PolarHBondContact O-N 3.32Å
48	H	90.1	Very high	91.2	Very high	79 Å²	79	61.3 Å²	61.3	37%	0.366	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-110.2	15.9	-175.3	-53.4	-65.5	0	0	0	112.8	V45 W46 D50 V51 L52	V45-H48 PolarHBondContact O-N 2.99Å; W46-H48 PolarHBondContact O-N 3.18Å; H48-D50 PolarHBondContact O-N 2.67Å; H48-V51 PolarHBondContact O-N 2.79Å; H48-L52 WeakPolarHBondContact O-CB 3.36Å; H48-L52 PolarHBondContact O-N 3.21Å
49	K	93.3	Very high	91.5	Very high	41 Å²	41	55.6 Å²	55.6	18%	0.178	28%	0.279	C	S	.	.	H	α-helix	trans	-49.3	-57.4	-174.5	175.7	178.5	-176.6	179.2	0	113.2	W46 L52 I53 F79 E82	W46-K49 WeakPolarHBondContact O-CB 3.35Å; W46-K49 PolarHBondContact O-N 3.47Å; W46-K49 VanDerWaalsContact O-N 3.13Å; K49-L52 PolarHBondContact O-N 2.83Å; K49-I53 VanDerWaalsContact O-CG1 3.31Å; K49-I53 WeakPolarHBondContact O-CG1 3.07Å; K49-I53 PolarHBondContact O-N 3.27Å; K49-I53 VanDerWaalsContact O-N 3.12Å; K49-F79 HydrophobicContact CB-CD2 4.11Å; K49-F79 HydrophobicContact CB-CE1 4.49Å; K49-F79 HydrophobicContact CB-CE2 3.85Å; K49-F79 HydrophobicContact CB-CZ 4.05Å; K49-F79 HydrophobicContact CD-CD1 3.72Å; K49-F79 HydrophobicContact CD-CD2 4.49Å; K49-F79 HydrophobicContact CD-CE1 3.77Å; K49-F79 HydrophobicContact CD-CG 4.1Å; K49-F79 HydrophobicContact CD-CZ 4.17Å; K49-F79 HydrophobicContact CG-CB 4.25Å; K49-F79 HydrophobicContact CG-CD1 3.87Å; K49-F79 HydrophobicContact CG-CD2 3.75Å; K49-F79 HydrophobicContact CG-CE1 4.05Å; K49-F79 HydrophobicContact CG-CE2 3.93Å; K49-F79 HydrophobicContact CG-CG 3.71Å; K49-F79 HydrophobicContact CG-CZ 4.07Å; K49-E82 WeakPolarHBondContact CE-OE2 3.41Å; K49-E82 IonicContact NZ-OE2 3.65Å; K49-E82 PolarHBondContact NZ-OE2 3.06Å
50	D	93.5	Very high	92	Very high	85 Å²	85	57.7 Å²	57.7	46%	0.455	29%	0.285	S	S	.	.	H	α-helix	trans	-69.1	-45.9	-174.3	-65.2	-60.3	0	0	0	111.8	H48 L52 I53 D54 K83	H48-D50 PolarHBondContact O-N 2.67Å; D50-L52 VanDerWaalsContact C-N 3.25Å; D50-L52 PolarHBondContact O-N 2.93Å; D50-I53 PolarHBondContact O-N 2.85Å; D50-I53 VanDerWaalsContact O-N 3.16Å; D50-D54 PolarHBondContact O-N 3.17Å; D50-K83 VanDerWaalsContact OD1-CE 3.32Å; D50-K83 WeakPolarHBondContact OD1-CE 3.26Å; D50-K83 IonicContact OD1-NZ 3.33Å; D50-K83 PolarHBondContact OD1-NZ 2.95Å
51	V	93.7	Very high	92.3	Very high	83 Å²	83	57.2 Å²	57.2	50%	0.503	28%	0.284	S	S	.	.	H	α-helix	trans	-57.1	-40.6	176.1	179.6	0	0	0	0	111.5	H48 T55	H48-V51 PolarHBondContact O-N 2.79Å; V51-T55 WeakPolarHBondContact O-CB 3.33Å; V51-T55 PolarHBondContact O-N 3.23Å; V51-T55 PolarHBondContact O-OG1 3.21Å
52	L	94	Very high	92.6	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.016	26%	0.263	C	S	.	.	H	α-helix	trans	-65.4	-45.9	179.3	-173.9	70.7	0	0	0	111.3	V45 H48 K49 D50 T55 I56 I64 I76 V251	V45-L52 HydrophobicContact CG2-CD2 4Å; H48-L52 WeakPolarHBondContact O-CB 3.36Å; H48-L52 PolarHBondContact O-N 3.21Å; K49-L52 PolarHBondContact O-N 2.83Å; D50-L52 VanDerWaalsContact C-N 3.25Å; D50-L52 PolarHBondContact O-N 2.93Å; L52-T55 PolarHBondContact O-N 2.95Å; L52-I56 HydrophobicContact CD1-CD1 4.49Å; L52-I56 HydrophobicContact CG-CD1 3.96Å; L52-I56 WeakPolarHBondContact O-CB 3.22Å; L52-I56 WeakPolarHBondContact O-CD1 3.33Å; L52-I56 VanDerWaalsContact O-CG1 3.24Å; L52-I56 WeakPolarHBondContact O-CG1 3.41Å; L52-I56 PolarHBondContact O-N 3.36Å; L52-I64 HydrophobicContact CD1-CD1 3.92Å; L52-I64 HydrophobicContact CD1-CG1 4.29Å; L52-I76 HydrophobicContact CD2-CB 4.48Å; L52-I76 HydrophobicContact CD2-CD1 3.73Å; L52-I76 HydrophobicContact CD2-CG1 3.58Å; L52-I76 HydrophobicContact CD2-CG2 4.29Å; L52-V251 HydrophobicContact CD1-CB 4.24Å; L52-V251 HydrophobicContact CD1-CG1 3.82Å; L52-V251 HydrophobicContact CD1-CG2 4.26Å
53	I	95.1	Very high	93	Very high	5 Å²	5	49.5 Å²	49.5	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-62.9	-46	178.1	-66.1	-68.3	0	0	0	110.6	K49 D50 T55 I56 M57 F79 L80 K83 L85	K49-I53 VanDerWaalsContact O-CG1 3.31Å; K49-I53 WeakPolarHBondContact O-CG1 3.07Å; K49-I53 PolarHBondContact O-N 3.27Å; K49-I53 VanDerWaalsContact O-N 3.12Å; D50-I53 PolarHBondContact O-N 2.85Å; D50-I53 VanDerWaalsContact O-N 3.16Å; I53-T55 VanDerWaalsContact C-N 3.3Å; I53-T55 PolarHBondContact O-N 3.39Å; I53-I56 PolarHBondContact O-N 3.12Å; I53-M57 HydrophobicContact CG2-CG 4.34Å; I53-M57 WeakPolarHBondContact O-CB 3.48Å; I53-M57 WeakPolarHBondContact O-CG 3.37Å; I53-M57 PolarHBondContact O-N 3.41Å; I53-F79 HydrophobicContact CD1-CB 3.72Å; I53-F79 HydrophobicContact CG1-CB 4.09Å; I53-L80 HydrophobicContact CD1-CB 4.45Å; I53-L80 HydrophobicContact CD1-CD2 3.5Å; I53-L80 VanDerWaalsContact CD1-CD2 3.5Å; I53-L80 HydrophobicContact CD1-CG 3.82Å; I53-K83 HydrophobicContact CG2-CG 4.22Å; I53-L85 HydrophobicContact CG2-CD1 4.23Å
54	D	95	Very high	93.4	Very high	83 Å²	83	48.8 Å²	48.8	44%	0.444	24%	0.236	S	C	.	.	H	α-helix	trans	-61.1	-41.5	178.2	-70.8	-12.2	0	0	0	111.5	D50 M57 K58	D50-D54 PolarHBondContact O-N 3.17Å; D54-M57 PolarHBondContact O-N 3.02Å; D54-K58 WeakPolarHBondContact O-CB 3.37Å; D54-K58 VanDerWaalsContact O-CG 3.28Å; D54-K58 WeakPolarHBondContact O-CG 3.37Å; D54-K58 PolarHBondContact O-N 2.94Å
55	T	94.9	Very high	93.6	Very high	31 Å²	31	48.1 Å²	48.1	19%	0.19	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-43.8	177.6	-56.1	0	0	0	0	111.7	V51 L52 I53 M57 K58 S59 Q249 V251	V51-T55 WeakPolarHBondContact O-CB 3.33Å; V51-T55 PolarHBondContact O-N 3.23Å; V51-T55 PolarHBondContact O-OG1 3.21Å; L52-T55 PolarHBondContact O-N 2.95Å; I53-T55 VanDerWaalsContact C-N 3.3Å; I53-T55 PolarHBondContact O-N 3.39Å; T55-M57 VanDerWaalsContact C-N 3.29Å; T55-M57 PolarHBondContact O-N 2.87Å; T55-K58 PolarHBondContact O-N 3.35Å; T55-S59 PolarHBondContact O-N 3.02Å; T55-S59 PolarHBondContact O-OG 3Å; T55-Q249 HydrophobicContact CG2-CB 3.75Å; T55-Q249 HydrophobicContact CG2-CG 4.24Å; T55-V251 HydrophobicContact CG2-CG2 3.66Å
56	I	95.1	Very high	93.4	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-39.6	174.5	-70.7	164.4	0	0	0	110.6	L52 I53 S59 C62 I64 I76 L80 F162 K226 I228	L52-I56 HydrophobicContact CD1-CD1 4.49Å; L52-I56 HydrophobicContact CG-CD1 3.96Å; L52-I56 WeakPolarHBondContact O-CB 3.22Å; L52-I56 WeakPolarHBondContact O-CD1 3.33Å; L52-I56 VanDerWaalsContact O-CG1 3.24Å; L52-I56 WeakPolarHBondContact O-CG1 3.41Å; L52-I56 PolarHBondContact O-N 3.36Å; I53-I56 PolarHBondContact O-N 3.12Å; I56-S59 VanDerWaalsContact O-O 3.11Å; I56-C62 HydrophobicContact CG1-CB 4Å; I56-I64 HydrophobicContact CD1-CD1 4.15Å; I56-I76 HydrophobicContact CD1-CG2 4.21Å; I56-L80 HydrophobicContact CD1-CD2 4.46Å; I56-L80 HydrophobicContact CG2-CD2 4.17Å; I56-F162 HydrophobicContact CG2-CE1 4.1Å; I56-K226 HydrophobicContact CG2-CD 4.43Å; I56-K226 PolarHBondContact O-NZ 3.25Å; I56-I228 HydrophobicContact CD1-CD1 4.02Å; I56-I228 HydrophobicContact CG1-CD1 4.34Å; I56-I228 HydrophobicContact CG2-CD1 3.79Å; I56-I228 HydrophobicContact CG2-CG1 4.18Å
57	M	93.9	Very high	92.8	Very high	68 Å²	68	46.5 Å²	46.5	34%	0.335	23%	0.23	S	C	.	.	H	α-helix	trans	-75.9	-33.1	-177.1	-70.4	-54.8	-67.2	0	0	113.1	I53 D54 T55 L85 F162 K226	I53-M57 HydrophobicContact CG2-CG 4.34Å; I53-M57 WeakPolarHBondContact O-CB 3.48Å; I53-M57 WeakPolarHBondContact O-CG 3.37Å; I53-M57 PolarHBondContact O-N 3.41Å; D54-M57 PolarHBondContact O-N 3.02Å; T55-M57 VanDerWaalsContact C-N 3.29Å; T55-M57 PolarHBondContact O-N 2.87Å; M57-L85 HydrophobicContact CE-CD2 4.03Å; M57-L85 HydrophobicContact CG-CD1 4.15Å; M57-L85 HydrophobicContact SD-CD1 3.81Å; M57-L85 HydrophobicContact SD-CD2 4.29Å; M57-F162 HydrophobicContact SD-CE1 4.1Å; M57-F162 HydrophobicContact SD-CZ 3.84Å; M57-K226 VanDerWaalsContact C-NZ 3.29Å; M57-K226 PolarHBondContact O-NZ 2.71Å; M57-K226 HydrophobicContact SD-CD 4.01Å
58	K	93.4	Very high	92.2	Very high	179 Å²	179	38.6 Å²	38.6	78%	0.778	20%	0.197	S	C	*	.	H	α-helix	trans	-74.8	-20.5	177.2	-72.9	173.5	-178.6	178.5	0	114.7	D54 T55	D54-K58 WeakPolarHBondContact O-CB 3.37Å; D54-K58 VanDerWaalsContact O-CG 3.28Å; D54-K58 WeakPolarHBondContact O-CG 3.37Å; D54-K58 PolarHBondContact O-N 2.94Å; T55-K58 PolarHBondContact O-N 3.35Å
59	S	93.3	Very high	91.6	Very high	8 Å²	8	35.8 Å²	35.8	6%	0.056	19%	0.189	C	C	.	.	S	Bend	trans	-108.9	151	-177.3	55.8	0	0	0	0	112.6	T55 I56 H61 K226	T55-S59 PolarHBondContact O-N 3.02Å; T55-S59 PolarHBondContact O-OG 3Å; I56-S59 VanDerWaalsContact O-O 3.11Å; S59-H61 VanDerWaalsContact C-N 3.3Å; S59-H61 VanDerWaalsContact CB-O 3.31Å; S59-H61 WeakPolarHBondContact CB-O 3.25Å; S59-H61 PolarHBondContact OG-O 2.9Å; S59-K226 PolarHBondContact O-NZ 3.26Å
60	E	93.2	Very high	91.2	Very high	87 Å²	87	33.8 Å²	33.8	41%	0.407	18%	0.181	S	C	.	.	S	Bend	trans	-69.5	-37.1	171.1	-67.6	-175.6	-135.5	0	0	110.8	I227 H247	E60-I227 PolarHBondContact O-N 3.03Å; E60-H247 HydrophobicContact CB-CB 4.28Å; E60-H247 PolarHBondContact N-O 3.32Å; E60-H247 IonicContact OE1-CE1 3.32Å; E60-H247 IonicContact OE1-CG 2.85Å; E60-H247 IonicContact OE1-ND1 3.73Å; E60-H247 PolarHBondContact OE1-ND1 3.26Å
61	H	95.4	Very high	90.9	Very high	8 Å²	8	30.2 Å²	30.2	4%	0.037	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	142.6	-177.6	-47.3	-35.2	0	0	0	110.7	S59 I227 L243 H247 T248 Q249	S59-H61 VanDerWaalsContact C-N 3.3Å; S59-H61 VanDerWaalsContact CB-O 3.31Å; S59-H61 WeakPolarHBondContact CB-O 3.25Å; S59-H61 PolarHBondContact OG-O 2.9Å; H61-I227 VanDerWaalsContact CA-O 3.31Å; H61-I227 WeakPolarHBondContact CA-O 3.43Å; H61-L243 HydrophobicContact CB-CB 4.35Å; H61-L243 HydrophobicContact CB-CD1 4.07Å; H61-L243 HydrophobicContact CB-CD2 4.49Å; H61-L243 PolarHBondContact CD2-O 3.14Å; H61-H247 PolarHBondContact N-O 3.03Å; H61-H247 VanDerWaalsContact N-O 3.15Å; H61-T248 HydrophobicContact CB-CG2 4.22Å; H61-T248 WeakPolarHBondContact O-CA 3.33Å; H61-Q249 PolarHBondContact O-N 3.22Å
62	C	96.5	Very high	90.8	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.007	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	123	177.3	-173.2	0	0	0	0	110.6	I56 I227 I228 V229 Q249	I56-C62 HydrophobicContact CG1-CB 4Å; C62-I227 PolarHBondContact N-O 3.05Å; C62-I228 CarbonylContact O-C 3.59Å; C62-I228 VanDerWaalsContact O-CA 3.3Å; C62-I228 WeakPolarHBondContact O-CA 3.39Å; C62-V229 PolarHBondContact O-N 3.22Å; C62-Q249 CarbonylContact C-O 3.16Å; C62-Q249 WeakPolarHBondContact CA-O 3.38Å
63	V	96.2	Very high	90.8	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	114.5	174.3	-179.1	0	0	0	0	108.4	V65 V229 P236 F239 L243 T248 Q249 V250 V251	V63-V65 HydrophobicContact CG1-CG2 4.35Å; V63-V229 CarbonylContact C-O 3.57Å; V63-V229 WeakPolarHBondContact CA-O 3.44Å; V63-V229 HydrophobicContact CG1-CB 4.45Å; V63-V229 HydrophobicContact CG2-CB 4.19Å; V63-V229 HydrophobicContact CG2-CG2 4.44Å; V63-P236 HydrophobicContact CG1-CB 3.84Å; V63-F239 HydrophobicContact CG1-CB 4.33Å; V63-F239 HydrophobicContact CG1-CD2 4.45Å; V63-F239 HydrophobicContact CG2-CB 4.01Å; V63-L243 HydrophobicContact CG2-CD1 3.88Å; V63-T248 HydrophobicContact CG2-CG2 3.69Å; V63-Q249 PolarHBondContact N-O 3.22Å; V63-V250 HydrophobicContact CB-CG2 4.35Å; V63-V250 CarbonylContact O-C 3.37Å; V63-V250 VanDerWaalsContact O-CA 3.31Å; V63-V250 WeakPolarHBondContact O-CA 3.41Å; V63-V251 PolarHBondContact O-N 3.44Å
64	I	94.9	Very high	90.7	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	107.7	-176	-54.1	172.7	0	0	0	108.5	L52 I56 K72 I76 I228 V229 M230 S231 V251 I253	L52-I64 HydrophobicContact CD1-CD1 3.92Å; L52-I64 HydrophobicContact CD1-CG1 4.29Å; I56-I64 HydrophobicContact CD1-CD1 4.15Å; I64-K72 HydrophobicContact CG2-CD 4.05Å; I64-K72 HydrophobicContact CG2-CG 4.36Å; I64-I76 HydrophobicContact CD1-CD1 3.8Å; I64-I76 HydrophobicContact CD1-CG2 4.41Å; I64-I76 HydrophobicContact CG2-CD1 4.07Å; I64-I228 HydrophobicContact CD1-CG2 3.54Å; I64-I228 HydrophobicContact CG1-CG2 4.22Å; I64-V229 PolarHBondContact N-O 2.81Å; I64-M230 HydrophobicContact CB-CG 4.3Å; I64-M230 WeakPolarHBondContact O-CA 3.32Å; I64-S231 PolarHBondContact O-N 2.63Å; I64-V251 CarbonylContact C-O 3.53Å; I64-V251 WeakPolarHBondContact CA-O 3.43Å; I64-V251 HydrophobicContact CG1-CB 4.49Å; I64-I253 HydrophobicContact CG2-CD1 3.41Å; I64-I253 VanDerWaalsContact CG2-CD1 3.41Å; I64-I253 HydrophobicContact CG2-CG1 4.17Å
65	V	91.9	Very high	90.7	Very high	9 Å²	9	24 Å²	24	6%	0.055	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	128.3	176.6	172.7	0	0	0	0	108.9	V63 S231 T233 P236 V251 Y252 I253	V63-V65 HydrophobicContact CG1-CG2 4.35Å; V65-S231 WeakPolarHBondContact CA-O 3.34Å; V65-T233 WeakPolarHBondContact CG1-O 3.4Å; V65-P236 HydrophobicContact CG2-CB 3.97Å; V65-V251 PolarHBondContact N-O 2.67Å; V65-Y252 HydrophobicContact CB-CD1 3.76Å; V65-Y252 HydrophobicContact CB-CE1 3.99Å; V65-Y252 HydrophobicContact CG1-CD1 3.75Å; V65-Y252 HydrophobicContact CG1-CE1 3.96Å; V65-Y252 HydrophobicContact CG2-CD1 4.47Å; V65-Y252 HydrophobicContact CG2-CE1 4.23Å; V65-Y252 CarbonylContact O-C 3.53Å; V65-Y252 WeakPolarHBondContact O-CA 3.49Å; V65-I253 PolarHBondContact O-N 2.74Å
66	G	86.8	Confident	90.7	Very high	4 Å²	4	22.5 Å²	22.5	4%	0.041	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	153.5	169.4	0	0	0	0	0	112.2	K72 S231 A232	G66-K72 VanDerWaalsContact O-CE 3.24Å; G66-K72 WeakPolarHBondContact O-CE 3.46Å; G66-K72 PolarHBondContact O-NZ 3.43Å; G66-S231 PolarHBondContact N-O 3.04Å; G66-A232 WeakPolarHBondContact O-CA 3.35Å
67	S	79	Confident	90.8	Very high	22 Å²	22	22.4 Å²	22.4	15%	0.154	12%	0.119	C	C	.	.			trans	-62.9	165.1	-175.1	87.8	0	0	0	0	113.3	G69 S70 K72 G255 R256	S67-G69 PolarHBondContact O-N 3.3Å; S67-S70 WeakPolarHBondContact O-CB 3.22Å; S67-S70 PolarHBondContact O-N 2.97Å; S67-S70 PolarHBondContact O-OG 2.95Å; S67-K72 PolarHBondContact O-NZ 2.99Å; S67-G255 PolarHBondContact OG-O 3.15Å; S67-R256 VanDerWaalsContact OG-CG 3.29Å; S67-R256 WeakPolarHBondContact OG-CG 2.97Å
68	T	76.7	Confident	90.9	Very high	12 Å²	12	19.1 Å²	19.1	7%	0.074	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	132.3	169.9	53.8	0	0	0	0	110.1	A232	T68-A232 HydrophobicContact CG2-CB 4.41Å
69	G	77.5	Confident	91.1	Very high	20 Å²	20	10.6 Å²	10.6	21%	0.206	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.8	-1.1	-177.7	0	0	0	0	0	114.8	S67 G71	S67-G69 PolarHBondContact O-N 3.3Å; G69-G71 PolarHBondContact O-N 2.88Å
70	S	84.8	Confident	91.2	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.063	C	C	.	.	S	Bend	trans	-70.5	-13.4	174.9	64.3	0	0	0	0	114.5	V45 S67 K72	V45-S70 WeakPolarHBondContact CB-O 3.38Å; V45-S70 VanDerWaalsContact CG1-O 3.3Å; V45-S70 WeakPolarHBondContact CG1-O 3.47Å; V45-S70 PolarHBondContact N-O 3.32Å; S67-S70 WeakPolarHBondContact O-CB 3.22Å; S67-S70 PolarHBondContact O-N 2.97Å; S67-S70 PolarHBondContact O-OG 2.95Å; S70-K72 WeakPolarHBondContact OG-CG 3.3Å; S70-K72 PolarHBondContact OG-NZ 2.82Å
71	G	87.8	Confident	91.3	Very high	9 Å²	9	7.6 Å²	7.6	9%	0.093	5%	0.05	C	C	.	.	S	Bend	trans	94.1	1	177.4	0	0	0	0	0	115.8	G69 T73 T74 Q75	G69-G71 PolarHBondContact O-N 2.88Å; G71-T73 PolarHBondContact O-N 2.92Å; G71-T74 PolarHBondContact O-N 3.26Å; G71-T74 PolarHBondContact O-OG1 3.03Å; G71-Q75 WeakPolarHBondContact O-CB 3.39Å; G71-Q75 WeakPolarHBondContact O-CG 3.48Å; G71-Q75 PolarHBondContact O-N 3.46Å
72	K	91.2	Very high	91.2	Very high	5 Å²	5	10.3 Å²	10.3	2%	0.022	6%	0.062	C	C	.	.	H	α-helix	trans	-45.3	-58.5	-178.3	-66.1	178.2	-45.8	-62.8	0	113.4	I64 G66 S67 S70 T74 I76 M230 I253	I64-K72 HydrophobicContact CG2-CD 4.05Å; I64-K72 HydrophobicContact CG2-CG 4.36Å; G66-K72 VanDerWaalsContact O-CE 3.24Å; G66-K72 WeakPolarHBondContact O-CE 3.46Å; G66-K72 PolarHBondContact O-NZ 3.43Å; S67-K72 PolarHBondContact O-NZ 2.99Å; S70-K72 WeakPolarHBondContact OG-CG 3.3Å; S70-K72 PolarHBondContact OG-NZ 2.82Å; K72-T74 VanDerWaalsContact C-N 3.34Å; K72-T74 PolarHBondContact O-N 3.29Å; K72-I76 HydrophobicContact CB-CD1 3.83Å; K72-I76 HydrophobicContact CG-CD1 4.04Å; K72-I76 WeakPolarHBondContact O-CB 3.46Å; K72-I76 VanDerWaalsContact O-CG1 3.29Å; K72-I76 WeakPolarHBondContact O-CG1 3.37Å; K72-I76 PolarHBondContact O-N 2.84Å; K72-I76 VanDerWaalsContact O-N 3.13Å; K72-M230 HydrophobicContact CB-SD 4Å; K72-I253 HydrophobicContact CD-CD1 4.16Å; K72-I253 HydrophobicContact CG-CD1 3.72Å
73	T	93.4	Very high	91	Very high	14 Å²	14	14.7 Å²	14.7	9%	0.086	8%	0.081	C	C	.	.	H	α-helix	trans	-59.1	-38.9	-173.1	-54.5	0	0	0	0	113.7	G71 I104 Y141 D166	G71-T73 PolarHBondContact O-N 2.92Å; T73-I104 HydrophobicContact CG2-CD1 3.43Å; T73-I104 VanDerWaalsContact CG2-CD1 3.43Å; T73-I104 HydrophobicContact CG2-CG1 4.02Å; T73-I104 HydrophobicContact CG2-CG2 3.83Å; T73-Y141 PolarHBondContact O-OH 2.88Å; T73-D166 WeakPolarHBondContact CB-OD2 3.34Å; T73-D166 WeakPolarHBondContact CG2-OD2 3.46Å; T73-D166 PolarHBondContact OG1-OD2 2.89Å
74	T	93.9	Very high	90.6	Very high	24 Å²	24	20 Å²	20	15%	0.147	11%	0.11	C	C	.	.	H	α-helix	trans	-91.2	-40.7	-177	54.2	0	0	0	0	112	G71 K72 Q78 I104 R107 V108	G71-T74 PolarHBondContact O-N 3.26Å; G71-T74 PolarHBondContact O-OG1 3.03Å; K72-T74 VanDerWaalsContact C-N 3.34Å; K72-T74 PolarHBondContact O-N 3.29Å; T74-Q78 WeakPolarHBondContact O-CG 3.1Å; T74-Q78 PolarHBondContact O-NE2 3.12Å; T74-I104 HydrophobicContact CG2-CG2 4.25Å; T74-R107 HydrophobicContact CG2-CG 4.38Å; T74-V108 HydrophobicContact CG2-CG2 3.94Å
75	Q	94.8	Very high	90.2	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-88.3	-39	-169.2	-58.4	-49.3	-67.2	0	0	114.2	L43 V45 G71 Q78 F79 E111	L43-Q75 HydrophobicContact CD1-CG 3.41Å; L43-Q75 VanDerWaalsContact CD1-CG 3.41Å; V45-Q75 HydrophobicContact CG1-CB 3.69Å; V45-Q75 HydrophobicContact CG1-CG 3.8Å; G71-Q75 WeakPolarHBondContact O-CB 3.39Å; G71-Q75 WeakPolarHBondContact O-CG 3.48Å; G71-Q75 PolarHBondContact O-N 3.46Å; Q75-Q78 CarbonylContact O-C 3.6Å; Q75-Q78 WeakPolarHBondContact O-CA 3.35Å; Q75-Q78 WeakPolarHBondContact O-CB 3.27Å; Q75-Q78 PolarHBondContact O-N 3.43Å; Q75-F79 HydrophobicContact CB-CD2 4.44Å; Q75-F79 HydrophobicContact CB-CE1 3.96Å; Q75-F79 HydrophobicContact CB-CE2 3.88Å; Q75-F79 HydrophobicContact CB-CZ 3.61Å; Q75-F79 HydrophobicContact CG-CZ 4.3Å; Q75-F79 WeakPolarHBondContact O-CD1 3.39Å; Q75-F79 VanDerWaalsContact O-CG 3.22Å; Q75-F79 WeakPolarHBondContact O-CG 2.98Å; Q75-F79 PolarHBondContact O-N 2.98Å; Q75-E111 PolarHBondContact NE2-OE2 2.86Å
76	I	96	Very high	89.9	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-60	-44.8	-174.7	-61.5	175.1	0	0	0	111.9	V45 L52 I56 I64 K72 Q78 F79 L80 M230 I253	V45-I76 HydrophobicContact CG2-CD1 4.25Å; V45-I76 HydrophobicContact CG2-CG1 3.99Å; L52-I76 HydrophobicContact CD2-CB 4.48Å; L52-I76 HydrophobicContact CD2-CD1 3.73Å; L52-I76 HydrophobicContact CD2-CG1 3.58Å; L52-I76 HydrophobicContact CD2-CG2 4.29Å; I56-I76 HydrophobicContact CD1-CG2 4.21Å; I64-I76 HydrophobicContact CD1-CD1 3.8Å; I64-I76 HydrophobicContact CD1-CG2 4.41Å; I64-I76 HydrophobicContact CG2-CD1 4.07Å; K72-I76 HydrophobicContact CB-CD1 3.83Å; K72-I76 HydrophobicContact CG-CD1 4.04Å; K72-I76 WeakPolarHBondContact O-CB 3.46Å; K72-I76 VanDerWaalsContact O-CG1 3.29Å; K72-I76 WeakPolarHBondContact O-CG1 3.37Å; K72-I76 PolarHBondContact O-N 2.84Å; K72-I76 VanDerWaalsContact O-N 3.13Å; I76-Q78 VanDerWaalsContact C-N 3.3Å; I76-Q78 PolarHBondContact O-N 2.84Å; I76-F79 PolarHBondContact O-N 3.12Å; I76-L80 HydrophobicContact CG2-CD1 4.45Å; I76-L80 WeakPolarHBondContact O-CG 3.42Å; I76-L80 PolarHBondContact O-N 3.13Å; I76-M230 HydrophobicContact CB-SD 4.3Å; I76-M230 HydrophobicContact CD1-SD 3.64Å; I76-M230 HydrophobicContact CG1-SD 4.49Å; I76-I253 HydrophobicContact CD1-CD1 4.44Å
77	P	96.8	Very high	89.6	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.1	-38.5	174.1	-22.1	34.5	0	0	0	112.7	L80 Y81 I93 L139 I164	P77-L80 PolarHBondContact O-N 2.8Å; P77-Y81 PolarHBondContact O-N 3.32Å; P77-Y81 VanDerWaalsContact O-N 3.12Å; P77-I93 HydrophobicContact CB-CD1 4.03Å; P77-I93 HydrophobicContact CB-CG1 4.02Å; P77-I93 HydrophobicContact CG-CD1 4.3Å; P77-I93 HydrophobicContact CG-CG1 3.75Å; P77-L139 HydrophobicContact CB-CD1 4.34Å; P77-L139 HydrophobicContact CB-CD2 4.12Å; P77-I164 HydrophobicContact CB-CD1 4.33Å; P77-I164 HydrophobicContact CG-CD1 3.87Å
78	Q	96.3	Very high	89.8	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.6	-42.7	176.9	-69.1	-179.8	73.5	0	0	111.5	T74 Q75 I76 L80 Y81 E82 V108 E111 M112 L139	T74-Q78 WeakPolarHBondContact O-CG 3.1Å; T74-Q78 PolarHBondContact O-NE2 3.12Å; Q75-Q78 CarbonylContact O-C 3.6Å; Q75-Q78 WeakPolarHBondContact O-CA 3.35Å; Q75-Q78 WeakPolarHBondContact O-CB 3.27Å; Q75-Q78 PolarHBondContact O-N 3.43Å; I76-Q78 VanDerWaalsContact C-N 3.3Å; I76-Q78 PolarHBondContact O-N 2.84Å; Q78-L80 VanDerWaalsContact C-N 3.32Å; Q78-L80 PolarHBondContact O-N 2.87Å; Q78-Y81 PolarHBondContact O-N 2.85Å; Q78-E82 WeakPolarHBondContact O-CB 3.3Å; Q78-E82 VanDerWaalsContact O-CG 3.23Å; Q78-E82 WeakPolarHBondContact O-CG 3.47Å; Q78-E82 PolarHBondContact O-N 3.01Å; Q78-V108 HydrophobicContact CG-CG1 3.77Å; Q78-E111 PolarHBondContact NE2-OE2 3.4Å; Q78-M112 HydrophobicContact CG-CG 4.02Å; Q78-M112 HydrophobicContact CG-SD 4.06Å; Q78-L139 HydrophobicContact CG-CD1 4.34Å
79	F	96.2	Very high	90.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-40.7	178.5	-62	-18.2	0	0	0	112.2	V45 W46 K49 I53 Q75 I76 K83	V45-F79 HydrophobicContact CG1-CE2 4.36Å; V45-F79 HydrophobicContact CG2-CE2 4.22Å; W46-F79 HydrophobicContact CD2-CZ 4.37Å; W46-F79 AromaticContact CE3-CE1 3.7Å; W46-F79 HydrophobicContact CE3-CE1 3.7Å; W46-F79 AromaticContact CE3-CZ 3.77Å; W46-F79 HydrophobicContact CE3-CZ 3.77Å; W46-F79 AromaticContact CZ3-CE1 3.78Å; W46-F79 HydrophobicContact CZ3-CE1 3.78Å; W46-F79 HydrophobicContact CZ3-CZ 4.33Å; K49-F79 HydrophobicContact CB-CD2 4.11Å; K49-F79 HydrophobicContact CB-CE1 4.49Å; K49-F79 HydrophobicContact CB-CE2 3.85Å; K49-F79 HydrophobicContact CB-CZ 4.05Å; K49-F79 HydrophobicContact CD-CD1 3.72Å; K49-F79 HydrophobicContact CD-CD2 4.49Å; K49-F79 HydrophobicContact CD-CE1 3.77Å; K49-F79 HydrophobicContact CD-CG 4.1Å; K49-F79 HydrophobicContact CD-CZ 4.17Å; K49-F79 HydrophobicContact CG-CB 4.25Å; K49-F79 HydrophobicContact CG-CD1 3.87Å; K49-F79 HydrophobicContact CG-CD2 3.75Å; K49-F79 HydrophobicContact CG-CE1 4.05Å; K49-F79 HydrophobicContact CG-CE2 3.93Å; K49-F79 HydrophobicContact CG-CG 3.71Å; K49-F79 HydrophobicContact CG-CZ 4.07Å; I53-F79 HydrophobicContact CD1-CB 3.72Å; I53-F79 HydrophobicContact CG1-CB 4.09Å; Q75-F79 HydrophobicContact CB-CD2 4.44Å; Q75-F79 HydrophobicContact CB-CE1 3.96Å; Q75-F79 HydrophobicContact CB-CE2 3.88Å; Q75-F79 HydrophobicContact CB-CZ 3.61Å; Q75-F79 HydrophobicContact CG-CZ 4.3Å; Q75-F79 WeakPolarHBondContact O-CD1 3.39Å; Q75-F79 VanDerWaalsContact O-CG 3.22Å; Q75-F79 WeakPolarHBondContact O-CG 2.98Å; Q75-F79 PolarHBondContact O-N 2.98Å; I76-F79 PolarHBondContact O-N 3.12Å; F79-K83 WeakPolarHBondContact O-CG 3.46Å; F79-K83 PolarHBondContact O-N 3.49Å
80	L	95.7	Very high	91.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-42.5	175.1	-67.9	167.7	0	0	0	111.7	I53 I56 I76 P77 Q78 L85 I91 F162 I164 I228	I53-L80 HydrophobicContact CD1-CB 4.45Å; I53-L80 HydrophobicContact CD1-CD2 3.5Å; I53-L80 VanDerWaalsContact CD1-CD2 3.5Å; I53-L80 HydrophobicContact CD1-CG 3.82Å; I56-L80 HydrophobicContact CD1-CD2 4.46Å; I56-L80 HydrophobicContact CG2-CD2 4.17Å; I76-L80 HydrophobicContact CG2-CD1 4.45Å; I76-L80 WeakPolarHBondContact O-CG 3.42Å; I76-L80 PolarHBondContact O-N 3.13Å; P77-L80 PolarHBondContact O-N 2.8Å; Q78-L80 VanDerWaalsContact C-N 3.32Å; Q78-L80 PolarHBondContact O-N 2.87Å; L80-L85 HydrophobicContact CD2-CD1 3.84Å; L80-L85 WeakPolarHBondContact O-CB 3.49Å; L80-L85 PolarHBondContact O-N 2.85Å; L80-I91 HydrophobicContact CB-CD1 3.46Å; L80-I91 VanDerWaalsContact CB-CD1 3.46Å; L80-I91 HydrophobicContact CD1-CD1 3.96Å; L80-I91 HydrophobicContact CG-CD1 4.37Å; L80-F162 HydrophobicContact CD1-CD1 4.21Å; L80-F162 HydrophobicContact CD1-CG 4.48Å; L80-F162 HydrophobicContact CD2-CD1 4.4Å; L80-F162 HydrophobicContact CD2-CE1 3.93Å; L80-F162 HydrophobicContact CD2-CZ 4.22Å; L80-I164 HydrophobicContact CD1-CD1 4.13Å; L80-I228 HydrophobicContact CD1-CD1 3.76Å
81	Y	94.9	Very high	91.9	Very high	32 Å²	32	33.6 Å²	33.6	13%	0.125	17%	0.173	C	C	.	.	H	α-helix	trans	-66.1	-44.1	176.6	173.8	-96.6	0	0	0	112.6	P77 Q78 K83 N84 T86 M112 R114 P121 H138	P77-Y81 PolarHBondContact O-N 3.32Å; P77-Y81 VanDerWaalsContact O-N 3.12Å; Q78-Y81 PolarHBondContact O-N 2.85Å; Y81-K83 PolarHBondContact O-N 2.79Å; Y81-N84 WeakPolarHBondContact O-CA 3.33Å; Y81-N84 PolarHBondContact O-N 2.98Å; Y81-T86 HydrophobicContact CD2-CG2 4.12Å; Y81-M112 HydrophobicContact CD1-CE 3.29Å; Y81-M112 HydrophobicContact CE1-CE 3.21Å; Y81-M112 HydrophobicContact CG-CE 4.13Å; Y81-R114 PolarHBondContact OH-NH1 3.38Å; Y81-P121 HydrophobicContact CE1-CB 4.44Å; Y81-P121 HydrophobicContact CE2-CB 4.02Å; Y81-H138 HydrophobicContact CD2-CB 3.72Å; Y81-H138 HydrophobicContact CE2-CB 3.69Å; Y81-H138 AromaticContact CE2-CD2 3.96Å; Y81-H138 AromaticContact CE2-CG 3.82Å
82	E	93.7	Very high	92.4	Very high	64 Å²	64	33.2 Å²	33.2	30%	0.299	17%	0.169	S	C	.	.	H	α-helix	trans	-63.9	-26.7	179.5	-73.2	168.2	-172.7	0	0	113	R40 K49 Q78 N84	R40-E82 IonicContact CZ-OE1 3.92Å; R40-E82 IonicContact NH1-OE1 3.39Å; R40-E82 IonicContact NH2-OE1 3.53Å; R40-E82 PolarHBondContact NH2-OE1 3.24Å; K49-E82 WeakPolarHBondContact CE-OE2 3.41Å; K49-E82 IonicContact NZ-OE2 3.65Å; K49-E82 PolarHBondContact NZ-OE2 3.06Å; Q78-E82 WeakPolarHBondContact O-CB 3.3Å; Q78-E82 VanDerWaalsContact O-CG 3.23Å; Q78-E82 WeakPolarHBondContact O-CG 3.47Å; Q78-E82 PolarHBondContact O-N 3.01Å; E82-N84 PolarHBondContact O-N 3.26Å
83	K	92.1	Very high	92.7	Very high	94 Å²	94	33 Å²	33	41%	0.409	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	12.4	172.7	-68.8	-82.3	-173.2	174.8	0	113.1	D50 I53 F79 Y81 L85	D50-K83 VanDerWaalsContact OD1-CE 3.32Å; D50-K83 WeakPolarHBondContact OD1-CE 3.26Å; D50-K83 IonicContact OD1-NZ 3.33Å; D50-K83 PolarHBondContact OD1-NZ 2.95Å; I53-K83 HydrophobicContact CG2-CG 4.22Å; F79-K83 WeakPolarHBondContact O-CG 3.46Å; F79-K83 PolarHBondContact O-N 3.49Å; Y81-K83 PolarHBondContact O-N 2.79Å; K83-L85 HydrophobicContact CB-CD1 4.16Å; K83-L85 HydrophobicContact CB-CG 4.06Å; K83-L85 PolarHBondContact O-N 2.85Å
84	N	88.4	Confident	93	Very high	112 Å²	112	32.3 Å²	32.3	60%	0.599	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	27.9	179.8	-61.2	-47.8	0	0	0	114.6	Y81 E82 T86 N87	Y81-N84 WeakPolarHBondContact O-CA 3.33Å; Y81-N84 PolarHBondContact O-N 2.98Å; E82-N84 PolarHBondContact O-N 3.26Å; N84-T86 PolarHBondContact O-N 3.3Å; N84-N87 PolarHBondContact O-ND2 2.81Å
85	L	87.5	Confident	93	Very high	44 Å²	44	31.1 Å²	31.1	23%	0.23	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	6.9	-178.7	-60.4	172.9	0	0	0	113.4	I53 M57 L80 K83 F162	I53-L85 HydrophobicContact CG2-CD1 4.23Å; M57-L85 HydrophobicContact CE-CD2 4.03Å; M57-L85 HydrophobicContact CG-CD1 4.15Å; M57-L85 HydrophobicContact SD-CD1 3.81Å; M57-L85 HydrophobicContact SD-CD2 4.29Å; L80-L85 HydrophobicContact CD2-CD1 3.84Å; L80-L85 WeakPolarHBondContact O-CB 3.49Å; L80-L85 PolarHBondContact O-N 2.85Å; K83-L85 HydrophobicContact CB-CD1 4.16Å; K83-L85 HydrophobicContact CB-CG 4.06Å; K83-L85 PolarHBondContact O-N 2.85Å; L85-F162 HydrophobicContact CB-CE2 3.87Å; L85-F162 HydrophobicContact CB-CZ 4.03Å; L85-F162 HydrophobicContact CD1-CZ 4.23Å; L85-F162 WeakPolarHBondContact O-CE2 3.46Å
86	T	83.9	Confident	92.9	Very high	8 Å²	8	32.5 Å²	32.5	5%	0.049	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	12.7	-177.1	59.8	0	0	0	0	114.3	Y81 N84 G89 I91 H138	Y81-T86 HydrophobicContact CD2-CG2 4.12Å; N84-T86 PolarHBondContact O-N 3.3Å; T86-G89 CarbonylContact C-O 3.59Å; T86-G89 VanDerWaalsContact CA-O 3.25Å; T86-G89 WeakPolarHBondContact CA-O 3.07Å; T86-I91 HydrophobicContact CG2-CD1 3.79Å; T86-I91 HydrophobicContact CG2-CG1 3.76Å; T86-H138 HydrophobicContact CG2-CB 4.42Å; T86-H138 PolarHBondContact OG1-ND1 2.91Å
87	N	81.1	Confident	92.5	Very high	133 Å²	133	33.7 Å²	33.7	71%	0.711	17%	0.17	S	C	*	.	S	Bend	trans	-72.1	-32.2	-178.3	-67.7	-12.5	0	0	0	112.7	N84	N84-N87 PolarHBondContact O-ND2 2.81Å
88	E	83.9	Confident	92.2	Very high	136 Å²	136	36.6 Å²	36.6	64%	0.636	18%	0.181	S	C	*	.	S	Bend	trans	-98.2	1.9	-177.2	-57.9	-177.7	156.6	0	0	113.4	R161 P223	E88-R161 IonicContact OE2-NE 2.83Å; E88-P223 HydrophobicContact CB-CB 4.28Å; E88-P223 HydrophobicContact CB-CG 4.08Å; E88-P223 WeakPolarHBondContact O-CG 3.49Å
89	G	90.3	Very high	91.7	Very high	13 Å²	13	37.2 Å²	37.2	13%	0.134	18%	0.184	C	C	.	.	S	Bend	trans	158.5	161.9	-176.6	0	0	0	0	0	111.2	T86	T86-G89 CarbonylContact C-O 3.59Å; T86-G89 VanDerWaalsContact CA-O 3.25Å; T86-G89 WeakPolarHBondContact CA-O 3.07Å
90	I	94.8	Very high	91.5	Very high	18 Å²	18	37.2 Å²	37.2	9%	0.092	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	173.1	-174.9	74.2	172.6	0	0	0	111.4	T137 H138 K140 R159 Y160 R161	I90-T137 WeakPolarHBondContact CG2-O 3.33Å; I90-H138 WeakPolarHBondContact CB-O 3.24Å; I90-K140 HydrophobicContact CD1-CB 4.16Å; I90-K140 HydrophobicContact CD1-CD 4.39Å; I90-R159 HydrophobicContact CD1-CG 4.08Å; I90-R159 HydrophobicContact CG1-CG 4.11Å; I90-R159 PolarHBondContact N-O 3.02Å; I90-R159 VanDerWaalsContact N-O 3.11Å; I90-Y160 HydrophobicContact CD1-CD1 4.2Å; I90-Y160 HydrophobicContact CD1-CE1 3.69Å; I90-Y160 HydrophobicContact CG1-CD1 3.54Å; I90-Y160 HydrophobicContact CG1-CE1 3.57Å; I90-Y160 WeakPolarHBondContact O-CA 3.49Å; I90-R161 PolarHBondContact O-N 3.21Å
91	I	97.6	Very high	91.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	119.2	177.6	-51.1	-175.1	0	0	0	108.8	L80 T86 I93 H138 L139 K140 F162 I164	L80-I91 HydrophobicContact CB-CD1 3.46Å; L80-I91 VanDerWaalsContact CB-CD1 3.46Å; L80-I91 HydrophobicContact CD1-CD1 3.96Å; L80-I91 HydrophobicContact CG-CD1 4.37Å; T86-I91 HydrophobicContact CG2-CD1 3.79Å; T86-I91 HydrophobicContact CG2-CG1 3.76Å; I91-I93 HydrophobicContact CB-CD1 4.24Å; I91-I93 HydrophobicContact CG2-CD1 3.74Å; I91-I93 HydrophobicContact CG2-CG1 3.97Å; I91-H138 PolarHBondContact N-O 2.74Å; I91-L139 HydrophobicContact CB-CD2 3.94Å; I91-L139 HydrophobicContact CD1-CD2 3.7Å; I91-L139 HydrophobicContact CG1-CD2 4.06Å; I91-K140 PolarHBondContact O-N 2.92Å; I91-F162 HydrophobicContact CB-CB 4.4Å; I91-F162 HydrophobicContact CD1-CD2 4.45Å; I91-F162 HydrophobicContact CG1-CB 4.13Å; I91-F162 HydrophobicContact CG1-CD2 4.12Å; I91-F162 HydrophobicContact CG1-CG 4.45Å; I91-F162 HydrophobicContact CG2-CB 4.03Å; I91-I164 HydrophobicContact CG2-CD1 3.73Å; I91-I164 HydrophobicContact CG2-CG1 4.02Å
92	A	98.1	Very high	91.2	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	129.1	166.1	0	0	0	0	0	109.3	L147 Y160 F162 I163 I164	A92-L147 HydrophobicContact CB-CD1 4.43Å; A92-L147 HydrophobicContact CB-CD2 4.25Å; A92-Y160 HydrophobicContact CB-CD1 3.57Å; A92-Y160 HydrophobicContact CB-CE1 3.6Å; A92-Y160 HydrophobicContact CB-CG 4.13Å; A92-F162 PolarHBondContact N-O 2.75Å; A92-I163 HydrophobicContact CB-CG1 4.29Å; A92-I164 PolarHBondContact O-N 2.66Å
93	I	98.2	Very high	91	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	111	173.1	-50.8	90.9	0	0	0	108	P77 I91 L139 K140 Y141 M142 I164	P77-I93 HydrophobicContact CB-CD1 4.03Å; P77-I93 HydrophobicContact CB-CG1 4.02Å; P77-I93 HydrophobicContact CG-CD1 4.3Å; P77-I93 HydrophobicContact CG-CG1 3.75Å; I91-I93 HydrophobicContact CB-CD1 4.24Å; I91-I93 HydrophobicContact CG2-CD1 3.74Å; I91-I93 HydrophobicContact CG2-CG1 3.97Å; I93-L139 HydrophobicContact CD1-CB 4.41Å; I93-K140 PolarHBondContact N-O 2.71Å; I93-Y141 HydrophobicContact CB-CD1 3.67Å; I93-Y141 HydrophobicContact CB-CE1 3.74Å; I93-Y141 HydrophobicContact CB-CG 4.32Å; I93-Y141 HydrophobicContact CD1-CE1 4.34Å; I93-Y141 HydrophobicContact CD1-CE2 4.33Å; I93-Y141 HydrophobicContact CG1-CD1 4.41Å; I93-Y141 HydrophobicContact CG1-CE1 4.1Å; I93-Y141 HydrophobicContact CG2-CD1 3.75Å; I93-Y141 HydrophobicContact CG2-CE1 3.58Å; I93-Y141 CarbonylContact O-C 3.58Å; I93-Y141 VanDerWaalsContact O-CA 3.28Å; I93-Y141 WeakPolarHBondContact O-CA 3.4Å; I93-M142 PolarHBondContact O-N 3.44Å; I93-I164 HydrophobicContact CB-CB 4.43Å; I93-I164 HydrophobicContact CG1-CB 4.22Å; I93-I164 HydrophobicContact CG1-CD1 4Å; I93-I164 HydrophobicContact CG1-CG1 4.4Å; I93-I164 HydrophobicContact CG2-CB 4.19Å; I93-I164 HydrophobicContact CG2-CG2 4.21Å
94	T	97.9	Very high	91	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	146.9	-179.5	60.2	0	0	0	0	111.1	M142 D144 L147 I164 L165 D166 L178	T94-M142 CarbonylContact C-O 3.57Å; T94-M142 VanDerWaalsContact CA-O 3.28Å; T94-M142 WeakPolarHBondContact CA-O 3.35Å; T94-M142 HydrophobicContact CG2-CG 4.26Å; T94-D144 WeakPolarHBondContact CB-OD1 3.1Å; T94-L147 HydrophobicContact CG2-CB 3.97Å; T94-L147 HydrophobicContact CG2-CD2 3.46Å; T94-L147 VanDerWaalsContact CG2-CD2 3.46Å; T94-L147 HydrophobicContact CG2-CG 4.37Å; T94-I164 PolarHBondContact N-O 3.41Å; T94-I164 PolarHBondContact OG1-O 2.98Å; T94-L165 HydrophobicContact CG2-CD2 4.4Å; T94-L165 WeakPolarHBondContact OG1-CA 3.18Å; T94-L165 WeakPolarHBondContact OG1-CD2 3.34Å; T94-D166 VanDerWaalsContact O-CB 3.28Å; T94-D166 WeakPolarHBondContact O-CB 3.28Å; T94-L178 HydrophobicContact CG2-CD2 3.82Å
95	Q	95.5	Very high	91.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	132.8	175.5	-66.5	-68.7	-47.9	0	0	107.4	R97 A100 A101 I104 M142 T143 D144 D166 S369	Q95-R97 PolarHBondContact O-N 2.74Å; Q95-A100 HydrophobicContact CB-CB 4.17Å; Q95-A100 HydrophobicContact CG-CB 4.37Å; Q95-A101 HydrophobicContact CB-CB 4.17Å; Q95-A101 HydrophobicContact CG-CB 4.41Å; Q95-I104 VanDerWaalsContact CD-CD1 3.43Å; Q95-I104 HydrophobicContact CG-CD1 3.92Å; Q95-M142 PolarHBondContact N-O 2.9Å; Q95-T143 VanDerWaalsContact O-CA 3.22Å; Q95-T143 WeakPolarHBondContact O-CA 3.06Å; Q95-D144 PolarHBondContact N-OD1 2.62Å; Q95-D166 VanDerWaalsContact NE2-CB 3.28Å; Q95-D166 PolarHBondContact NE2-OD2 3.42Å; Q95-S369 PolarHBondContact OE1-OG 3.21Å
96	P	91.9	Very high	91.5	Very high	28 Å²	28	26.3 Å²	26.3	18%	0.182	14%	0.137	C	C	.	.	S	Bend	trans	-67.2	-19	-176.6	25.7	-34.8	0	0	0	112.9	E167 E170 T368	P96-E167 HydrophobicContact CG-CB 4.04Å; P96-E170 WeakPolarHBondContact CB-OE2 3.49Å; P96-E170 HydrophobicContact CG-CB 4.3Å; P96-E170 VanDerWaalsContact CG-CD 3.48Å; P96-E170 HydrophobicContact CG-CG 4.31Å; P96-E170 WeakPolarHBondContact CG-OE2 3.46Å; P96-T368 HydrophobicContact CG-CG2 4.34Å
97	R	88.7	Confident	91.8	Very high	25 Å²	25	30.4 Å²	30.4	9%	0.094	15%	0.151	C	C	.	.	S	Bend	trans	-117.6	136.5	-176.7	-56.2	-172.3	-164.3	159.7	-9.8	112.9	Q95 V99 A100 A101 E170 N364 L365 T368	Q95-R97 PolarHBondContact O-N 2.74Å; R97-V99 VanDerWaalsContact C-N 3.34Å; R97-V99 PolarHBondContact O-N 2.93Å; R97-A100 HydrophobicContact CB-CB 4.26Å; R97-A100 WeakPolarHBondContact O-CB 3.42Å; R97-A100 PolarHBondContact O-N 3.08Å; R97-A100 VanDerWaalsContact O-N 3.15Å; R97-A101 PolarHBondContact O-N 2.87Å; R97-A101 VanDerWaalsContact O-N 3.11Å; R97-E170 IonicContact CZ-OE1 3.65Å; R97-E170 IonicContact NE-OE1 2.79Å; R97-E170 PolarHBondContact NE-OE1 2.79Å; R97-E170 IonicContact NH1-OE1 2.72Å; R97-E170 IonicContact NH2-OE1 2.87Å; R97-E170 PolarHBondContact NH2-OE1 3.13Å; R97-N364 PolarHBondContact NH1-O 3Å; R97-N364 PolarHBondContact NH2-O 3.38Å; R97-L365 VanDerWaalsContact NH1-CA 3.32Å; R97-L365 PolarHBondContact NH1-O 3.08Å; R97-T368 HydrophobicContact CB-CG2 4.37Å; R97-T368 VanDerWaalsContact CD-CG2 3.43Å; R97-T368 HydrophobicContact CG-CG2 3.82Å; R97-T368 VanDerWaalsContact NE-CG2 3.31Å; R97-T368 VanDerWaalsContact NH1-CG2 3.34Å; R97-T368 PolarHBondContact NH1-OG1 2.84Å
98	R	89.2	Confident	92.4	Very high	61 Å²	61	24 Å²	24	23%	0.23	12%	0.117	C	C	.	.	H	α-helix	trans	-53.8	-46.8	175.8	176.6	177.9	176.8	140.1	8.5	112.7	A100 A101 I102 V126 R127 E129 T143	R98-A100 VanDerWaalsContact C-N 3.27Å; R98-A100 PolarHBondContact O-N 3.18Å; R98-A101 PolarHBondContact O-N 2.77Å; R98-I102 HydrophobicContact CG-CD1 3.88Å; R98-I102 WeakPolarHBondContact O-CG1 3.38Å; R98-I102 PolarHBondContact O-N 2.77Å; R98-I102 VanDerWaalsContact O-N 3.11Å; R98-V126 HydrophobicContact CG-CB 3.89Å; R98-V126 HydrophobicContact CG-CG1 3.98Å; R98-V126 HydrophobicContact CG-CG2 3.91Å; R98-R127 PolarHBondContact NH1-O 2.88Å; R98-E129 IonicContact CZ-OE2 2.63Å; R98-E129 IonicContact NH2-OE2 3.93Å; R98-E129 PolarHBondContact NH2-OE2 2.72Å; R98-T143 HydrophobicContact CB-CG2 4.23Å
99	V	87	Confident	92.9	Very high	13 Å²	13	17.8 Å²	17.8	8%	0.079	9%	0.089	C	C	.	.	H	α-helix	trans	-64.6	-35.4	-176.9	-169.4	0	0	0	0	111.2	R97 S103 L349 I370	R97-V99 VanDerWaalsContact C-N 3.34Å; R97-V99 PolarHBondContact O-N 2.93Å; V99-S103 VanDerWaalsContact O-CB 3.27Å; V99-S103 WeakPolarHBondContact O-CB 3.44Å; V99-S103 PolarHBondContact O-N 3.15Å; V99-S103 PolarHBondContact O-OG 3.21Å; V99-L349 HydrophobicContact CG1-CD1 3.47Å; V99-L349 VanDerWaalsContact CG1-CD1 3.47Å; V99-I370 HydrophobicContact CB-CD1 4.07Å; V99-I370 HydrophobicContact CG1-CD1 3.82Å
100	A	90.3	Very high	93	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.8	-52.9	176	0	0	0	0	0	110.1	Q95 R97 R98 I102 S103 I104 I370	Q95-A100 HydrophobicContact CB-CB 4.17Å; Q95-A100 HydrophobicContact CG-CB 4.37Å; R97-A100 HydrophobicContact CB-CB 4.26Å; R97-A100 WeakPolarHBondContact O-CB 3.42Å; R97-A100 PolarHBondContact O-N 3.08Å; R97-A100 VanDerWaalsContact O-N 3.15Å; R98-A100 VanDerWaalsContact C-N 3.27Å; R98-A100 PolarHBondContact O-N 3.18Å; A100-I102 VanDerWaalsContact C-N 3.27Å; A100-I102 PolarHBondContact O-N 3.19Å; A100-S103 PolarHBondContact O-N 2.96Å; A100-S103 PolarHBondContact O-OG 2.85Å; A100-I104 HydrophobicContact CB-CD1 4.05Å; A100-I104 VanDerWaalsContact O-CB 3.31Å; A100-I104 WeakPolarHBondContact O-CB 3.41Å; A100-I104 VanDerWaalsContact O-CD1 3.27Å; A100-I104 WeakPolarHBondContact O-CD1 3.49Å; A100-I104 WeakPolarHBondContact O-CG1 3.29Å; A100-I104 PolarHBondContact O-N 3.37Å; A100-I370 HydrophobicContact CB-CD1 4.15Å; A100-I370 HydrophobicContact CB-CG1 4.04Å
101	A	93.3	Very high	92.8	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-51.8	-44.7	178.1	0	0	0	0	0	112.9	Q95 R97 R98 A105 V126	Q95-A101 HydrophobicContact CB-CB 4.17Å; Q95-A101 HydrophobicContact CG-CB 4.41Å; R97-A101 PolarHBondContact O-N 2.87Å; R97-A101 VanDerWaalsContact O-N 3.11Å; R98-A101 PolarHBondContact O-N 2.77Å; A101-A105 VanDerWaalsContact O-CB 3.25Å; A101-A105 WeakPolarHBondContact O-CB 3.35Å; A101-A105 PolarHBondContact O-N 3.41Å; A101-V126 HydrophobicContact CB-CG1 3.89Å
102	I	91.4	Very high	92.6	Very high	5 Å²	5	23.1 Å²	23.1	3%	0.026	11%	0.113	C	C	.	.	H	α-helix	trans	-70.8	-52.5	179.7	-61.7	174.8	0	0	0	111.5	R98 A100 I104 A105 L106 Y124 V126	R98-I102 HydrophobicContact CG-CD1 3.88Å; R98-I102 WeakPolarHBondContact O-CG1 3.38Å; R98-I102 PolarHBondContact O-N 2.77Å; R98-I102 VanDerWaalsContact O-N 3.11Å; A100-I102 VanDerWaalsContact C-N 3.27Å; A100-I102 PolarHBondContact O-N 3.19Å; I102-I104 VanDerWaalsContact C-N 3.34Å; I102-I104 PolarHBondContact O-N 3.44Å; I102-A105 PolarHBondContact O-N 2.86Å; I102-L106 HydrophobicContact CG2-CD1 3.91Å; I102-L106 HydrophobicContact CG2-CG 4.44Å; I102-L106 WeakPolarHBondContact O-CG 3.34Å; I102-L106 PolarHBondContact O-N 2.82Å; I102-Y124 HydrophobicContact CD1-CE2 4.16Å; I102-Y124 HydrophobicContact CG1-CD2 3.85Å; I102-Y124 HydrophobicContact CG1-CE1 4.37Å; I102-Y124 HydrophobicContact CG1-CE2 3.69Å; I102-Y124 HydrophobicContact CG1-CG 4.27Å; I102-Y124 HydrophobicContact CG2-CE1 4.06Å; I102-V126 HydrophobicContact CD1-CG2 4.16Å; I102-V126 HydrophobicContact CG1-CG1 4.22Å; I102-V126 HydrophobicContact CG1-CG2 4.44Å
103	S	88.9	Confident	92.2	Very high	28 Å²	28	27.9 Å²	27.9	20%	0.196	14%	0.139	C	C	.	.	H	α-helix	trans	-64.8	-37.9	-174.8	57.4	0	0	0	0	112.5	V99 A100 R107	V99-S103 VanDerWaalsContact O-CB 3.27Å; V99-S103 WeakPolarHBondContact O-CB 3.44Å; V99-S103 PolarHBondContact O-N 3.15Å; V99-S103 PolarHBondContact O-OG 3.21Å; A100-S103 PolarHBondContact O-N 2.96Å; A100-S103 PolarHBondContact O-OG 2.85Å; S103-R107 WeakPolarHBondContact O-CB 3.13Å; S103-R107 PolarHBondContact O-N 3.39Å
104	I	93.1	Very high	91.9	Very high	8 Å²	8	34.8 Å²	34.8	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-67.6	-44.9	175.9	-63.5	159	0	0	0	110.3	T73 T74 Q95 A100 I102 L106 R107 V108 Y141	T73-I104 HydrophobicContact CG2-CD1 3.43Å; T73-I104 VanDerWaalsContact CG2-CD1 3.43Å; T73-I104 HydrophobicContact CG2-CG1 4.02Å; T73-I104 HydrophobicContact CG2-CG2 3.83Å; T74-I104 HydrophobicContact CG2-CG2 4.25Å; Q95-I104 VanDerWaalsContact CD-CD1 3.43Å; Q95-I104 HydrophobicContact CG-CD1 3.92Å; A100-I104 HydrophobicContact CB-CD1 4.05Å; A100-I104 VanDerWaalsContact O-CB 3.31Å; A100-I104 WeakPolarHBondContact O-CB 3.41Å; A100-I104 VanDerWaalsContact O-CD1 3.27Å; A100-I104 WeakPolarHBondContact O-CD1 3.49Å; A100-I104 WeakPolarHBondContact O-CG1 3.29Å; A100-I104 PolarHBondContact O-N 3.37Å; I102-I104 VanDerWaalsContact C-N 3.34Å; I102-I104 PolarHBondContact O-N 3.44Å; I104-L106 VanDerWaalsContact C-N 3.33Å; I104-L106 PolarHBondContact O-N 2.99Å; I104-R107 PolarHBondContact O-N 3.42Å; I104-V108 HydrophobicContact CG2-CG2 4.08Å; I104-V108 WeakPolarHBondContact O-CB 3.46Å; I104-V108 VanDerWaalsContact O-CG2 3.25Å; I104-V108 WeakPolarHBondContact O-CG2 3.46Å; I104-V108 PolarHBondContact O-N 2.83Å; I104-Y141 HydrophobicContact CB-CD1 4.3Å; I104-Y141 HydrophobicContact CB-CE1 4.29Å; I104-Y141 HydrophobicContact CG2-CD1 3.76Å; I104-Y141 HydrophobicContact CG2-CE1 3.28Å; I104-Y141 HydrophobicContact CG2-CE2 4.36Å; I104-Y141 HydrophobicContact CG2-CG 4.49Å
105	A	94.8	Very high	91.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.6	-42.5	177.8	0	0	0	0	0	112.3	A101 I102 V108 A109 V117 V122 Y124 Y141	A101-A105 VanDerWaalsContact O-CB 3.25Å; A101-A105 WeakPolarHBondContact O-CB 3.35Å; A101-A105 PolarHBondContact O-N 3.41Å; I102-A105 PolarHBondContact O-N 2.86Å; A105-V108 PolarHBondContact O-N 2.89Å; A105-A109 WeakPolarHBondContact O-CB 3.38Å; A105-A109 PolarHBondContact O-N 2.78Å; A105-V117 HydrophobicContact CB-CG2 4.42Å; A105-V117 WeakPolarHBondContact O-CG2 3.46Å; A105-V122 HydrophobicContact CB-CG1 4.15Å; A105-V122 WeakPolarHBondContact O-CG1 3.24Å; A105-Y124 HydrophobicContact CB-CD1 3.86Å; A105-Y124 HydrophobicContact CB-CG 4.29Å; A105-Y141 HydrophobicContact CB-CD2 3.8Å; A105-Y141 HydrophobicContact CB-CG 4.14Å
106	L	91.8	Very high	91.4	Very high	77 Å²	77	40.1 Å²	40.1	40%	0.403	21%	0.205	S	C	.	.	H	α-helix	trans	-60.6	-49.1	174	-70.1	170.1	0	0	0	110.9	I102 I104 V108 A109 D110 V117	I102-L106 HydrophobicContact CG2-CD1 3.91Å; I102-L106 HydrophobicContact CG2-CG 4.44Å; I102-L106 WeakPolarHBondContact O-CG 3.34Å; I102-L106 PolarHBondContact O-N 2.82Å; I104-L106 VanDerWaalsContact C-N 3.33Å; I104-L106 PolarHBondContact O-N 2.99Å; L106-V108 VanDerWaalsContact C-N 3.33Å; L106-V108 PolarHBondContact O-N 2.78Å; L106-A109 PolarHBondContact O-N 3.09Å; L106-D110 PolarHBondContact O-N 3.31Å; L106-V117 HydrophobicContact CD2-CB 4.47Å; L106-V117 HydrophobicContact CD2-CG2 3.86Å; L106-V117 HydrophobicContact CG-CG2 4.44Å
107	R	89.9	Confident	91.4	Very high	93 Å²	93	39.5 Å²	39.5	35%	0.351	20%	0.201	S	C	.	.	H	α-helix	trans	-58.7	-43.3	178.2	176.2	60.5	-177	-168	4.4	112.5	T74 S103 I104 D110 E111	T74-R107 HydrophobicContact CG2-CG 4.38Å; S103-R107 WeakPolarHBondContact O-CB 3.13Å; S103-R107 PolarHBondContact O-N 3.39Å; I104-R107 PolarHBondContact O-N 3.42Å; R107-D110 PolarHBondContact O-N 2.86Å; R107-E111 IonicContact CZ-OE1 3.15Å; R107-E111 IonicContact NE-OE1 3.2Å; R107-E111 PolarHBondContact NE-OE1 2.92Å; R107-E111 IonicContact NH2-OE1 2.93Å; R107-E111 PolarHBondContact NH2-OE1 3.14Å; R107-E111 WeakPolarHBondContact O-CB 3.49Å; R107-E111 WeakPolarHBondContact O-CG 3.37Å; R107-E111 PolarHBondContact O-N 3.27Å
108	V	94.3	Very high	91.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-73	-34.5	-178.3	173.4	0	0	0	0	111	T74 Q78 I104 A105 L106 D110 E111 M112 V122 L139 Y141	T74-V108 HydrophobicContact CG2-CG2 3.94Å; Q78-V108 HydrophobicContact CG-CG1 3.77Å; I104-V108 HydrophobicContact CG2-CG2 4.08Å; I104-V108 WeakPolarHBondContact O-CB 3.46Å; I104-V108 VanDerWaalsContact O-CG2 3.25Å; I104-V108 WeakPolarHBondContact O-CG2 3.46Å; I104-V108 PolarHBondContact O-N 2.83Å; A105-V108 PolarHBondContact O-N 2.89Å; L106-V108 VanDerWaalsContact C-N 3.33Å; L106-V108 PolarHBondContact O-N 2.78Å; V108-D110 VanDerWaalsContact C-N 3.34Å; V108-E111 PolarHBondContact O-N 3.29Å; V108-M112 HydrophobicContact CG1-CG 4.31Å; V108-M112 HydrophobicContact CG1-SD 3.91Å; V108-M112 WeakPolarHBondContact O-CB 3.43Å; V108-M112 VanDerWaalsContact O-CG 3.23Å; V108-M112 WeakPolarHBondContact O-CG 3.31Å; V108-M112 PolarHBondContact O-N 2.95Å; V108-V122 HydrophobicContact CB-CG1 4.44Å; V108-V122 HydrophobicContact CG1-CG1 4.37Å; V108-V122 HydrophobicContact CG1-CG2 3.94Å; V108-L139 HydrophobicContact CG1-CD1 4.21Å; V108-Y141 HydrophobicContact CB-CE2 4.16Å; V108-Y141 HydrophobicContact CG1-CE2 4.21Å; V108-Y141 HydrophobicContact CG2-CE2 4.23Å; V108-Y141 WeakPolarHBondContact CG2-OH 3.47Å
109	A	94.5	Very high	91.5	Very high	5 Å²	5	42.1 Å²	42.1	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-43	171.1	0	0	0	0	0	111.7	A105 L106 M112 D113 V117 V122	A105-A109 WeakPolarHBondContact O-CB 3.38Å; A105-A109 PolarHBondContact O-N 2.78Å; L106-A109 PolarHBondContact O-N 3.09Å; A109-M112 PolarHBondContact O-N 3.47Å; A109-D113 PolarHBondContact O-N 3.39Å; A109-V117 HydrophobicContact CB-CG2 3.54Å; A109-V122 HydrophobicContact CB-CB 4.06Å; A109-V122 HydrophobicContact CB-CG1 4.45Å; A109-V122 HydrophobicContact CB-CG2 4.29Å
110	D	91.4	Very high	91.8	Very high	104 Å²	104	41.9 Å²	41.9	56%	0.556	22%	0.224	S	C	*	.	H	α-helix	trans	-65.5	-41.7	175.7	-67.3	-16.1	0	0	0	111.7	L106 R107 V108 M112	L106-D110 PolarHBondContact O-N 3.31Å; R107-D110 PolarHBondContact O-N 2.86Å; V108-D110 VanDerWaalsContact C-N 3.34Å; D110-M112 VanDerWaalsContact C-N 3.33Å; D110-M112 PolarHBondContact O-N 3.05Å
111	E	91.8	Very high	92	Very high	17 Å²	17	42.2 Å²	42.2	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-30.5	177.3	-80.4	-179.5	-169.1	0	0	113.9	R40 Q75 Q78 R107 V108	R40-E111 HydrophobicContact CG-CG 4.28Å; R40-E111 PolarHBondContact NH1-O 3.21Å; Q75-E111 PolarHBondContact NE2-OE2 2.86Å; Q78-E111 PolarHBondContact NE2-OE2 3.4Å; R107-E111 IonicContact CZ-OE1 3.15Å; R107-E111 IonicContact NE-OE1 3.2Å; R107-E111 PolarHBondContact NE-OE1 2.92Å; R107-E111 IonicContact NH2-OE1 2.93Å; R107-E111 PolarHBondContact NH2-OE1 3.14Å; R107-E111 WeakPolarHBondContact O-CB 3.49Å; R107-E111 WeakPolarHBondContact O-CG 3.37Å; R107-E111 PolarHBondContact O-N 3.27Å; V108-E111 PolarHBondContact O-N 3.29Å
112	M	91.6	Very high	92.2	Very high	21 Å²	21	42.3 Å²	42.3	10%	0.103	23%	0.227	C	C	.	.	H	α-helix	trans	-86.2	-26.1	179.6	-72	-179.6	72.5	0	0	113.2	Q78 Y81 V108 A109 D110 R114 P121 V122 L139	Q78-M112 HydrophobicContact CG-CG 4.02Å; Q78-M112 HydrophobicContact CG-SD 4.06Å; Y81-M112 HydrophobicContact CD1-CE 3.29Å; Y81-M112 HydrophobicContact CE1-CE 3.21Å; Y81-M112 HydrophobicContact CG-CE 4.13Å; V108-M112 HydrophobicContact CG1-CG 4.31Å; V108-M112 HydrophobicContact CG1-SD 3.91Å; V108-M112 WeakPolarHBondContact O-CB 3.43Å; V108-M112 VanDerWaalsContact O-CG 3.23Å; V108-M112 WeakPolarHBondContact O-CG 3.31Å; V108-M112 PolarHBondContact O-N 2.95Å; A109-M112 PolarHBondContact O-N 3.47Å; D110-M112 VanDerWaalsContact C-N 3.33Å; D110-M112 PolarHBondContact O-N 3.05Å; M112-R114 WeakPolarHBondContact O-CG 3.12Å; M112-R114 PolarHBondContact O-N 3.22Å; M112-R114 VanDerWaalsContact O-N 3.14Å; M112-P121 HydrophobicContact CE-CB 4.06Å; M112-P121 HydrophobicContact CE-CG 3.51Å; M112-P121 HydrophobicContact SD-CG 4.27Å; M112-V122 HydrophobicContact SD-CG2 3.43Å; M112-V122 WeakPolarHBondContact SD-CG2 3.08Å; M112-L139 HydrophobicContact CE-CD1 4.3Å; M112-L139 HydrophobicContact SD-CD1 3.66Å
113	D	90.5	Very high	92.5	Very high	100 Å²	100	42 Å²	42	54%	0.535	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	35.7	-176.6	-166	59.5	0	0	0	114.5	Q33 A109	Q33-D113 PolarHBondContact NE2-OD1 3.44Å; Q33-D113 PolarHBondContact NE2-OD2 3.32Å; A109-D113 PolarHBondContact O-N 3.39Å
114	R	92	Very high	92.9	Very high	146 Å²	146	41.4 Å²	41.4	55%	0.551	22%	0.219	S	C	*	.	S	Bend	trans	-109.2	31.7	179.7	-72	-177	-172.8	-162.8	0.9	112.9	Y81 M112 G120 P121	Y81-R114 PolarHBondContact OH-NH1 3.38Å; M112-R114 WeakPolarHBondContact O-CG 3.12Å; M112-R114 PolarHBondContact O-N 3.22Å; M112-R114 VanDerWaalsContact O-N 3.14Å; R114-G120 VanDerWaalsContact O-CA 3.23Å; R114-G120 WeakPolarHBondContact O-CA 3.43Å; R114-P121 VanDerWaalsContact CB-CD 3.5Å; R114-P121 HydrophobicContact CB-CG 3.64Å; R114-P121 WeakPolarHBondContact O-CD 3.46Å
115	G	90.8	Very high	93	Very high	32 Å²	32	41 Å²	41	33%	0.33	22%	0.217	S	C	.	.	S	Bend	trans	99.4	159.1	-176.6	0	0	0	0	0	113.3
116	P	91.7	Very high	92.9	Very high	79 Å²	79	41.1 Å²	41.1	51%	0.513	22%	0.217	S	C	.	.	S	Bend	trans	-69.4	162.3	-175.3	31.3	-36.4	0	0	0	111.3	G118 I119 G120	P116-G118 PolarHBondContact O-N 2.94Å; P116-I119 HydrophobicContact CG-CB 4.03Å; P116-I119 HydrophobicContact CG-CD1 3.84Å; P116-I119 HydrophobicContact CG-CG1 4.15Å; P116-I119 PolarHBondContact O-N 2.83Å; P116-G120 PolarHBondContact O-N 3.11Å
117	V	92.2	Very high	92.6	Very high	16 Å²	16	40 Å²	40	10%	0.097	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-49	132.2	175.4	176.7	0	0	0	0	111.5	A105 L106 A109 I119 V122 Y124 M131	A105-V117 HydrophobicContact CB-CG2 4.42Å; A105-V117 WeakPolarHBondContact O-CG2 3.46Å; L106-V117 HydrophobicContact CD2-CB 4.47Å; L106-V117 HydrophobicContact CD2-CG2 3.86Å; L106-V117 HydrophobicContact CG-CG2 4.44Å; A109-V117 HydrophobicContact CB-CG2 3.54Å; V117-I119 PolarHBondContact O-N 3.25Å; V117-V122 CarbonylContact C-O 3.52Å; V117-V122 VanDerWaalsContact CA-O 3.32Å; V117-V122 WeakPolarHBondContact CA-O 3.46Å; V117-Y124 HydrophobicContact CG1-CD1 3.51Å; V117-Y124 HydrophobicContact CG1-CE1 3.73Å; V117-M131 HydrophobicContact CG1-CB 3.99Å
118	G	88.8	Confident	92.2	Very high	16 Å²	16	37.2 Å²	37.2	17%	0.165	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	-16.8	179.1	0	0	0	0	0	114.9	P116 V122 M131 S133	P116-G118 PolarHBondContact O-N 2.94Å; G118-V122 PolarHBondContact N-O 3.41Å; G118-M131 WeakPolarHBondContact CA-O 3.47Å; G118-M131 PolarHBondContact N-O 3.01Å; G118-S133 WeakPolarHBondContact O-CB 3.19Å
119	I	91.5	Very high	91.8	Very high	125 Å²	125	40 Å²	40	64%	0.641	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104	-49.7	171.9	-56.7	-176.5	0	0	0	109.8	P116 V117 S136	P116-I119 HydrophobicContact CG-CB 4.03Å; P116-I119 HydrophobicContact CG-CD1 3.84Å; P116-I119 HydrophobicContact CG-CG1 4.15Å; P116-I119 PolarHBondContact O-N 2.83Å; V117-I119 PolarHBondContact O-N 3.25Å; I119-S136 WeakPolarHBondContact O-CB 3.39Å; I119-S136 PolarHBondContact O-OG 2.87Å
120	G	92.6	Very high	91.6	Very high	7 Å²	7	42 Å²	42	7%	0.072	22%	0.221	C	C	.	.	S	Bend	trans	-77.5	-164.9	177.4	0	0	0	0	0	114	R114 P116 V122	R114-G120 VanDerWaalsContact O-CA 3.23Å; R114-G120 WeakPolarHBondContact O-CA 3.43Å; P116-G120 PolarHBondContact O-N 3.11Å; G120-V122 PolarHBondContact O-N 2.95Å
121	P	95.5	Very high	91.7	Very high	8 Å²	8	40.9 Å²	40.9	5%	0.052	21%	0.214	C	C	.	.	S	Bend	trans	-69.8	-14.9	-176.9	28.4	-34	0	0	0	113.9	Y81 M112 R114 S136 H138 L139	Y81-P121 HydrophobicContact CE1-CB 4.44Å; Y81-P121 HydrophobicContact CE2-CB 4.02Å; M112-P121 HydrophobicContact CE-CB 4.06Å; M112-P121 HydrophobicContact CE-CG 3.51Å; M112-P121 HydrophobicContact SD-CG 4.27Å; R114-P121 VanDerWaalsContact CB-CD 3.5Å; R114-P121 HydrophobicContact CB-CG 3.64Å; R114-P121 WeakPolarHBondContact O-CD 3.46Å; P121-S136 VanDerWaalsContact CA-O 3.29Å; P121-S136 WeakPolarHBondContact CA-O 3.34Å; P121-H138 PolarHBondContact O-N 3.5Å; P121-L139 PolarHBondContact O-N 3.22Å
122	V	97.6	Very high	91.7	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.006	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	134.7	-177.2	-169.7	0	0	0	0	109.8	A105 V108 A109 M112 V117 G118 G120 L139 Y141	A105-V122 HydrophobicContact CB-CG1 4.15Å; A105-V122 WeakPolarHBondContact O-CG1 3.24Å; V108-V122 HydrophobicContact CB-CG1 4.44Å; V108-V122 HydrophobicContact CG1-CG1 4.37Å; V108-V122 HydrophobicContact CG1-CG2 3.94Å; A109-V122 HydrophobicContact CB-CB 4.06Å; A109-V122 HydrophobicContact CB-CG1 4.45Å; A109-V122 HydrophobicContact CB-CG2 4.29Å; M112-V122 HydrophobicContact SD-CG2 3.43Å; M112-V122 WeakPolarHBondContact SD-CG2 3.08Å; V117-V122 CarbonylContact C-O 3.52Å; V117-V122 VanDerWaalsContact CA-O 3.32Å; V117-V122 WeakPolarHBondContact CA-O 3.46Å; G118-V122 PolarHBondContact N-O 3.41Å; G120-V122 PolarHBondContact O-N 2.95Å; V122-L139 WeakPolarHBondContact CA-O 3.34Å; V122-L139 HydrophobicContact CG2-CD1 4.42Å; V122-Y141 HydrophobicContact CG1-CD2 4.1Å; V122-Y141 HydrophobicContact CG1-CE2 4.11Å
123	G	97.2	Very high	91.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	164.9	173.2	0	0	0	0	0	110.5	M131 L139 K140 Y141	G123-M131 WeakPolarHBondContact CA-O 3.16Å; G123-L139 PolarHBondContact N-O 3.45Å; G123-K140 WeakPolarHBondContact O-CA 3.48Å; G123-Y141 PolarHBondContact O-N 3.3Å
124	Y	97	Very high	91.5	Very high	15 Å²	15	40.3 Å²	40.3	6%	0.059	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	156.7	165.1	69.9	-99.5	0	0	0	112.8	I102 A105 V117 V126 E129 M131 Y141	I102-Y124 HydrophobicContact CD1-CE2 4.16Å; I102-Y124 HydrophobicContact CG1-CD2 3.85Å; I102-Y124 HydrophobicContact CG1-CE1 4.37Å; I102-Y124 HydrophobicContact CG1-CE2 3.69Å; I102-Y124 HydrophobicContact CG1-CG 4.27Å; I102-Y124 HydrophobicContact CG2-CE1 4.06Å; A105-Y124 HydrophobicContact CB-CD1 3.86Å; A105-Y124 HydrophobicContact CB-CG 4.29Å; V117-Y124 HydrophobicContact CG1-CD1 3.51Å; V117-Y124 HydrophobicContact CG1-CE1 3.73Å; Y124-V126 HydrophobicContact CD2-CG1 4.19Å; Y124-V126 HydrophobicContact CD2-CG2 4.29Å; Y124-V126 HydrophobicContact CE2-CG2 4.16Å; Y124-E129 HydrophobicContact CE2-CB 4.49Å; Y124-E129 HydrophobicContact CE2-CG 3.82Å; Y124-E129 PolarHBondContact OH-OE1 2.93Å; Y124-M131 HydrophobicContact CD1-CB 4.16Å; Y124-M131 HydrophobicContact CD2-CB 4.48Å; Y124-M131 HydrophobicContact CE1-CB 3.78Å; Y124-M131 HydrophobicContact CE1-CG 3.89Å; Y124-M131 HydrophobicContact CE2-CB 4.13Å; Y124-M131 HydrophobicContact CE2-CG 3.94Å; Y124-M131 HydrophobicContact CG-CB 4.48Å; Y124-M131 VanDerWaalsContact CZ-CG 3.44Å; Y124-M131 PolarHBondContact N-O 3.33Å; Y124-M131 CarbonylContact O-C 3.49Å; Y124-M131 PolarHBondContact O-N 2.91Å; Y124-M131 VanDerWaalsContact OH-CG 3.31Å; Y124-M131 WeakPolarHBondContact OH-CG 3.38Å; Y124-Y141 CarbonylContact C-O 3.57Å; Y124-Y141 WeakPolarHBondContact CA-O 3.39Å; Y124-Y141 WeakPolarHBondContact CB-O 3.29Å
125	S	96	Very high	91.4	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	117.8	174.1	-169.9	0	0	0	0	110.9	D130 K140 Y141 M142 T143 M146	S125-D130 WeakPolarHBondContact CB-OD2 3.44Å; S125-D130 PolarHBondContact OG-OD2 2.95Å; S125-K140 VanDerWaalsContact CB-CE 3.42Å; S125-Y141 PolarHBondContact N-O 3.07Å; S125-M142 WeakPolarHBondContact O-CA 3.47Å; S125-M142 WeakPolarHBondContact O-CB 3.2Å; S125-T143 PolarHBondContact O-N 3.25Å; S125-M146 WeakPolarHBondContact OG-CE 3.47Å
126	V	92.4	Very high	91.5	Very high	2 Å²	2	43 Å²	43	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	166.2	177.7	-57.4	0	0	0	0	108.8	R98 A101 I102 Y124 F128 E129 T143	R98-V126 HydrophobicContact CG-CB 3.89Å; R98-V126 HydrophobicContact CG-CG1 3.98Å; R98-V126 HydrophobicContact CG-CG2 3.91Å; A101-V126 HydrophobicContact CB-CG1 3.89Å; I102-V126 HydrophobicContact CD1-CG2 4.16Å; I102-V126 HydrophobicContact CG1-CG1 4.22Å; I102-V126 HydrophobicContact CG1-CG2 4.44Å; Y124-V126 HydrophobicContact CD2-CG1 4.19Å; Y124-V126 HydrophobicContact CD2-CG2 4.29Å; Y124-V126 HydrophobicContact CE2-CG2 4.16Å; V126-F128 PolarHBondContact O-N 3.43Å; V126-E129 HydrophobicContact CG2-CB 3.85Å; V126-E129 PolarHBondContact N-O 3.09Å; V126-E129 CarbonylContact O-C 3.57Å; V126-E129 PolarHBondContact O-N 3.18Å; V126-T143 HydrophobicContact CB-CG2 4.5Å; V126-T143 HydrophobicContact CG1-CG2 4.05Å
127	R	86	Confident	91.6	Very high	52 Å²	52	39.3 Å²	39.3	20%	0.196	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	128.5	179.8	-163.4	-178.7	-176.6	157.7	7.7	111	R98 E129 P540 Y569	R98-R127 PolarHBondContact NH1-O 2.88Å; R127-E129 VanDerWaalsContact C-N 3.28Å; R127-E129 PolarHBondContact O-N 3.4Å; R127-P540 PolarHBondContact NH2-O 3.17Å; R127-Y569 VanDerWaalsContact NH1-CZ 3.33Å; R127-Y569 PolarHBondContact NH1-OH 2.93Å; R127-Y569 VanDerWaalsContact NH1-OH 3.16Å
128	F	81	Confident	91.8	Very high	36 Å²	36	41.1 Å²	41.1	16%	0.158	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.3	4.1	-177.9	-43.1	-64.5	0	0	0	116.8	V126 R668 V669 Q672	V126-F128 PolarHBondContact O-N 3.43Å; F128-R668 HydrophobicContact CD1-CB 4.25Å; F128-R668 HydrophobicContact CG-CB 4.34Å; F128-V669 HydrophobicContact CE1-CG2 4.23Å; F128-V669 HydrophobicContact CE2-CG2 4.01Å; F128-V669 HydrophobicContact CZ-CB 4.12Å; F128-V669 HydrophobicContact CZ-CG2 3.42Å; F128-V669 VanDerWaalsContact CZ-CG2 3.42Å; F128-Q672 HydrophobicContact CD1-CB 4.28Å; F128-Q672 HydrophobicContact CE1-CB 3.86Å; F128-Q672 HydrophobicContact CE1-CG 4.36Å
129	E	84.9	Confident	92.3	Very high	58 Å²	58	40.4 Å²	40.4	27%	0.271	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	108.3	-177.8	-171.4	174.7	-156.1	0	0	109.9	R98 Y124 V126 R127 M131	R98-E129 IonicContact CZ-OE2 2.63Å; R98-E129 IonicContact NH2-OE2 3.93Å; R98-E129 PolarHBondContact NH2-OE2 2.72Å; Y124-E129 HydrophobicContact CE2-CB 4.49Å; Y124-E129 HydrophobicContact CE2-CG 3.82Å; Y124-E129 PolarHBondContact OH-OE1 2.93Å; V126-E129 HydrophobicContact CG2-CB 3.85Å; V126-E129 PolarHBondContact N-O 3.09Å; V126-E129 CarbonylContact O-C 3.57Å; V126-E129 PolarHBondContact O-N 3.18Å; R127-E129 VanDerWaalsContact C-N 3.28Å; R127-E129 PolarHBondContact O-N 3.4Å; E129-M131 HydrophobicContact CG-CG 4.17Å
130	D	91	Very high	92.6	Very high	46 Å²	46	34.5 Å²	34.5	25%	0.246	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	105.3	172.7	-165.3	-28.3	0	0	0	109.1	S125 S132 K140	S125-D130 WeakPolarHBondContact CB-OD2 3.44Å; S125-D130 PolarHBondContact OG-OD2 2.95Å; D130-S132 VanDerWaalsContact OD1-CB 3.27Å; D130-S132 WeakPolarHBondContact OD1-CB 3.34Å; D130-S132 PolarHBondContact OD1-N 3.2Å; D130-S132 PolarHBondContact OD1-OG 2.75Å; D130-K140 IonicContact OD2-NZ 3.25Å
131	M	93.1	Very high	92.8	Very high	82 Å²	82	34.2 Å²	34.2	40%	0.404	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	54.8	176.1	-65.1	-61.2	-66.7	0	0	109.3	V117 G118 G123 Y124 E129	V117-M131 HydrophobicContact CG1-CB 3.99Å; G118-M131 WeakPolarHBondContact CA-O 3.47Å; G118-M131 PolarHBondContact N-O 3.01Å; G123-M131 WeakPolarHBondContact CA-O 3.16Å; Y124-M131 HydrophobicContact CD1-CB 4.16Å; Y124-M131 HydrophobicContact CD2-CB 4.48Å; Y124-M131 HydrophobicContact CE1-CB 3.78Å; Y124-M131 HydrophobicContact CE1-CG 3.89Å; Y124-M131 HydrophobicContact CE2-CB 4.13Å; Y124-M131 HydrophobicContact CE2-CG 3.94Å; Y124-M131 HydrophobicContact CG-CB 4.48Å; Y124-M131 VanDerWaalsContact CZ-CG 3.44Å; Y124-M131 PolarHBondContact N-O 3.33Å; Y124-M131 CarbonylContact O-C 3.49Å; Y124-M131 PolarHBondContact O-N 2.91Å; Y124-M131 VanDerWaalsContact OH-CG 3.31Å; Y124-M131 WeakPolarHBondContact OH-CG 3.38Å; E129-M131 HydrophobicContact CG-CG 4.17Å
132	S	92.4	Very high	92.9	Very high	6 Å²	6	33.8 Å²	33.8	4%	0.042	17%	0.165	C	C	.	.			trans	-129.6	149.6	173.2	72.6	0	0	0	0	112.2	D130 K140 S843	D130-S132 VanDerWaalsContact OD1-CB 3.27Å; D130-S132 WeakPolarHBondContact OD1-CB 3.34Å; D130-S132 PolarHBondContact OD1-N 3.2Å; D130-S132 PolarHBondContact OD1-OG 2.75Å; S132-K140 WeakPolarHBondContact OG-CE 3.48Å; S132-S843 WeakPolarHBondContact O-CB 3.19Å; S132-S843 PolarHBondContact O-OG 2.99Å
133	S	91.8	Very high	92.9	Very high	29 Å²	29	34.8 Å²	34.8	20%	0.203	17%	0.171	C	C	.	.			trans	-115.3	130	178.9	160.6	0	0	0	0	108.7	G118 K135 S136 T137	G118-S133 WeakPolarHBondContact O-CB 3.19Å; S133-K135 PolarHBondContact O-N 3.12Å; S133-K135 VanDerWaalsContact O-N 3.14Å; S133-K135 PolarHBondContact OG-N 2.89Å; S133-S136 WeakPolarHBondContact CB-OG 3.42Å; S133-S136 PolarHBondContact OG-N 3.39Å; S133-S136 PolarHBondContact OG-OG 3.39Å; S133-T137 PolarHBondContact N-OG1 3.46Å; S133-T137 VanDerWaalsContact O-CB 3.28Å; S133-T137 WeakPolarHBondContact O-CB 3.39Å; S133-T137 PolarHBondContact O-N 2.96Å; S133-T137 PolarHBondContact O-OG1 3.1Å
134	D	87.2	Confident	92.8	Very high	91 Å²	91	34.9 Å²	34.9	49%	0.487	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-19	176.1	-70.9	-21.6	0	0	0	113.1	R159	D134-R159 IonicContact OD1-CZ 2.99Å; D134-R159 IonicContact OD1-NH1 3.63Å; D134-R159 PolarHBondContact OD1-NH1 3.44Å; D134-R159 IonicContact OD1-NH2 3.81Å; D134-R159 PolarHBondContact OD1-NH2 2.86Å
135	K	88.5	Confident	92.6	Very high	201 Å²	201	35.4 Å²	35.4	87%	0.874	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.7	-37	-177.9	-66.7	-175.8	178	-177.1	0	113.7	S133	S133-K135 PolarHBondContact O-N 3.12Å; S133-K135 VanDerWaalsContact O-N 3.14Å; S133-K135 PolarHBondContact OG-N 2.89Å
136	S	92.8	Very high	92.5	Very high	32 Å²	32	37.5 Å²	37.5	22%	0.224	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-25.6	-169.4	54.4	0	0	0	0	114	I119 P121 S133 H138	I119-S136 WeakPolarHBondContact O-CB 3.39Å; I119-S136 PolarHBondContact O-OG 2.87Å; P121-S136 VanDerWaalsContact CA-O 3.29Å; P121-S136 WeakPolarHBondContact CA-O 3.34Å; S133-S136 WeakPolarHBondContact CB-OG 3.42Å; S133-S136 PolarHBondContact OG-N 3.39Å; S133-S136 PolarHBondContact OG-OG 3.39Å; S136-H138 PolarHBondContact O-CD2 3.25Å; S136-H138 PolarHBondContact O-N 3.34Å
137	T	95.1	Very high	92.7	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.018	19%	0.191	C	C	.	.			trans	-77.7	117.6	-177.2	-58.3	0	0	0	0	111.7	I90 S133 L139 K140	I90-T137 WeakPolarHBondContact CG2-O 3.33Å; S133-T137 PolarHBondContact N-OG1 3.46Å; S133-T137 VanDerWaalsContact O-CB 3.28Å; S133-T137 WeakPolarHBondContact O-CB 3.39Å; S133-T137 PolarHBondContact O-N 2.96Å; S133-T137 PolarHBondContact O-OG1 3.1Å; T137-L139 WeakPolarHBondContact CG2-O 3.25Å; T137-K140 HydrophobicContact CG2-CB 4.13Å
138	H	96.5	Very high	93.1	Very high	54 Å²	54	35.2 Å²	35.2	25%	0.25	18%	0.183	C	C	.	.	S	Bend	trans	-107.9	-26.5	172.9	-67.8	-90	0	0	0	113.1	Y81 T86 I90 I91 P121 S136	Y81-H138 HydrophobicContact CD2-CB 3.72Å; Y81-H138 HydrophobicContact CE2-CB 3.69Å; Y81-H138 AromaticContact CE2-CD2 3.96Å; Y81-H138 AromaticContact CE2-CG 3.82Å; T86-H138 HydrophobicContact CG2-CB 4.42Å; T86-H138 PolarHBondContact OG1-ND1 2.91Å; I90-H138 WeakPolarHBondContact CB-O 3.24Å; I91-H138 PolarHBondContact N-O 2.74Å; P121-H138 PolarHBondContact O-N 3.5Å; S136-H138 PolarHBondContact O-CD2 3.25Å; S136-H138 PolarHBondContact O-N 3.34Å
139	L	97.8	Very high	93.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	105	174.4	-58.5	-173.5	0	0	0	108.8	P77 Q78 I91 I93 V108 M112 P121 V122 G123 T137	P77-L139 HydrophobicContact CB-CD1 4.34Å; P77-L139 HydrophobicContact CB-CD2 4.12Å; Q78-L139 HydrophobicContact CG-CD1 4.34Å; I91-L139 HydrophobicContact CB-CD2 3.94Å; I91-L139 HydrophobicContact CD1-CD2 3.7Å; I91-L139 HydrophobicContact CG1-CD2 4.06Å; I93-L139 HydrophobicContact CD1-CB 4.41Å; V108-L139 HydrophobicContact CG1-CD1 4.21Å; M112-L139 HydrophobicContact CE-CD1 4.3Å; M112-L139 HydrophobicContact SD-CD1 3.66Å; P121-L139 PolarHBondContact O-N 3.22Å; V122-L139 WeakPolarHBondContact CA-O 3.34Å; V122-L139 HydrophobicContact CG2-CD1 4.42Å; G123-L139 PolarHBondContact N-O 3.45Å; T137-L139 WeakPolarHBondContact CG2-O 3.25Å
140	K	97.9	Very high	93.9	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.009	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	101.1	-177.6	-165.3	178.9	179.2	-173.8	0	110.3	I90 I91 I93 G123 S125 D130 S132 T137 M142 E150	I90-K140 HydrophobicContact CD1-CB 4.16Å; I90-K140 HydrophobicContact CD1-CD 4.39Å; I91-K140 PolarHBondContact O-N 2.92Å; I93-K140 PolarHBondContact N-O 2.71Å; G123-K140 WeakPolarHBondContact O-CA 3.48Å; S125-K140 VanDerWaalsContact CB-CE 3.42Å; D130-K140 IonicContact OD2-NZ 3.25Å; S132-K140 WeakPolarHBondContact OG-CE 3.48Å; T137-K140 HydrophobicContact CG2-CB 4.13Å; K140-M142 HydrophobicContact CD-CE 3.45Å; K140-M142 VanDerWaalsContact CD-CE 3.45Å; K140-M142 HydrophobicContact CG-CE 3.82Å; K140-E150 IonicContact NZ-OE1 3.61Å; K140-E150 PolarHBondContact NZ-OE1 3.16Å
141	Y	98.1	Very high	94	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	138.1	170.5	-70.7	-88.3	0	0	0	110.2	T73 I93 I104 A105 V108 V122 G123 Y124 S125	T73-Y141 PolarHBondContact O-OH 2.88Å; I93-Y141 HydrophobicContact CB-CD1 3.67Å; I93-Y141 HydrophobicContact CB-CE1 3.74Å; I93-Y141 HydrophobicContact CB-CG 4.32Å; I93-Y141 HydrophobicContact CD1-CE1 4.34Å; I93-Y141 HydrophobicContact CD1-CE2 4.33Å; I93-Y141 HydrophobicContact CG1-CD1 4.41Å; I93-Y141 HydrophobicContact CG1-CE1 4.1Å; I93-Y141 HydrophobicContact CG2-CD1 3.75Å; I93-Y141 HydrophobicContact CG2-CE1 3.58Å; I93-Y141 CarbonylContact O-C 3.58Å; I93-Y141 VanDerWaalsContact O-CA 3.28Å; I93-Y141 WeakPolarHBondContact O-CA 3.4Å; I104-Y141 HydrophobicContact CB-CD1 4.3Å; I104-Y141 HydrophobicContact CB-CE1 4.29Å; I104-Y141 HydrophobicContact CG2-CD1 3.76Å; I104-Y141 HydrophobicContact CG2-CE1 3.28Å; I104-Y141 HydrophobicContact CG2-CE2 4.36Å; I104-Y141 HydrophobicContact CG2-CG 4.49Å; A105-Y141 HydrophobicContact CB-CD2 3.8Å; A105-Y141 HydrophobicContact CB-CG 4.14Å; V108-Y141 HydrophobicContact CB-CE2 4.16Å; V108-Y141 HydrophobicContact CG1-CE2 4.21Å; V108-Y141 HydrophobicContact CG2-CE2 4.23Å; V108-Y141 WeakPolarHBondContact CG2-OH 3.47Å; V122-Y141 HydrophobicContact CG1-CD2 4.1Å; V122-Y141 HydrophobicContact CG1-CE2 4.11Å; G123-Y141 PolarHBondContact O-N 3.3Å; Y124-Y141 CarbonylContact C-O 3.57Å; Y124-Y141 WeakPolarHBondContact CA-O 3.39Å; Y124-Y141 WeakPolarHBondContact CB-O 3.29Å; S125-Y141 PolarHBondContact N-O 3.07Å
142	M	97.5	Very high	93.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	162.7	-178.9	53.1	174.8	49.8	0	0	112.3	I93 T94 Q95 S125 K140 M146 L147 E150	I93-M142 PolarHBondContact O-N 3.44Å; T94-M142 CarbonylContact C-O 3.57Å; T94-M142 VanDerWaalsContact CA-O 3.28Å; T94-M142 WeakPolarHBondContact CA-O 3.35Å; T94-M142 HydrophobicContact CG2-CG 4.26Å; Q95-M142 PolarHBondContact N-O 2.9Å; S125-M142 WeakPolarHBondContact O-CA 3.47Å; S125-M142 WeakPolarHBondContact O-CB 3.2Å; K140-M142 HydrophobicContact CD-CE 3.45Å; K140-M142 VanDerWaalsContact CD-CE 3.45Å; K140-M142 HydrophobicContact CG-CE 3.82Å; M142-M146 HydrophobicContact CB-CB 4.31Å; M142-L147 HydrophobicContact SD-CB 3.54Å; M142-L147 VanDerWaalsContact SD-CB 3.54Å; M142-L147 HydrophobicContact SD-CD1 3.86Å; M142-L147 HydrophobicContact SD-CG 4.16Å; M142-E150 WeakPolarHBondContact CE-OE1 3.44Å
143	T	96.1	Very high	93.6	Very high	21 Å²	21	32.8 Å²	32.8	13%	0.129	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	147.8	168.8	51.4	0	0	0	0	111.3	Q95 R98 S125 V126 G145 M146 L147	Q95-T143 VanDerWaalsContact O-CA 3.22Å; Q95-T143 WeakPolarHBondContact O-CA 3.06Å; R98-T143 HydrophobicContact CB-CG2 4.23Å; S125-T143 PolarHBondContact O-N 3.25Å; V126-T143 HydrophobicContact CB-CG2 4.5Å; V126-T143 HydrophobicContact CG1-CG2 4.05Å; T143-G145 PolarHBondContact O-N 2.76Å; T143-G145 VanDerWaalsContact O-N 3.15Å; T143-M146 WeakPolarHBondContact O-CA 3.45Å; T143-M146 WeakPolarHBondContact O-CB 3.38Å; T143-M146 PolarHBondContact O-N 3.37Å; T143-M146 VanDerWaalsContact OG1-CG 3.27Å; T143-M146 WeakPolarHBondContact OG1-CG 3.39Å; T143-L147 PolarHBondContact O-N 3.36Å
144	D	95.2	Very high	93.6	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.016	17%	0.172	C	C	.	.	H	α-helix	trans	-51.2	-43.1	-179.1	-51.7	0.7	0	0	0	112	T94 Q95 M146 L147 L148 N174 T175 L178	T94-D144 WeakPolarHBondContact CB-OD1 3.1Å; Q95-D144 PolarHBondContact N-OD1 2.62Å; D144-M146 VanDerWaalsContact C-N 3.27Å; D144-M146 PolarHBondContact O-N 3.37Å; D144-L147 PolarHBondContact O-N 3.16Å; D144-L147 VanDerWaalsContact O-N 3.16Å; D144-L148 PolarHBondContact O-N 3.47Å; D144-N174 HydrophobicContact CB-CB 4Å; D144-T175 WeakPolarHBondContact OD2-CB 3.39Å; D144-T175 PolarHBondContact OD2-OG1 3.18Å; D144-L178 HydrophobicContact CB-CD2 4.19Å
145	G	92.9	Very high	93.8	Very high	26 Å²	26	31 Å²	31	27%	0.268	16%	0.159	S	C	.	.	H	α-helix	trans	-63.8	-26	177	0	0	0	0	0	114.6	T143 R149	T143-G145 PolarHBondContact O-N 2.76Å; T143-G145 VanDerWaalsContact O-N 3.15Å; G145-R149 WeakPolarHBondContact O-CB 3.44Å; G145-R149 PolarHBondContact O-N 3.36Å
146	M	94.7	Very high	94	Very high	43 Å²	43	23.8 Å²	23.8	21%	0.212	13%	0.13	C	C	.	.	H	α-helix	trans	-73.4	-41.4	173.2	-71.1	-60.2	-60.7	0	0	111	S125 M142 T143 D144 R149 E150	S125-M146 WeakPolarHBondContact OG-CE 3.47Å; M142-M146 HydrophobicContact CB-CB 4.31Å; T143-M146 WeakPolarHBondContact O-CA 3.45Å; T143-M146 WeakPolarHBondContact O-CB 3.38Å; T143-M146 PolarHBondContact O-N 3.37Å; T143-M146 VanDerWaalsContact OG1-CG 3.27Å; T143-M146 WeakPolarHBondContact OG1-CG 3.39Å; D144-M146 VanDerWaalsContact C-N 3.27Å; D144-M146 PolarHBondContact O-N 3.37Å; M146-R149 PolarHBondContact O-N 3.29Å; M146-E150 PolarHBondContact O-N 2.67Å
147	L	96.3	Very high	94	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.7	-42	175.3	-170.4	54	0	0	0	111.4	A92 T94 M142 T143 D144 R149 E150 A151 L157 Y160 I163 L178	A92-L147 HydrophobicContact CB-CD1 4.43Å; A92-L147 HydrophobicContact CB-CD2 4.25Å; T94-L147 HydrophobicContact CG2-CB 3.97Å; T94-L147 HydrophobicContact CG2-CD2 3.46Å; T94-L147 VanDerWaalsContact CG2-CD2 3.46Å; T94-L147 HydrophobicContact CG2-CG 4.37Å; M142-L147 HydrophobicContact SD-CB 3.54Å; M142-L147 VanDerWaalsContact SD-CB 3.54Å; M142-L147 HydrophobicContact SD-CD1 3.86Å; M142-L147 HydrophobicContact SD-CG 4.16Å; T143-L147 PolarHBondContact O-N 3.36Å; D144-L147 PolarHBondContact O-N 3.16Å; D144-L147 VanDerWaalsContact O-N 3.16Å; L147-R149 PolarHBondContact O-N 3.36Å; L147-E150 PolarHBondContact O-N 2.74Å; L147-E150 VanDerWaalsContact O-N 3.16Å; L147-A151 PolarHBondContact O-N 3.15Å; L147-L157 HydrophobicContact CD1-CD2 3.97Å; L147-Y160 HydrophobicContact CD1-CD2 4.29Å; L147-Y160 HydrophobicContact CD1-CE2 3.79Å; L147-I163 HydrophobicContact CD2-CD1 4.34Å; L147-I163 HydrophobicContact CD2-CG2 3.85Å; L147-L178 HydrophobicContact CB-CD1 4.05Å; L147-L178 HydrophobicContact CB-CD2 4.27Å; L147-L178 HydrophobicContact CD2-CD1 3.89Å; L147-L178 HydrophobicContact CD2-CD2 4.02Å; L147-L178 HydrophobicContact CD2-CG 4.44Å; L147-L178 HydrophobicContact CG-CD1 3.79Å; L147-L178 HydrophobicContact CG-CD2 4.49Å
148	L	93.8	Very high	93.9	Very high	6 Å²	6	24.6 Å²	24.6	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-57.5	-39.9	173.6	-177.9	59.9	0	0	0	110.9	D144 A151 I152 I177 V181 M458	D144-L148 PolarHBondContact O-N 3.47Å; L148-A151 WeakPolarHBondContact O-CB 3.42Å; L148-A151 PolarHBondContact O-N 2.95Å; L148-I152 WeakPolarHBondContact O-CG1 3.45Å; L148-I152 PolarHBondContact O-N 3.43Å; L148-I152 VanDerWaalsContact O-N 3.08Å; L148-I177 HydrophobicContact CD1-CG2 3.75Å; L148-I177 HydrophobicContact CD2-CB 4.46Å; L148-I177 HydrophobicContact CD2-CG2 4.09Å; L148-V181 HydrophobicContact CD1-CG2 3.91Å; L148-M458 HydrophobicContact CD1-CE 4.5Å
149	R	91.1	Very high	93.8	Very high	49 Å²	49	25.3 Å²	25.3	19%	0.185	14%	0.136	C	C	.	.	H	α-helix	trans	-67.7	-39	176.8	-174.3	57.9	-176.7	-179.4	3.7	113.1	G145 M146 L147 A151 I152 S537 A538	G145-R149 WeakPolarHBondContact O-CB 3.44Å; G145-R149 PolarHBondContact O-N 3.36Å; M146-R149 PolarHBondContact O-N 3.29Å; L147-R149 PolarHBondContact O-N 3.36Å; R149-A151 VanDerWaalsContact C-N 3.31Å; R149-I152 PolarHBondContact O-N 2.93Å; R149-S537 PolarHBondContact NH1-O 3.2Å; R149-A538 PolarHBondContact NH2-O 3.44Å
150	E	93.3	Very high	93.7	Very high	44 Å²	44	25.4 Å²	25.4	21%	0.206	14%	0.137	C	C	.	.	H	α-helix	trans	-63.1	-39.2	171.9	-71.3	-170.1	-163.5	0	0	111.2	K140 M142 M146 L147 I152 L153 D154 Y160	K140-E150 IonicContact NZ-OE1 3.61Å; K140-E150 PolarHBondContact NZ-OE1 3.16Å; M142-E150 WeakPolarHBondContact CE-OE1 3.44Å; M146-E150 PolarHBondContact O-N 2.67Å; L147-E150 PolarHBondContact O-N 2.74Å; L147-E150 VanDerWaalsContact O-N 3.16Å; E150-I152 VanDerWaalsContact C-N 3.34Å; E150-I152 PolarHBondContact O-N 3.39Å; E150-L153 PolarHBondContact O-N 2.67Å; E150-L153 VanDerWaalsContact O-N 3.13Å; E150-D154 PolarHBondContact O-N 3.39Å; E150-Y160 VanDerWaalsContact CD-OH 3.3Å; E150-Y160 PolarHBondContact OE1-OH 2.92Å; E150-Y160 VanDerWaalsContact OE2-CE2 3.22Å; E150-Y160 WeakPolarHBondContact OE2-CE2 3.29Å; E150-Y160 VanDerWaalsContact OE2-CZ 3.27Å; E150-Y160 PolarHBondContact OE2-OH 3.43Å
151	A	92.7	Very high	93.5	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.8	-33.4	177.8	0	0	0	0	0	113.5	L147 L148 R149 L153 D154 P155 L157 V181 M458	L147-A151 PolarHBondContact O-N 3.15Å; L148-A151 WeakPolarHBondContact O-CB 3.42Å; L148-A151 PolarHBondContact O-N 2.95Å; R149-A151 VanDerWaalsContact C-N 3.31Å; A151-L153 VanDerWaalsContact C-N 3.27Å; A151-L153 PolarHBondContact O-N 2.91Å; A151-D154 CarbonylContact O-C 3.48Å; A151-P155 WeakPolarHBondContact O-CA 3.36Å; A151-P155 WeakPolarHBondContact O-CD 3.37Å; A151-L157 HydrophobicContact CB-CD2 3.76Å; A151-L157 HydrophobicContact CB-CG 4.33Å; A151-V181 HydrophobicContact CB-CG1 3.43Å; A151-V181 VanDerWaalsContact CB-CG1 3.43Å; A151-M458 HydrophobicContact CB-SD 4.26Å
152	I	88.8	Confident	93.5	Very high	23 Å²	23	26.7 Å²	26.7	12%	0.118	14%	0.141	C	C	.	.	H	α-helix	trans	-61.8	-38.2	173.8	-67.9	164.5	0	0	0	110.9	L148 R149 E150 N454 M458	L148-I152 WeakPolarHBondContact O-CG1 3.45Å; L148-I152 PolarHBondContact O-N 3.43Å; L148-I152 VanDerWaalsContact O-N 3.08Å; R149-I152 PolarHBondContact O-N 2.93Å; E150-I152 VanDerWaalsContact C-N 3.34Å; E150-I152 PolarHBondContact O-N 3.39Å; I152-N454 HydrophobicContact CD1-CB 3.97Å; I152-N454 WeakPolarHBondContact CD1-OD1 3.44Å; I152-N454 HydrophobicContact CG1-CB 4.37Å; I152-M458 HydrophobicContact CG1-CE 4.47Å; I152-M458 HydrophobicContact CG1-CG 4.24Å; I152-M458 HydrophobicContact CG1-SD 4.12Å
153	L	87.8	Confident	93.5	Very high	62 Å²	62	26.7 Å²	26.7	33%	0.325	14%	0.141	S	C	.	.	H	α-helix	trans	-83.6	-34.4	-179.6	-64.3	175.8	0	0	0	112.8	E150 A151 L837 M839	E150-L153 PolarHBondContact O-N 2.67Å; E150-L153 VanDerWaalsContact O-N 3.13Å; A151-L153 VanDerWaalsContact C-N 3.27Å; A151-L153 PolarHBondContact O-N 2.91Å; L153-L837 HydrophobicContact CD2-CB 4.48Å; L153-M839 HydrophobicContact CD1-CB 4.39Å
154	D	91.1	Very high	93.6	Very high	47 Å²	47	25.7 Å²	25.7	25%	0.251	14%	0.135	S	C	.	.			trans	-132	86.2	176.4	177.8	10.9	0	0	0	109.7	E150 A151 N156 L157 S158	E150-D154 PolarHBondContact O-N 3.39Å; A151-D154 CarbonylContact O-C 3.48Å; D154-N156 PolarHBondContact O-N 3.49Å; D154-N156 PolarHBondContact OD1-N 2.72Å; D154-L157 PolarHBondContact O-N 3.29Å; D154-L157 PolarHBondContact OD1-N 3.38Å; D154-S158 VanDerWaalsContact OD2-CB 3.23Å; D154-S158 WeakPolarHBondContact OD2-CB 3.17Å; D154-S158 PolarHBondContact OD2-N 2.97Å; D154-S158 PolarHBondContact OD2-OG 2.75Å
155	P	91.5	Very high	93.7	Very high	34 Å²	34	25.6 Å²	25.6	22%	0.221	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-25.5	-179	-28.4	36.6	0	0	0	113	A151 L157 A185 R188	A151-P155 WeakPolarHBondContact O-CA 3.36Å; A151-P155 WeakPolarHBondContact O-CD 3.37Å; P155-L157 VanDerWaalsContact C-N 3.27Å; P155-A185 WeakPolarHBondContact O-CB 3.33Å; P155-R188 VanDerWaalsContact C-NH1 3.34Å; P155-R188 PolarHBondContact O-NH1 2.67Å; P155-R188 PolarHBondContact O-NH2 3.26Å
156	N	92	Very high	93.9	Very high	51 Å²	51	24.3 Å²	24.3	27%	0.273	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-7.1	178.3	-72	-38.7	0	0	0	112.6	D154 S158 R188 R189 L222	D154-N156 PolarHBondContact O-N 3.49Å; D154-N156 PolarHBondContact OD1-N 2.72Å; N156-S158 PolarHBondContact O-N 2.71Å; N156-R188 PolarHBondContact OD1-NH1 2.91Å; N156-R189 VanDerWaalsContact O-CZ 3.22Å; N156-R189 PolarHBondContact O-NE 2.98Å; N156-R189 PolarHBondContact O-NH2 3.38Å; N156-L222 HydrophobicContact CB-CD1 3.87Å
157	L	94.5	Very high	93.7	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.113	C	C	.	.			trans	54.4	34.8	-177.3	-67.9	174.2	0	0	0	113	L147 A151 D154 P155 R159 Y160 I163 V182 A185 R189	L147-L157 HydrophobicContact CD1-CD2 3.97Å; A151-L157 HydrophobicContact CB-CD2 3.76Å; A151-L157 HydrophobicContact CB-CG 4.33Å; D154-L157 PolarHBondContact O-N 3.29Å; D154-L157 PolarHBondContact OD1-N 3.38Å; P155-L157 VanDerWaalsContact C-N 3.27Å; L157-R159 PolarHBondContact O-N 2.95Å; L157-Y160 HydrophobicContact CB-CD2 4.2Å; L157-Y160 HydrophobicContact CD2-CD2 4.41Å; L157-Y160 PolarHBondContact O-N 3.32Å; L157-I163 HydrophobicContact CB-CD1 4.45Å; L157-I163 HydrophobicContact CD1-CD1 3.45Å; L157-I163 VanDerWaalsContact CD1-CD1 3.45Å; L157-V182 HydrophobicContact CD1-CG2 4Å; L157-A185 HydrophobicContact CD1-CB 4.21Å; L157-R189 PolarHBondContact O-NH2 2.9Å
158	S	93.1	Very high	93.5	Very high	50 Å²	50	22.5 Å²	22.5	35%	0.35	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-25.5	-163.2	64.8	0	0	0	0	115.7	D154 N156 Y160 R189	D154-S158 VanDerWaalsContact OD2-CB 3.23Å; D154-S158 WeakPolarHBondContact OD2-CB 3.17Å; D154-S158 PolarHBondContact OD2-N 2.97Å; D154-S158 PolarHBondContact OD2-OG 2.75Å; N156-S158 PolarHBondContact O-N 2.71Å; S158-Y160 VanDerWaalsContact C-N 3.3Å; S158-Y160 PolarHBondContact O-N 3.29Å; S158-R189 VanDerWaalsContact CA-NH2 3.33Å
159	R	92.7	Very high	93.3	Very high	70 Å²	70	22.5 Å²	22.5	26%	0.264	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-24.4	177.1	-171.9	177.8	175.5	161.7	0.6	113.8	I90 D134 L157	I90-R159 HydrophobicContact CD1-CG 4.08Å; I90-R159 HydrophobicContact CG1-CG 4.11Å; I90-R159 PolarHBondContact N-O 3.02Å; I90-R159 VanDerWaalsContact N-O 3.11Å; D134-R159 IonicContact OD1-CZ 2.99Å; D134-R159 IonicContact OD1-NH1 3.63Å; D134-R159 PolarHBondContact OD1-NH1 3.44Å; D134-R159 IonicContact OD1-NH2 3.81Å; D134-R159 PolarHBondContact OD1-NH2 2.86Å; L157-R159 PolarHBondContact O-N 2.95Å
160	Y	95.8	Very high	93.1	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.008	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	138.4	-168.4	-57.1	-70.5	0	0	0	112.7	I90 A92 L147 E150 L157 S158 R189 L225	I90-Y160 HydrophobicContact CD1-CD1 4.2Å; I90-Y160 HydrophobicContact CD1-CE1 3.69Å; I90-Y160 HydrophobicContact CG1-CD1 3.54Å; I90-Y160 HydrophobicContact CG1-CE1 3.57Å; I90-Y160 WeakPolarHBondContact O-CA 3.49Å; A92-Y160 HydrophobicContact CB-CD1 3.57Å; A92-Y160 HydrophobicContact CB-CE1 3.6Å; A92-Y160 HydrophobicContact CB-CG 4.13Å; L147-Y160 HydrophobicContact CD1-CD2 4.29Å; L147-Y160 HydrophobicContact CD1-CE2 3.79Å; E150-Y160 VanDerWaalsContact CD-OH 3.3Å; E150-Y160 PolarHBondContact OE1-OH 2.92Å; E150-Y160 VanDerWaalsContact OE2-CE2 3.22Å; E150-Y160 WeakPolarHBondContact OE2-CE2 3.29Å; E150-Y160 VanDerWaalsContact OE2-CZ 3.27Å; E150-Y160 PolarHBondContact OE2-OH 3.43Å; L157-Y160 HydrophobicContact CB-CD2 4.2Å; L157-Y160 HydrophobicContact CD2-CD2 4.41Å; L157-Y160 PolarHBondContact O-N 3.32Å; S158-Y160 VanDerWaalsContact C-N 3.3Å; S158-Y160 PolarHBondContact O-N 3.29Å; Y160-R189 PolarHBondContact O-NH1 3.22Å; Y160-R189 PolarHBondContact O-NH2 2.8Å; Y160-L225 WeakPolarHBondContact O-CD1 3.28Å
161	R	95.3	Very high	93	Very high	28 Å²	28	21.4 Å²	21.4	11%	0.106	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	-34.5	169.6	178.2	62.2	-177.4	79	-4.3	111.9	E88 I90 L224 K226	E88-R161 IonicContact OE2-NE 2.83Å; I90-R161 PolarHBondContact O-N 3.21Å; R161-L224 WeakPolarHBondContact CD-O 3.41Å; R161-L224 PolarHBondContact NE-O 3.33Å; R161-L224 PolarHBondContact NH1-O 3.27Å; R161-K226 PolarHBondContact O-N 3.05Å
162	F	97.7	Very high	92.9	Very high	1 Å²	1	22.5 Å²	22.5	0%	0.004	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	138.1	177.2	-63.4	-95.2	0	0	0	109.9	I56 M57 L80 L85 I91 A92 K226 I228	I56-F162 HydrophobicContact CG2-CE1 4.1Å; M57-F162 HydrophobicContact SD-CE1 4.1Å; M57-F162 HydrophobicContact SD-CZ 3.84Å; L80-F162 HydrophobicContact CD1-CD1 4.21Å; L80-F162 HydrophobicContact CD1-CG 4.48Å; L80-F162 HydrophobicContact CD2-CD1 4.4Å; L80-F162 HydrophobicContact CD2-CE1 3.93Å; L80-F162 HydrophobicContact CD2-CZ 4.22Å; L85-F162 HydrophobicContact CB-CE2 3.87Å; L85-F162 HydrophobicContact CB-CZ 4.03Å; L85-F162 HydrophobicContact CD1-CZ 4.23Å; L85-F162 WeakPolarHBondContact O-CE2 3.46Å; I91-F162 HydrophobicContact CB-CB 4.4Å; I91-F162 HydrophobicContact CD1-CD2 4.45Å; I91-F162 HydrophobicContact CG1-CB 4.13Å; I91-F162 HydrophobicContact CG1-CD2 4.12Å; I91-F162 HydrophobicContact CG1-CG 4.45Å; I91-F162 HydrophobicContact CG2-CB 4.03Å; A92-F162 PolarHBondContact N-O 2.75Å; F162-K226 WeakPolarHBondContact CA-O 3.42Å; F162-K226 HydrophobicContact CD1-CB 3.67Å; F162-K226 HydrophobicContact CD1-CD 4.19Å; F162-K226 HydrophobicContact CE1-CB 3.9Å; F162-K226 HydrophobicContact CE1-CD 3.52Å; F162-K226 HydrophobicContact CE1-CG 4.32Å; F162-K226 HydrophobicContact CG-CB 4.47Å; F162-K226 HydrophobicContact CZ-CD 4.17Å; F162-I228 HydrophobicContact CD1-CD1 4.1Å
163	I	98.1	Very high	93	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	122.5	168.2	-64.5	178.3	0	0	0	108.1	A92 L147 L157 L165 V182 L225 K226 I228	A92-I163 HydrophobicContact CB-CG1 4.29Å; L147-I163 HydrophobicContact CD2-CD1 4.34Å; L147-I163 HydrophobicContact CD2-CG2 3.85Å; L157-I163 HydrophobicContact CB-CD1 4.45Å; L157-I163 HydrophobicContact CD1-CD1 3.45Å; L157-I163 VanDerWaalsContact CD1-CD1 3.45Å; I163-L165 HydrophobicContact CG2-CD2 3.89Å; I163-L165 HydrophobicContact CG2-CG 4.26Å; I163-V182 HydrophobicContact CB-CG1 4.25Å; I163-V182 HydrophobicContact CD1-CB 4.5Å; I163-V182 HydrophobicContact CD1-CG1 3.89Å; I163-V182 HydrophobicContact CD1-CG2 3.85Å; I163-V182 HydrophobicContact CG2-CG1 4.19Å; I163-V182 HydrophobicContact CG2-CG2 4.1Å; I163-L225 HydrophobicContact CD1-CD1 3.93Å; I163-L225 HydrophobicContact CD1-CD2 3.91Å; I163-L225 HydrophobicContact CD1-CG 4.28Å; I163-L225 HydrophobicContact CG1-CD1 3.96Å; I163-K226 PolarHBondContact N-O 2.83Å; I163-I228 PolarHBondContact O-N 3.23Å
164	I	98.2	Very high	93.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	112.4	176.7	-53.7	-176.6	0	0	0	108.1	P77 L80 I91 A92 I93 T94 D166 I228 M230	P77-I164 HydrophobicContact CB-CD1 4.33Å; P77-I164 HydrophobicContact CG-CD1 3.87Å; L80-I164 HydrophobicContact CD1-CD1 4.13Å; I91-I164 HydrophobicContact CG2-CD1 3.73Å; I91-I164 HydrophobicContact CG2-CG1 4.02Å; A92-I164 PolarHBondContact O-N 2.66Å; I93-I164 HydrophobicContact CB-CB 4.43Å; I93-I164 HydrophobicContact CG1-CB 4.22Å; I93-I164 HydrophobicContact CG1-CD1 4Å; I93-I164 HydrophobicContact CG1-CG1 4.4Å; I93-I164 HydrophobicContact CG2-CB 4.19Å; I93-I164 HydrophobicContact CG2-CG2 4.21Å; T94-I164 PolarHBondContact N-O 3.41Å; T94-I164 PolarHBondContact OG1-O 2.98Å; I164-D166 PolarHBondContact O-N 3.27Å; I164-I228 CarbonylContact C-O 3.45Å; I164-I228 VanDerWaalsContact CA-O 3.3Å; I164-I228 WeakPolarHBondContact CA-O 3.49Å; I164-I228 HydrophobicContact CD1-CD1 4.3Å; I164-I228 HydrophobicContact CG1-CB 4.11Å; I164-I228 HydrophobicContact CG1-CD1 4.06Å; I164-I228 HydrophobicContact CG2-CG2 4.39Å; I164-M230 HydrophobicContact CG2-CE 3.33Å; I164-M230 HydrophobicContact CG2-CG 3.96Å; I164-M230 HydrophobicContact CG2-SD 3.8Å
165	L	97.1	Very high	93.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	88.3	172.9	-58.4	179.4	0	0	0	108.2	T94 I163 L178 F179 I227 I228 M230	T94-L165 HydrophobicContact CG2-CD2 4.4Å; T94-L165 WeakPolarHBondContact OG1-CA 3.18Å; T94-L165 WeakPolarHBondContact OG1-CD2 3.34Å; I163-L165 HydrophobicContact CG2-CD2 3.89Å; I163-L165 HydrophobicContact CG2-CG 4.26Å; L165-L178 HydrophobicContact CD2-CD2 3.48Å; L165-L178 VanDerWaalsContact CD2-CD2 3.48Å; L165-L178 HydrophobicContact CD2-CG 3.9Å; L165-F179 HydrophobicContact CB-CZ 4.17Å; L165-F179 HydrophobicContact CD1-CD1 3.49Å; L165-F179 VanDerWaalsContact CD1-CD1 3.49Å; L165-F179 HydrophobicContact CD1-CD2 4.13Å; L165-F179 HydrophobicContact CD1-CE1 3.47Å; L165-F179 VanDerWaalsContact CD1-CE1 3.47Å; L165-F179 HydrophobicContact CD1-CE2 4.1Å; L165-F179 HydrophobicContact CD1-CG 3.83Å; L165-F179 HydrophobicContact CD1-CZ 3.76Å; L165-I227 HydrophobicContact CD1-CG2 4.46Å; L165-I228 PolarHBondContact N-O 2.86Å; L165-M230 PolarHBondContact O-N 2.85Å
166	D	95.5	Very high	93.5	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	158.6	-178.5	-161.3	13	0	0	0	112.1	T73 T94 Q95 I164 A168 M230	T73-D166 WeakPolarHBondContact CB-OD2 3.34Å; T73-D166 WeakPolarHBondContact CG2-OD2 3.46Å; T73-D166 PolarHBondContact OG1-OD2 2.89Å; T94-D166 VanDerWaalsContact O-CB 3.28Å; T94-D166 WeakPolarHBondContact O-CB 3.28Å; Q95-D166 VanDerWaalsContact NE2-CB 3.28Å; Q95-D166 PolarHBondContact NE2-OD2 3.42Å; I164-D166 PolarHBondContact O-N 3.27Å; D166-A168 PolarHBondContact O-N 3.42Å; D166-A168 VanDerWaalsContact O-N 3.15Å; D166-M230 HydrophobicContact CB-CB 4.49Å; D166-M230 HydrophobicContact CB-CE 3.6Å; D166-M230 VanDerWaalsContact OD1-CB 3.29Å; D166-M230 WeakPolarHBondContact OD1-CB 3.42Å; D166-M230 VanDerWaalsContact OD1-CE 3.3Å; D166-M230 WeakPolarHBondContact OD1-CE 3.42Å; D166-M230 WeakPolarHBondContact OD2-CE 3.45Å
167	E	92.2	Very high	93.6	Very high	5 Å²	5	17 Å²	17	2%	0.023	9%	0.086	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	35.1	-176.7	-54	-76.5	108	0	0	112.1	P96 H169 E170 M230 S369	P96-E167 HydrophobicContact CG-CB 4.04Å; E167-H169 PolarHBondContact O-N 3.03Å; E167-H169 IonicContact OE1-CE1 2.92Å; E167-H169 IonicContact OE2-CE1 2.82Å; E167-H169 IonicContact OE2-NE2 3.64Å; E167-E170 PolarHBondContact O-N 3.48Å; E167-M230 PolarHBondContact N-O 2.67Å; E167-S369 WeakPolarHBondContact OE1-CB 3.21Å; E167-S369 PolarHBondContact OE2-N 2.71Å
168	A	92.3	Very high	93.6	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-58.8	-16.8	-172.4	0	0	0	0	0	114.6	D166 E170 R171 F179 V229 M230 F239	D166-A168 PolarHBondContact O-N 3.42Å; D166-A168 VanDerWaalsContact O-N 3.15Å; A168-E170 VanDerWaalsContact C-N 3.29Å; A168-E170 PolarHBondContact O-N 3.04Å; A168-R171 VanDerWaalsContact O-CD 3.23Å; A168-R171 WeakPolarHBondContact O-CD 3.15Å; A168-F179 HydrophobicContact CB-CE2 4.08Å; A168-F179 HydrophobicContact CB-CZ 3.78Å; A168-V229 HydrophobicContact CB-CG1 3.63Å; A168-M230 PolarHBondContact N-O 3.31Å; A168-M230 VanDerWaalsContact N-O 3.09Å; A168-F239 HydrophobicContact CB-CE1 3.83Å; A168-F239 HydrophobicContact CB-CE2 4.44Å; A168-F239 HydrophobicContact CB-CZ 3.68Å
169	H	89.6	Confident	93.8	Very high	5 Å²	5	14.8 Å²	14.8	2%	0.023	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-73.6	-13.1	175.1	56	-94.2	0	0	0	115	E167 R171 S231 A232 T233 Q410	E167-H169 PolarHBondContact O-N 3.03Å; E167-H169 IonicContact OE1-CE1 2.92Å; E167-H169 IonicContact OE2-CE1 2.82Å; E167-H169 IonicContact OE2-NE2 3.64Å; H169-R171 PolarHBondContact O-N 3.43Å; H169-S231 WeakPolarHBondContact CB-OG 3.47Å; H169-S231 PolarHBondContact ND1-OG 2.77Å; H169-A232 PolarHBondContact ND1-N 3.16Å; H169-A232 VanDerWaalsContact ND1-N 3.18Å; H169-T233 HydrophobicContact CB-CG2 3.25Å; H169-Q410 PolarHBondContact CD2-NE2 3.46Å; H169-Q410 PolarHBondContact NE2-NE2 3.09Å
170	E	86.3	Confident	93.9	Very high	45 Å²	45	11.4 Å²	11.4	21%	0.21	6%	0.057	C	C	.	.	G	3₁₀ helix	trans	-65.9	-25.7	173.9	-105.2	-163.4	-168.1	0	0	112.2	P96 R97 E167 A168 S172 T368	P96-E170 WeakPolarHBondContact CB-OE2 3.49Å; P96-E170 HydrophobicContact CG-CB 4.3Å; P96-E170 VanDerWaalsContact CG-CD 3.48Å; P96-E170 HydrophobicContact CG-CG 4.31Å; P96-E170 WeakPolarHBondContact CG-OE2 3.46Å; R97-E170 IonicContact CZ-OE1 3.65Å; R97-E170 IonicContact NE-OE1 2.79Å; R97-E170 PolarHBondContact NE-OE1 2.79Å; R97-E170 IonicContact NH1-OE1 2.72Å; R97-E170 IonicContact NH2-OE1 2.87Å; R97-E170 PolarHBondContact NH2-OE1 3.13Å; E167-E170 PolarHBondContact O-N 3.48Å; A168-E170 VanDerWaalsContact C-N 3.29Å; A168-E170 PolarHBondContact O-N 3.04Å; E170-S172 PolarHBondContact O-N 2.91Å; E170-S172 VanDerWaalsContact O-N 3.17Å; E170-T368 WeakPolarHBondContact OE1-CG2 3.38Å
171	R	91.2	Very high	93.9	Very high	25 Å²	25	11.5 Å²	11.5	9%	0.094	6%	0.057	C	C	.	.			trans	50	41.4	175.7	-59	-58.8	-55.1	-81	-5.8	113.4	A168 H169 D176 P441 Q442 S470	A168-R171 VanDerWaalsContact O-CD 3.23Å; A168-R171 WeakPolarHBondContact O-CD 3.15Å; H169-R171 PolarHBondContact O-N 3.43Å; R171-D176 IonicContact CZ-OD1 2.65Å; R171-D176 IonicContact CZ-OD2 3.87Å; R171-D176 IonicContact NE-OD1 2.77Å; R171-D176 PolarHBondContact NE-OD1 3.39Å; R171-D176 IonicContact NE-OD2 2.72Å; R171-D176 PolarHBondContact NE-OD2 2.75Å; R171-D176 IonicContact NH2-OD1 3.73Å; R171-D176 PolarHBondContact NH2-OD1 3.44Å; R171-D176 IonicContact NH2-OD2 3.59Å; R171-D176 PolarHBondContact NH2-OD2 2.88Å; R171-P441 HydrophobicContact CB-CB 4.13Å; R171-P441 HydrophobicContact CB-CG 4.39Å; R171-P441 VanDerWaalsContact CZ-CG 3.42Å; R171-P441 VanDerWaalsContact NH2-CG 3.31Å; R171-Q442 PolarHBondContact O-N 3.45Å; R171-Q442 VanDerWaalsContact O-N 3.09Å; R171-S470 PolarHBondContact NH2-OG 2.6Å
172	S	90.2	Very high	94	Very high	23 Å²	23	10.2 Å²	10.2	16%	0.161	5%	0.052	C	C	.	.			trans	-67.6	157	173.8	91	0	0	0	0	110.7	E170 N174 T175 D176	E170-S172 PolarHBondContact O-N 2.91Å; E170-S172 VanDerWaalsContact O-N 3.17Å; S172-N174 VanDerWaalsContact C-N 3.3Å; S172-N174 PolarHBondContact O-N 2.92Å; S172-T175 PolarHBondContact O-N 3.41Å; S172-T175 VanDerWaalsContact O-N 3.13Å; S172-T175 PolarHBondContact OG-N 3.3Å; S172-T175 PolarHBondContact OG-OG1 3.42Å; S172-D176 PolarHBondContact O-N 3.4Å
173	L	92	Very high	93.9	Very high	29 Å²	29	10.2 Å²	10.2	15%	0.152	5%	0.053	C	C	.	.	H	α-helix	trans	-54.8	-46.1	179.4	-179.1	63.9	0	0	0	111.9	T175 D176 I177 Q442 I443 A446 V451	L173-T175 PolarHBondContact O-N 3.47Å; L173-D176 PolarHBondContact O-N 3.18Å; L173-I177 HydrophobicContact CD1-CD1 4.03Å; L173-I177 HydrophobicContact CG-CD1 3.85Å; L173-I177 VanDerWaalsContact O-CD1 3.24Å; L173-I177 WeakPolarHBondContact O-CD1 3.42Å; L173-I177 WeakPolarHBondContact O-CG1 3.27Å; L173-I177 PolarHBondContact O-N 3.45Å; L173-I177 VanDerWaalsContact O-N 3.15Å; L173-Q442 HydrophobicContact CB-CB 4.39Å; L173-Q442 HydrophobicContact CB-CG 4.24Å; L173-I443 HydrophobicContact CD1-CB 4.09Å; L173-I443 HydrophobicContact CD1-CG1 4.02Å; L173-A446 HydrophobicContact CD1-CB 4.2Å; L173-A446 HydrophobicContact CD2-CB 4.06Å; L173-V451 HydrophobicContact CD1-CG2 4.12Å; L173-V451 HydrophobicContact CD2-CG2 4.21Å; L173-V451 HydrophobicContact CG-CG2 4.34Å
174	N	93.1	Very high	93.7	Very high	69 Å²	69	11.3 Å²	11.3	37%	0.369	6%	0.06	S	C	.	.	H	α-helix	trans	-65.9	-38.9	179.5	-72	-41.3	0	0	0	112.1	D144 S172 L178	D144-N174 HydrophobicContact CB-CB 4Å; S172-N174 VanDerWaalsContact C-N 3.3Å; S172-N174 PolarHBondContact O-N 2.92Å; N174-L178 WeakPolarHBondContact O-CB 3.26Å; N174-L178 PolarHBondContact O-N 3.1Å
175	T	93.2	Very high	93.5	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.006	6%	0.06	C	C	.	.	H	α-helix	trans	-61.6	-49.3	178.2	-40.4	0	0	0	0	110.3	D144 S172 L173 I177 L178 F179	D144-T175 WeakPolarHBondContact OD2-CB 3.39Å; D144-T175 PolarHBondContact OD2-OG1 3.18Å; S172-T175 PolarHBondContact O-N 3.41Å; S172-T175 VanDerWaalsContact O-N 3.13Å; S172-T175 PolarHBondContact OG-N 3.3Å; S172-T175 PolarHBondContact OG-OG1 3.42Å; L173-T175 PolarHBondContact O-N 3.47Å; T175-I177 PolarHBondContact O-N 3.41Å; T175-L178 WeakPolarHBondContact O-CB 3.42Å; T175-L178 PolarHBondContact O-N 2.87Å; T175-L178 VanDerWaalsContact O-N 3.14Å; T175-F179 HydrophobicContact CG2-CD2 4.22Å; T175-F179 HydrophobicContact CG2-CE2 3.89Å; T175-F179 VanDerWaalsContact O-CD2 3.24Å; T175-F179 WeakPolarHBondContact O-CD2 3.29Å; T175-F179 PolarHBondContact O-N 3.29Å
176	D	93.9	Very high	93.4	Very high	1 Å²	1	11.8 Å²	11.8	1%	0.005	6%	0.064	C	C	.	.	H	α-helix	trans	-62.9	-40.4	-178.5	-82.9	19.2	0	0	0	112.5	R171 S172 L173 I443	R171-D176 IonicContact CZ-OD1 2.65Å; R171-D176 IonicContact CZ-OD2 3.87Å; R171-D176 IonicContact NE-OD1 2.77Å; R171-D176 PolarHBondContact NE-OD1 3.39Å; R171-D176 IonicContact NE-OD2 2.72Å; R171-D176 PolarHBondContact NE-OD2 2.75Å; R171-D176 IonicContact NH2-OD1 3.73Å; R171-D176 PolarHBondContact NH2-OD1 3.44Å; R171-D176 IonicContact NH2-OD2 3.59Å; R171-D176 PolarHBondContact NH2-OD2 2.88Å; S172-D176 PolarHBondContact O-N 3.4Å; L173-D176 PolarHBondContact O-N 3.18Å; D176-I443 HydrophobicContact CB-CB 4.38Å; D176-I443 HydrophobicContact CB-CD1 4.29Å; D176-I443 HydrophobicContact CB-CG2 4.47Å; D176-I443 VanDerWaalsContact OD2-CG2 3.28Å; D176-I443 WeakPolarHBondContact OD2-CG2 3.13Å
177	I	94.2	Very high	93.3	Very high	3 Å²	3	17.9 Å²	17.9	2%	0.015	9%	0.091	C	C	.	.	H	α-helix	trans	-65.8	-42.9	174.3	-62.1	158.9	0	0	0	110.2	L148 L173 T175 F179 G180 V181 V451	L148-I177 HydrophobicContact CD1-CG2 3.75Å; L148-I177 HydrophobicContact CD2-CB 4.46Å; L148-I177 HydrophobicContact CD2-CG2 4.09Å; L173-I177 HydrophobicContact CD1-CD1 4.03Å; L173-I177 HydrophobicContact CG-CD1 3.85Å; L173-I177 VanDerWaalsContact O-CD1 3.24Å; L173-I177 WeakPolarHBondContact O-CD1 3.42Å; L173-I177 WeakPolarHBondContact O-CG1 3.27Å; L173-I177 PolarHBondContact O-N 3.45Å; L173-I177 VanDerWaalsContact O-N 3.15Å; T175-I177 PolarHBondContact O-N 3.41Å; I177-F179 VanDerWaalsContact C-N 3.29Å; I177-F179 PolarHBondContact O-N 3.13Å; I177-G180 PolarHBondContact O-N 3.06Å; I177-G180 VanDerWaalsContact O-N 3.16Å; I177-V181 HydrophobicContact CG2-CG2 4.09Å; I177-V181 WeakPolarHBondContact O-CG2 3.04Å; I177-V181 PolarHBondContact O-N 3.3Å; I177-V451 HydrophobicContact CD1-CB 4.01Å; I177-V451 HydrophobicContact CD1-CG1 3.56Å; I177-V451 HydrophobicContact CD1-CG2 3.38Å; I177-V451 HydrophobicContact CG1-CG1 3.65Å; I177-V451 HydrophobicContact CG1-CG2 4.28Å; I177-V451 HydrophobicContact CG2-CG1 4.37Å
178	L	95.3	Very high	93.3	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.4	-36.7	-177.7	-178	66.1	0	0	0	111.8	T94 D144 L147 L165 N174 T175 G180 V181 V182	T94-L178 HydrophobicContact CG2-CD2 3.82Å; D144-L178 HydrophobicContact CB-CD2 4.19Å; L147-L178 HydrophobicContact CB-CD1 4.05Å; L147-L178 HydrophobicContact CB-CD2 4.27Å; L147-L178 HydrophobicContact CD2-CD1 3.89Å; L147-L178 HydrophobicContact CD2-CD2 4.02Å; L147-L178 HydrophobicContact CD2-CG 4.44Å; L147-L178 HydrophobicContact CG-CD1 3.79Å; L147-L178 HydrophobicContact CG-CD2 4.49Å; L165-L178 HydrophobicContact CD2-CD2 3.48Å; L165-L178 VanDerWaalsContact CD2-CD2 3.48Å; L165-L178 HydrophobicContact CD2-CG 3.9Å; N174-L178 WeakPolarHBondContact O-CB 3.26Å; N174-L178 PolarHBondContact O-N 3.1Å; T175-L178 WeakPolarHBondContact O-CB 3.42Å; T175-L178 PolarHBondContact O-N 2.87Å; T175-L178 VanDerWaalsContact O-N 3.14Å; L178-G180 VanDerWaalsContact C-N 3.34Å; L178-G180 PolarHBondContact O-N 3.43Å; L178-V181 PolarHBondContact O-N 2.92Å; L178-V182 HydrophobicContact CD1-CG2 3.73Å; L178-V182 HydrophobicContact CG-CG2 3.98Å; L178-V182 VanDerWaalsContact O-CB 3.3Å; L178-V182 WeakPolarHBondContact O-CB 3.24Å; L178-V182 WeakPolarHBondContact O-CG2 3.34Å; L178-V182 PolarHBondContact O-N 2.9Å
179	F	96.1	Very high	93.3	Very high	3 Å²	3	21.9 Å²	21.9	1%	0.013	11%	0.105	C	C	.	.	H	α-helix	trans	-52.3	-51.5	171.4	-91.2	-78.8	0	0	0	112	L165 A168 T175 I177 L183 V229 F239 F242 L469	L165-F179 HydrophobicContact CB-CZ 4.17Å; L165-F179 HydrophobicContact CD1-CD1 3.49Å; L165-F179 VanDerWaalsContact CD1-CD1 3.49Å; L165-F179 HydrophobicContact CD1-CD2 4.13Å; L165-F179 HydrophobicContact CD1-CE1 3.47Å; L165-F179 VanDerWaalsContact CD1-CE1 3.47Å; L165-F179 HydrophobicContact CD1-CE2 4.1Å; L165-F179 HydrophobicContact CD1-CG 3.83Å; L165-F179 HydrophobicContact CD1-CZ 3.76Å; A168-F179 HydrophobicContact CB-CE2 4.08Å; A168-F179 HydrophobicContact CB-CZ 3.78Å; T175-F179 HydrophobicContact CG2-CD2 4.22Å; T175-F179 HydrophobicContact CG2-CE2 3.89Å; T175-F179 VanDerWaalsContact O-CD2 3.24Å; T175-F179 WeakPolarHBondContact O-CD2 3.29Å; T175-F179 PolarHBondContact O-N 3.29Å; I177-F179 VanDerWaalsContact C-N 3.29Å; I177-F179 PolarHBondContact O-N 3.13Å; F179-L183 WeakPolarHBondContact O-CB 3.37Å; F179-L183 PolarHBondContact O-N 3.29Å; F179-V229 HydrophobicContact CE1-CB 4.48Å; F179-V229 HydrophobicContact CE1-CG1 4.06Å; F179-V229 HydrophobicContact CE1-CG2 3.57Å; F179-V229 HydrophobicContact CZ-CG1 3.79Å; F179-V229 HydrophobicContact CZ-CG2 4.12Å; F179-F239 AromaticContact CE1-CD1 3.89Å; F179-F239 HydrophobicContact CE1-CD1 3.89Å; F179-F239 HydrophobicContact CE1-CE1 4.31Å; F179-F239 HydrophobicContact CE2-CD1 4.38Å; F179-F239 HydrophobicContact CE2-CE1 4.01Å; F179-F239 AromaticContact CZ-CD1 3.65Å; F179-F239 HydrophobicContact CZ-CD1 3.65Å; F179-F239 AromaticContact CZ-CE1 3.62Å; F179-F239 HydrophobicContact CZ-CE1 3.62Å; F179-F242 HydrophobicContact CB-CE1 3.78Å; F179-F242 HydrophobicContact CB-CZ 4.01Å; F179-F242 HydrophobicContact CD1-CD1 4.11Å; F179-F242 AromaticContact CD1-CE1 3.9Å; F179-F242 HydrophobicContact CD1-CE1 3.9Å; F179-F242 HydrophobicContact CG-CE1 4.3Å; F179-L469 HydrophobicContact CB-CB 4.31Å; F179-L469 HydrophobicContact CD2-CD2 3.63Å; F179-L469 HydrophobicContact CE2-CD2 3.86Å; F179-L469 HydrophobicContact CG-CD2 4.01Å; F179-L469 HydrophobicContact CZ-CD2 4.4Å
180	G	95.6	Very high	93.3	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.2	-44.5	178.2	0	0	0	0	0	112.9	I177 L178 V182 L183 S184 F466 P467	I177-G180 PolarHBondContact O-N 3.06Å; I177-G180 VanDerWaalsContact O-N 3.16Å; L178-G180 VanDerWaalsContact C-N 3.34Å; L178-G180 PolarHBondContact O-N 3.43Å; G180-V182 PolarHBondContact O-N 3.09Å; G180-L183 PolarHBondContact O-N 2.86Å; G180-S184 WeakPolarHBondContact O-CB 3.31Å; G180-S184 PolarHBondContact O-N 3.08Å; G180-S184 PolarHBondContact O-OG 3.4Å; G180-F466 VanDerWaalsContact C-CZ 3.41Å; G180-P467 WeakPolarHBondContact CA-O 3.48Å
181	V	95.1	Very high	93.4	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.018	13%	0.134	C	C	.	.	H	α-helix	trans	-62	-45.2	179.5	170.9	0	0	0	0	111.8	L148 A151 I177 L178 S184 A185 M458 F466	L148-V181 HydrophobicContact CD1-CG2 3.91Å; A151-V181 HydrophobicContact CB-CG1 3.43Å; A151-V181 VanDerWaalsContact CB-CG1 3.43Å; I177-V181 HydrophobicContact CG2-CG2 4.09Å; I177-V181 WeakPolarHBondContact O-CG2 3.04Å; I177-V181 PolarHBondContact O-N 3.3Å; L178-V181 PolarHBondContact O-N 2.92Å; V181-S184 PolarHBondContact O-N 3.18Å; V181-A185 WeakPolarHBondContact O-CB 3.13Å; V181-A185 PolarHBondContact O-N 3.15Å; V181-M458 HydrophobicContact CG1-SD 4.06Å; V181-M458 HydrophobicContact CG2-CE 3.64Å; V181-M458 HydrophobicContact CG2-SD 4.08Å; V181-F466 HydrophobicContact CG2-CE2 4.15Å; V181-F466 HydrophobicContact CG2-CZ 4Å
182	V	96.5	Very high	93.1	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	14%	0.14	C	C	.	.	H	α-helix	trans	-67.6	-43.1	-179.9	170.8	0	0	0	0	110.7	L157 I163 L178 G180 A185 A186 L225 I227	L157-V182 HydrophobicContact CD1-CG2 4Å; I163-V182 HydrophobicContact CB-CG1 4.25Å; I163-V182 HydrophobicContact CD1-CB 4.5Å; I163-V182 HydrophobicContact CD1-CG1 3.89Å; I163-V182 HydrophobicContact CD1-CG2 3.85Å; I163-V182 HydrophobicContact CG2-CG1 4.19Å; I163-V182 HydrophobicContact CG2-CG2 4.1Å; L178-V182 HydrophobicContact CD1-CG2 3.73Å; L178-V182 HydrophobicContact CG-CG2 3.98Å; L178-V182 VanDerWaalsContact O-CB 3.3Å; L178-V182 WeakPolarHBondContact O-CB 3.24Å; L178-V182 WeakPolarHBondContact O-CG2 3.34Å; L178-V182 PolarHBondContact O-N 2.9Å; G180-V182 PolarHBondContact O-N 3.09Å; V182-A185 WeakPolarHBondContact O-CB 3.34Å; V182-A185 PolarHBondContact O-N 2.89Å; V182-A186 PolarHBondContact O-N 3.01Å; V182-L225 HydrophobicContact CG1-CD2 4.39Å; V182-I227 HydrophobicContact CG1-CD1 3.74Å; V182-I227 HydrophobicContact CG1-CG1 3.73Å; V182-I227 HydrophobicContact CG1-CG2 4.3Å
183	L	96	Very high	92.9	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	14%	0.141	C	C	.	.	H	α-helix	trans	-63.7	-43.2	175.7	-176	59.1	0	0	0	111.6	F179 G180 A185 A186 K187 I227 F242 L243 P467	F179-L183 WeakPolarHBondContact O-CB 3.37Å; F179-L183 PolarHBondContact O-N 3.29Å; G180-L183 PolarHBondContact O-N 2.86Å; L183-A185 VanDerWaalsContact C-N 3.28Å; L183-A185 PolarHBondContact O-N 3.13Å; L183-A186 PolarHBondContact O-N 2.92Å; L183-K187 HydrophobicContact CD1-CG 4.35Å; L183-K187 HydrophobicContact CG-CD 4.32Å; L183-K187 WeakPolarHBondContact O-CB 3.4Å; L183-K187 WeakPolarHBondContact O-CG 3.44Å; L183-K187 PolarHBondContact O-N 3.43Å; L183-I227 HydrophobicContact CB-CD1 4.49Å; L183-I227 HydrophobicContact CD1-CD1 4.17Å; L183-F242 HydrophobicContact CB-CE1 4.19Å; L183-F242 HydrophobicContact CB-CZ 4.16Å; L183-F242 HydrophobicContact CD2-CD1 4.34Å; L183-F242 HydrophobicContact CD2-CE1 3.71Å; L183-F242 HydrophobicContact CD2-CE2 4.15Å; L183-F242 HydrophobicContact CD2-CZ 3.61Å; L183-L243 HydrophobicContact CD1-CD2 4.31Å; L183-P467 HydrophobicContact CD2-CB 4.09Å; L183-P467 HydrophobicContact CD2-CG 4.42Å
184	S	94.4	Very high	92.5	Very high	23 Å²	23	30.4 Å²	30.4	16%	0.161	15%	0.154	C	C	.	.	H	α-helix	trans	-61.8	-34.7	174.1	-66.8	0	0	0	0	112.6	G180 V181 R188 P467	G180-S184 WeakPolarHBondContact O-CB 3.31Å; G180-S184 PolarHBondContact O-N 3.08Å; G180-S184 PolarHBondContact O-OG 3.4Å; V181-S184 PolarHBondContact O-N 3.18Å; S184-R188 WeakPolarHBondContact O-CB 3.44Å; S184-R188 WeakPolarHBondContact O-CG 3.35Å; S184-R188 PolarHBondContact O-N 2.9Å; S184-R188 PolarHBondContact O-NE 2.82Å; S184-P467 WeakPolarHBondContact OG-CD 3.5Å; S184-P467 WeakPolarHBondContact OG-CG 3.27Å
185	A	94.4	Very high	91.7	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-69	-45.5	173.7	0	0	0	0	0	111.7	P155 L157 V181 V182 L183 R188 R189 L225	P155-A185 WeakPolarHBondContact O-CB 3.33Å; L157-A185 HydrophobicContact CD1-CB 4.21Å; V181-A185 WeakPolarHBondContact O-CB 3.13Å; V181-A185 PolarHBondContact O-N 3.15Å; V182-A185 WeakPolarHBondContact O-CB 3.34Å; V182-A185 PolarHBondContact O-N 2.89Å; L183-A185 VanDerWaalsContact C-N 3.28Å; L183-A185 PolarHBondContact O-N 3.13Å; A185-R188 PolarHBondContact O-N 3.27Å; A185-R189 WeakPolarHBondContact O-CG 3.22Å; A185-R189 PolarHBondContact O-N 3.07Å; A185-L225 HydrophobicContact CB-CD2 4.01Å
186	A	94.9	Very high	90.5	Very high	9 Å²	9	35.6 Å²	35.6	7%	0.074	17%	0.17	C	C	.	.	H	α-helix	trans	-60.5	-48.5	177.3	0	0	0	0	0	111.9	V182 L183 R188 R189 S190 L225 I227	V182-A186 PolarHBondContact O-N 3.01Å; L183-A186 PolarHBondContact O-N 2.92Å; A186-R188 VanDerWaalsContact C-N 3.34Å; A186-R188 PolarHBondContact O-N 3.48Å; A186-R189 PolarHBondContact O-N 3.48Å; A186-S190 PolarHBondContact O-N 2.8Å; A186-L225 HydrophobicContact CB-CB 4.2Å; A186-L225 HydrophobicContact CB-CD2 4.35Å; A186-I227 HydrophobicContact CB-CD1 3.92Å; A186-I227 HydrophobicContact CB-CG1 4.41Å
187	K	93.2	Very high	89.4	Confident	129 Å²	129	42.7 Å²	42.7	56%	0.561	20%	0.204	S	C	*	.	H	α-helix	trans	-58.5	-42.4	176.2	-73.6	-177.3	176.9	-177.5	0	112.4	L183 S190 K191	L183-K187 HydrophobicContact CD1-CG 4.35Å; L183-K187 HydrophobicContact CG-CD 4.32Å; L183-K187 WeakPolarHBondContact O-CB 3.4Å; L183-K187 WeakPolarHBondContact O-CG 3.44Å; L183-K187 PolarHBondContact O-N 3.43Å; K187-S190 PolarHBondContact O-N 3.46Å; K187-K191 WeakPolarHBondContact O-CB 3.44Å; K187-K191 PolarHBondContact O-N 3.06Å
188	R	91.4	Very high	88.2	Confident	87 Å²	87	47.5 Å²	47.5	33%	0.328	23%	0.229	S	C	.	.	H	α-helix	trans	-63.1	-44.4	175.7	-82.5	-180	-70.1	140.4	-10.7	112.3	P155 N156 S184 A185 A186 K191 L192	P155-R188 VanDerWaalsContact C-NH1 3.34Å; P155-R188 PolarHBondContact O-NH1 2.67Å; P155-R188 PolarHBondContact O-NH2 3.26Å; N156-R188 PolarHBondContact OD1-NH1 2.91Å; S184-R188 WeakPolarHBondContact O-CB 3.44Å; S184-R188 WeakPolarHBondContact O-CG 3.35Å; S184-R188 PolarHBondContact O-N 2.9Å; S184-R188 PolarHBondContact O-NE 2.82Å; A185-R188 PolarHBondContact O-N 3.27Å; A186-R188 VanDerWaalsContact C-N 3.34Å; A186-R188 PolarHBondContact O-N 3.48Å; R188-K191 PolarHBondContact O-N 3.39Å; R188-L192 VanDerWaalsContact O-CG 3.3Å; R188-L192 WeakPolarHBondContact O-CG 3.41Å; R188-L192 PolarHBondContact O-N 3.45Å; R188-L192 VanDerWaalsContact O-N 3.11Å
189	R	92.3	Very high	86.6	Confident	1 Å²	1	51.1 Å²	51.1	0%	0.004	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-44.7	175.9	-68.5	-167.9	-168.8	-177.1	5.7	111.6	N156 L157 S158 Y160 A185 A186 K191 L192 H193 P223	N156-R189 VanDerWaalsContact O-CZ 3.22Å; N156-R189 PolarHBondContact O-NE 2.98Å; N156-R189 PolarHBondContact O-NH2 3.38Å; L157-R189 PolarHBondContact O-NH2 2.9Å; S158-R189 VanDerWaalsContact CA-NH2 3.33Å; Y160-R189 PolarHBondContact O-NH1 3.22Å; Y160-R189 PolarHBondContact O-NH2 2.8Å; A185-R189 WeakPolarHBondContact O-CG 3.22Å; A185-R189 PolarHBondContact O-N 3.07Å; A186-R189 PolarHBondContact O-N 3.48Å; R189-K191 PolarHBondContact O-N 3.5Å; R189-L192 WeakPolarHBondContact O-CB 3.47Å; R189-L192 PolarHBondContact O-N 3.19Å; R189-L192 VanDerWaalsContact O-N 3.14Å; R189-H193 PolarHBondContact O-CD2 2.97Å; R189-H193 PolarHBondContact O-N 3.37Å; R189-H193 VanDerWaalsContact O-N 3.07Å; R189-P223 VanDerWaalsContact CD-O 3.25Å; R189-P223 WeakPolarHBondContact CD-O 3.47Å; R189-P223 PolarHBondContact NH1-O 2.74Å
190	S	91	Very high	84.8	Confident	47 Å²	47	58.4 Å²	58.4	33%	0.329	29%	0.292	S	S	.	.	H	α-helix	trans	-58.7	-47.6	176.9	-177.9	0	0	0	0	111.7	A186 K187 L192 H193 S194	A186-S190 PolarHBondContact O-N 2.8Å; K187-S190 PolarHBondContact O-N 3.46Å; S190-L192 VanDerWaalsContact C-N 3.26Å; S190-L192 PolarHBondContact O-N 2.84Å; S190-H193 WeakPolarHBondContact O-CB 3.38Å; S190-H193 PolarHBondContact O-N 3.41Å; S190-S194 PolarHBondContact O-N 2.72Å
191	K	88.3	Confident	83	Confident	116 Å²	116	62.7 Å²	62.7	50%	0.504	32%	0.315	S	S	.	.	H	α-helix	trans	-57.6	-35.7	174.9	-174.6	175	-177.1	172.4	0	113	K187 R188 R189 S194 L195	K187-K191 WeakPolarHBondContact O-CB 3.44Å; K187-K191 PolarHBondContact O-N 3.06Å; R188-K191 PolarHBondContact O-N 3.39Å; R189-K191 PolarHBondContact O-N 3.5Å; K191-S194 PolarHBondContact O-OG 3.44Å; K191-L195 HydrophobicContact CG-CD1 4.47Å; K191-L195 WeakPolarHBondContact O-CD1 3.36Å; K191-L195 WeakPolarHBondContact O-CG 3.45Å; K191-L195 PolarHBondContact O-N 3.28Å
192	L	84.9	Confident	81	Confident	44 Å²	44	67.8 Å²	67.8	23%	0.23	35%	0.35	C	S	.	.	H	α-helix	trans	-70.7	-35.2	176.1	-69.5	171.9	0	0	0	112.5	R188 R189 S190 I211 F221	R188-L192 VanDerWaalsContact O-CG 3.3Å; R188-L192 WeakPolarHBondContact O-CG 3.41Å; R188-L192 PolarHBondContact O-N 3.45Å; R188-L192 VanDerWaalsContact O-N 3.11Å; R189-L192 WeakPolarHBondContact O-CB 3.47Å; R189-L192 PolarHBondContact O-N 3.19Å; R189-L192 VanDerWaalsContact O-N 3.14Å; S190-L192 VanDerWaalsContact C-N 3.26Å; S190-L192 PolarHBondContact O-N 2.84Å; L192-I211 HydrophobicContact CD2-CD1 3.45Å; L192-I211 VanDerWaalsContact CD2-CD1 3.45Å; L192-I211 HydrophobicContact CD2-CG2 3.87Å; L192-F221 HydrophobicContact CB-CD1 4.24Å; L192-F221 HydrophobicContact CB-CE1 4.12Å; L192-F221 WeakPolarHBondContact O-CE1 3.48Å
193	H	85.2	Confident	78.9	Confident	39 Å²	39	75 Å²	75	18%	0.181	39%	0.388	C	S	.	.	H	α-helix	trans	-69.2	-44.6	174	-85.2	-89.8	0	0	0	111.9	R189 S190 L195 R196 E197 L222 L224	R189-H193 PolarHBondContact O-CD2 2.97Å; R189-H193 PolarHBondContact O-N 3.37Å; R189-H193 VanDerWaalsContact O-N 3.07Å; S190-H193 WeakPolarHBondContact O-CB 3.38Å; S190-H193 PolarHBondContact O-N 3.41Å; H193-L195 VanDerWaalsContact C-N 3.26Å; H193-L195 PolarHBondContact O-N 3.14Å; H193-R196 VanDerWaalsContact O-CB 3.29Å; H193-R196 WeakPolarHBondContact O-CB 3.36Å; H193-R196 PolarHBondContact O-N 3.46Å; H193-E197 PolarHBondContact O-N 2.87Å; H193-L222 PolarHBondContact NE2-O 2.96Å; H193-L224 HydrophobicContact CB-CD2 4.19Å
194	S	83.8	Confident	76.7	Confident	61 Å²	61	76.9 Å²	76.9	43%	0.427	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-33.5	178.8	68	0	0	0	0	112.9	S190 K191 R196 E197 N198	S190-S194 PolarHBondContact O-N 2.72Å; K191-S194 PolarHBondContact O-OG 3.44Å; S194-R196 VanDerWaalsContact C-N 3.26Å; S194-R196 PolarHBondContact O-N 3Å; S194-E197 PolarHBondContact O-N 3.06Å; S194-N198 PolarHBondContact O-N 3.46Å
195	L	75.1	Confident	74.7	Confident	24 Å²	24	79.3 Å²	79.3	13%	0.126	41%	0.413	C	S	.	.	H	α-helix	trans	-68.1	-23.5	174.7	-73.3	171.8	0	0	0	113.4	K191 H193 L204	K191-L195 HydrophobicContact CG-CD1 4.47Å; K191-L195 WeakPolarHBondContact O-CD1 3.36Å; K191-L195 WeakPolarHBondContact O-CG 3.45Å; K191-L195 PolarHBondContact O-N 3.28Å; H193-L195 VanDerWaalsContact C-N 3.26Å; H193-L195 PolarHBondContact O-N 3.14Å; L195-L204 HydrophobicContact CD1-CD2 4.41Å; L195-L204 HydrophobicContact CD2-CD1 3.94Å; L195-L204 HydrophobicContact CD2-CD2 3.78Å; L195-L204 HydrophobicContact CD2-CG 3.93Å
196	R	69.8	Low	72.6	Confident	154 Å²	154	84 Å²	84	58%	0.581	45%	0.446	S	S	*	.	H	α-helix	trans	-78.3	-40.3	175.9	-177.5	-173.3	175.5	-161.7	-1.6	111.4	H193 S194 N198	H193-R196 VanDerWaalsContact O-CB 3.29Å; H193-R196 WeakPolarHBondContact O-CB 3.36Å; H193-R196 PolarHBondContact O-N 3.46Å; S194-R196 VanDerWaalsContact C-N 3.26Å; S194-R196 PolarHBondContact O-N 3Å; R196-N198 VanDerWaalsContact C-N 3.32Å
197	E	70.4	Confident	70.7	Confident	151 Å²	151	91.6 Å²	91.6	71%	0.706	48%	0.477	S	S	*	.	H	α-helix	trans	-70.9	-30.1	-179.6	-66.7	-179.6	167.7	0	0	112	H193 S194	H193-E197 PolarHBondContact O-N 2.87Å; S194-E197 PolarHBondContact O-N 3.06Å
198	N	68.2	Low	68.7	Low	104 Å²	104	87 Å²	87	56%	0.556	46%	0.459	S	S	*	.			trans	-130.5	77.1	178.8	-74	-48.1	0	0	0	112.3	S194 R196 N200	S194-N198 PolarHBondContact O-N 3.46Å; R196-N198 VanDerWaalsContact C-N 3.32Å; N198-N200 PolarHBondContact O-N 2.97Å
199	P	61.7	Low	66.7	Low	76 Å²	76	87.4 Å²	87.4	49%	0.494	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-21.4	-177.2	25.2	-33.1	0	0	0	113.9
200	N	59.2	Low	65	Low	156 Å²	156	89.7 Å²	89.7	83%	0.834	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	6.9	-174.3	-67.3	-14.9	0	0	0	114.5	N198 S202	N198-N200 PolarHBondContact O-N 2.97Å; N200-S202 PolarHBondContact O-N 3.4Å; N200-S202 VanDerWaalsContact O-N 3.15Å
201	N	57.4	Low	63.3	Low	90 Å²	90	89.5 Å²	89.5	48%	0.481	49%	0.486	S	S	.	.			trans	-71.9	111.7	-178.1	-146.4	-12.3	0	0	0	110.6	L203	N201-L203 VanDerWaalsContact C-N 3.25Å; N201-L203 PolarHBondContact O-N 3.07Å
202	S	52.9	Low	61.5	Low	109 Å²	109	89.8 Å²	89.8	76%	0.762	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-7.6	-167.4	53.4	0	0	0	0	115.2	N200 L204	N200-S202 PolarHBondContact O-N 3.4Å; N200-S202 VanDerWaalsContact O-N 3.15Å; S202-L204 PolarHBondContact O-N 3.08Å
203	L	53.4	Low	60.1	Low	154 Å²	154	94.5 Å²	94.5	81%	0.806	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	16.5	-179.7	-79.4	149.4	0	0	0	114.7	N201 P205	N201-L203 VanDerWaalsContact C-N 3.25Å; N201-L203 PolarHBondContact O-N 3.07Å; L203-P205 VanDerWaalsContact O-CD 3.3Å; L203-P205 WeakPolarHBondContact O-CD 3.35Å
204	L	49.2	Very low	58.5	Low	41 Å²	41	95.7 Å²	95.7	22%	0.215	51%	0.51	C	S	.	.			trans	-74.2	118.8	-176.7	-102	148.3	0	0	0	111.8	L195 S202 S206 L208	L195-L204 HydrophobicContact CD1-CD2 4.41Å; L195-L204 HydrophobicContact CD2-CD1 3.94Å; L195-L204 HydrophobicContact CD2-CD2 3.78Å; L195-L204 HydrophobicContact CD2-CG 3.93Å; S202-L204 PolarHBondContact O-N 3.08Å; L204-S206 PolarHBondContact O-N 3.17Å; L204-L208 HydrophobicContact CD2-CB 3.93Å; L204-L208 HydrophobicContact CD2-CD1 3.97Å
205	P	52.9	Low	57.1	Low	73 Å²	73	95.2 Å²	95.2	47%	0.474	50%	0.502	S	S	.	.			trans	-57.5	135.3	173.4	-20.6	28.1	0	0	0	111.6	L203 K207 L208	L203-P205 VanDerWaalsContact O-CD 3.3Å; L203-P205 WeakPolarHBondContact O-CD 3.35Å; P205-K207 PolarHBondContact O-N 3.41Å; P205-L208 HydrophobicContact CB-CD1 4.32Å; P205-L208 HydrophobicContact CG-CD1 4.09Å; P205-L208 WeakPolarHBondContact O-CB 3.25Å; P205-L208 PolarHBondContact O-N 3.24Å
206	S	49.8	Very low	56	Low	99 Å²	99	101.8 Å²	101.8	69%	0.692	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-52	-25.5	178.3	56.9	0	0	0	0	114.1	L204 L208 N209	L204-S206 PolarHBondContact O-N 3.17Å; S206-L208 PolarHBondContact O-N 3.25Å; S206-L208 VanDerWaalsContact O-N 3.09Å; S206-N209 PolarHBondContact O-N 3.5Å
207	K	53.7	Low	55.3	Low	168 Å²	168	100.1 Å²	100.1	73%	0.73	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-62.6	-8.1	174.1	-76.3	178.7	173.9	175.6	0	114.4	P205 E496	P205-K207 PolarHBondContact O-N 3.41Å; K207-E496 IonicContact NZ-OE1 2.76Å; K207-E496 PolarHBondContact NZ-OE1 3.44Å; K207-E496 IonicContact NZ-OE2 3.99Å
208	L	51.6	Low	54.4	Low	33 Å²	33	100.4 Å²	100.4	17%	0.173	54%	0.541	C	S	.	.	G	3₁₀ helix	trans	-102.5	10.5	-177.5	-77.8	148.8	0	0	0	115.3	L204 P205 S206 G210 I211	L204-L208 HydrophobicContact CD2-CB 3.93Å; L204-L208 HydrophobicContact CD2-CD1 3.97Å; P205-L208 HydrophobicContact CB-CD1 4.32Å; P205-L208 HydrophobicContact CG-CD1 4.09Å; P205-L208 WeakPolarHBondContact O-CB 3.25Å; P205-L208 PolarHBondContact O-N 3.24Å; S206-L208 PolarHBondContact O-N 3.25Å; S206-L208 VanDerWaalsContact O-N 3.09Å; L208-G210 PolarHBondContact O-N 3.39Å; L208-I211 HydrophobicContact CD2-CB 4.29Å; L208-I211 HydrophobicContact CD2-CD1 3.19Å; L208-I211 HydrophobicContact CD2-CG1 3.62Å; L208-I211 WeakPolarHBondContact O-CB 3.36Å; L208-I211 PolarHBondContact O-N 3.22Å
209	N	50.7	Low	53.8	Low	96 Å²	96	101 Å²	101	51%	0.513	54%	0.539	S	S	.	.	H	α-helix	trans	-55.1	-25	178.3	-80.1	-19.1	0	0	0	114.5	S206 I211	S206-N209 PolarHBondContact O-N 3.5Å; N209-I211 VanDerWaalsContact C-N 3.33Å
210	G	56.7	Low	53.8	Low	48 Å²	48	104.1 Å²	104.1	50%	0.495	56%	0.557	S	S	.	*	H	α-helix	trans	-67.9	-29.3	172.7	0	0	0	0	0	114.1	L208 K213 D214	L208-G210 PolarHBondContact O-N 3.39Å; G210-K213 PolarHBondContact O-N 3.17Å; G210-D214 PolarHBondContact O-N 3.19Å
211	I	54.2	Low	54.4	Low	43 Å²	43	99.5 Å²	99.5	22%	0.221	53%	0.529	C	S	.	.	H	α-helix	trans	-79	-35.6	-177.2	-53.2	-151.9	0	0	0	110.9	L192 L208 N209 K213 D214 I215	L192-I211 HydrophobicContact CD2-CD1 3.45Å; L192-I211 VanDerWaalsContact CD2-CD1 3.45Å; L192-I211 HydrophobicContact CD2-CG2 3.87Å; L208-I211 HydrophobicContact CD2-CB 4.29Å; L208-I211 HydrophobicContact CD2-CD1 3.19Å; L208-I211 HydrophobicContact CD2-CG1 3.62Å; L208-I211 WeakPolarHBondContact O-CB 3.36Å; L208-I211 PolarHBondContact O-N 3.22Å; N209-I211 VanDerWaalsContact C-N 3.33Å; I211-K213 VanDerWaalsContact C-N 3.26Å; I211-K213 PolarHBondContact O-N 2.83Å; I211-D214 PolarHBondContact O-N 2.78Å; I211-D214 VanDerWaalsContact O-N 3.11Å; I211-I215 HydrophobicContact CG2-CD1 4.05Å; I211-I215 HydrophobicContact CG2-CG1 4.45Å; I211-I215 WeakPolarHBondContact O-CG1 2.96Å; I211-I215 PolarHBondContact O-N 2.78Å
212	R	51.6	Low	55.6	Low	122 Å²	122	97.8 Å²	97.8	46%	0.46	52%	0.52	S	S	.	.	H	α-helix	trans	-56.4	-40.9	169.7	-76.2	-177.4	174	166.2	-2.4	111.9	I215 Q216	R212-I215 PolarHBondContact O-N 2.99Å; R212-Q216 WeakPolarHBondContact O-CG 3.41Å; R212-Q216 PolarHBondContact O-N 3.13Å
213	K	53.7	Low	57.3	Low	143 Å²	143	93.7 Å²	93.7	62%	0.622	49%	0.491	S	S	*	.	H	α-helix	trans	-68	-34.9	174.9	-71	-174.7	176.5	-178.1	0	113.3	G210 I211 N217	G210-K213 PolarHBondContact O-N 3.17Å; I211-K213 VanDerWaalsContact C-N 3.26Å; I211-K213 PolarHBondContact O-N 2.83Å; K213-N217 WeakPolarHBondContact O-CB 3.49Å; K213-N217 VanDerWaalsContact O-CG 3.25Å; K213-N217 PolarHBondContact O-N 3.43Å; K213-N217 PolarHBondContact O-ND2 2.92Å
214	D	53.3	Low	59.2	Low	64 Å²	64	90 Å²	90	34%	0.342	47%	0.472	S	S	.	.	H	α-helix	trans	-73.6	-34.1	176.6	-85.8	-10.5	0	0	0	112.1	G210 I211 N217 K219	G210-D214 PolarHBondContact O-N 3.19Å; I211-D214 PolarHBondContact O-N 2.78Å; I211-D214 VanDerWaalsContact O-N 3.11Å; D214-N217 PolarHBondContact O-N 2.9Å; D214-K219 HydrophobicContact CB-CD 4.15Å; D214-K219 WeakPolarHBondContact OD1-CD 3.45Å; D214-K219 IonicContact OD1-NZ 2.78Å; D214-K219 PolarHBondContact OD1-NZ 3.11Å; D214-K219 IonicContact OD2-NZ 2.91Å; D214-K219 PolarHBondContact OD2-NZ 3.33Å
215	I	54.1	Low	61.4	Low	52 Å²	52	88.6 Å²	88.6	27%	0.267	46%	0.464	S	S	.	.	H	α-helix	trans	-62.9	-48.1	171	-69.5	160.1	0	0	0	110.6	I211 R212 N217 N218 F221	I211-I215 HydrophobicContact CG2-CD1 4.05Å; I211-I215 HydrophobicContact CG2-CG1 4.45Å; I211-I215 WeakPolarHBondContact O-CG1 2.96Å; I211-I215 PolarHBondContact O-N 2.78Å; R212-I215 PolarHBondContact O-N 2.99Å; I215-N217 PolarHBondContact O-N 2.92Å; I215-N218 PolarHBondContact O-N 3.08Å; I215-F221 HydrophobicContact CG1-CE2 4.45Å; I215-F221 HydrophobicContact CG1-CZ 3.74Å
216	Q	51.1	Low	63.4	Low	161 Å²	161	86.1 Å²	86.1	75%	0.752	45%	0.446	S	S	*	.	H	α-helix	trans	-64.6	-23.5	178.8	-75.5	174.4	-15.7	0	0	113.6	R212	R212-Q216 WeakPolarHBondContact O-CG 3.41Å; R212-Q216 PolarHBondContact O-N 3.13Å
217	N	55.3	Low	65.7	Low	120 Å²	120	81.5 Å²	81.5	64%	0.642	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	13.9	-178	-77.7	-32	0	0	0	114.5	K213 D214 I215 K219	K213-N217 WeakPolarHBondContact O-CB 3.49Å; K213-N217 VanDerWaalsContact O-CG 3.25Å; K213-N217 PolarHBondContact O-N 3.43Å; K213-N217 PolarHBondContact O-ND2 2.92Å; D214-N217 PolarHBondContact O-N 2.9Å; I215-N217 PolarHBondContact O-N 2.92Å; N217-K219 PolarHBondContact O-N 3.45Å; N217-K219 VanDerWaalsContact O-N 3.09Å
218	N	50.8	Low	67.8	Low	157 Å²	157	73.6 Å²	73.6	84%	0.84	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	33.8	179.9	-98.2	-13.3	0	0	0	114	I215 T220	I215-N218 PolarHBondContact O-N 3.08Å; N218-T220 PolarHBondContact O-N 3.08Å
219	K	56.7	Low	70	Confident	117 Å²	117	72 Å²	72	51%	0.509	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-71.4	129.1	179.7	-142.9	175.9	-173.3	176.3	0	108.9	D214 N217 F221	D214-K219 HydrophobicContact CB-CD 4.15Å; D214-K219 WeakPolarHBondContact OD1-CD 3.45Å; D214-K219 IonicContact OD1-NZ 2.78Å; D214-K219 PolarHBondContact OD1-NZ 3.11Å; D214-K219 IonicContact OD2-NZ 2.91Å; D214-K219 PolarHBondContact OD2-NZ 3.33Å; N217-K219 PolarHBondContact O-N 3.45Å; N217-K219 VanDerWaalsContact O-N 3.09Å; K219-F221 WeakPolarHBondContact O-CD2 3.26Å; K219-F221 PolarHBondContact O-N 3.31Å; K219-F221 VanDerWaalsContact O-N 3.13Å
220	T	60.6	Low	72.1	Confident	140 Å²	140	67.4 Å²	67.4	86%	0.859	35%	0.346	S	S	*	.	P	Polyproline II helix	trans	-58.5	118	-178.7	45.7	0	0	0	0	110.8	N218	N218-T220 PolarHBondContact O-N 3.08Å
221	F	71.7	Confident	73.7	Confident	60 Å²	60	65.1 Å²	65.1	26%	0.263	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-69.5	141.1	175.1	-80.5	-96.1	0	0	0	110	L192 I215 K219	L192-F221 HydrophobicContact CB-CD1 4.24Å; L192-F221 HydrophobicContact CB-CE1 4.12Å; L192-F221 WeakPolarHBondContact O-CE1 3.48Å; I215-F221 HydrophobicContact CG1-CE2 4.45Å; I215-F221 HydrophobicContact CG1-CZ 3.74Å; K219-F221 WeakPolarHBondContact O-CD2 3.26Å; K219-F221 PolarHBondContact O-N 3.31Å; K219-F221 VanDerWaalsContact O-N 3.13Å
222	L	84	Confident	75.1	Confident	54 Å²	54	63.7 Å²	63.7	28%	0.283	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-67.1	137.8	173	-62.8	174.3	0	0	0	109	N156 H193	N156-L222 HydrophobicContact CB-CD1 3.87Å; H193-L222 PolarHBondContact NE2-O 2.96Å
223	P	88.5	Confident	76.1	Confident	23 Å²	23	58.4 Å²	58.4	15%	0.149	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-62.9	155.4	176.5	29.8	-37.6	0	0	0	111	E88 R189 L225	E88-P223 HydrophobicContact CB-CB 4.28Å; E88-P223 HydrophobicContact CB-CG 4.08Å; E88-P223 WeakPolarHBondContact O-CG 3.49Å; R189-P223 VanDerWaalsContact CD-O 3.25Å; R189-P223 WeakPolarHBondContact CD-O 3.47Å; R189-P223 PolarHBondContact NH1-O 2.74Å; P223-L225 PolarHBondContact O-N 3.14Å
224	L	92.8	Very high	76.6	Confident	77 Å²	77	58 Å²	58	40%	0.403	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-56.4	136.6	175.3	-66.2	177.7	0	0	0	110.3	R161 H193	R161-L224 WeakPolarHBondContact CD-O 3.41Å; R161-L224 PolarHBondContact NE-O 3.33Å; R161-L224 PolarHBondContact NH1-O 3.27Å; H193-L224 HydrophobicContact CB-CD2 4.19Å
225	L	95.3	Very high	78	Confident	10 Å²	10	58.1 Å²	58.1	5%	0.052	30%	0.302	C	S	.	.			trans	-88.8	113.8	-178.1	-174	64.3	0	0	0	109.1	Y160 I163 V182 A185 A186 P223	Y160-L225 WeakPolarHBondContact O-CD1 3.28Å; I163-L225 HydrophobicContact CD1-CD1 3.93Å; I163-L225 HydrophobicContact CD1-CD2 3.91Å; I163-L225 HydrophobicContact CD1-CG 4.28Å; I163-L225 HydrophobicContact CG1-CD1 3.96Å; V182-L225 HydrophobicContact CG1-CD2 4.39Å; A185-L225 HydrophobicContact CB-CD2 4.01Å; A186-L225 HydrophobicContact CB-CB 4.2Å; A186-L225 HydrophobicContact CB-CD2 4.35Å; P223-L225 PolarHBondContact O-N 3.14Å
226	K	96	Very high	79.7	Confident	21 Å²	21	55.9 Å²	55.9	9%	0.091	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	133.2	174.7	-85.7	-179.5	-176.2	-74.7	0	110.7	I56 M57 S59 R161 F162 I163	I56-K226 HydrophobicContact CG2-CD 4.43Å; I56-K226 PolarHBondContact O-NZ 3.25Å; M57-K226 VanDerWaalsContact C-NZ 3.29Å; M57-K226 PolarHBondContact O-NZ 2.71Å; M57-K226 HydrophobicContact SD-CD 4.01Å; S59-K226 PolarHBondContact O-NZ 3.26Å; R161-K226 PolarHBondContact O-N 3.05Å; F162-K226 WeakPolarHBondContact CA-O 3.42Å; F162-K226 HydrophobicContact CD1-CB 3.67Å; F162-K226 HydrophobicContact CD1-CD 4.19Å; F162-K226 HydrophobicContact CE1-CB 3.9Å; F162-K226 HydrophobicContact CE1-CD 3.52Å; F162-K226 HydrophobicContact CE1-CG 4.32Å; F162-K226 HydrophobicContact CG-CB 4.47Å; F162-K226 HydrophobicContact CZ-CD 4.17Å; I163-K226 PolarHBondContact N-O 2.83Å
227	I	97.6	Very high	81.6	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.015	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	124.1	179.8	-52	176.5	0	0	0	108.5	E60 H61 C62 L165 V182 L183 A186 V229 L243	E60-I227 PolarHBondContact O-N 3.03Å; H61-I227 VanDerWaalsContact CA-O 3.31Å; H61-I227 WeakPolarHBondContact CA-O 3.43Å; C62-I227 PolarHBondContact N-O 3.05Å; L165-I227 HydrophobicContact CD1-CG2 4.46Å; V182-I227 HydrophobicContact CG1-CD1 3.74Å; V182-I227 HydrophobicContact CG1-CG1 3.73Å; V182-I227 HydrophobicContact CG1-CG2 4.3Å; L183-I227 HydrophobicContact CB-CD1 4.49Å; L183-I227 HydrophobicContact CD1-CD1 4.17Å; A186-I227 HydrophobicContact CB-CD1 3.92Å; A186-I227 HydrophobicContact CB-CG1 4.41Å; I227-V229 HydrophobicContact CG2-CG2 4.37Å; I227-L243 HydrophobicContact CD1-CD2 4.28Å; I227-L243 HydrophobicContact CG2-CD2 4.37Å
228	I	97.7	Very high	83.2	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.1	174.6	-58.2	167	0	0	0	107.6	I56 C62 I64 L80 F162 I163 I164 L165 M230	I56-I228 HydrophobicContact CD1-CD1 4.02Å; I56-I228 HydrophobicContact CG1-CD1 4.34Å; I56-I228 HydrophobicContact CG2-CD1 3.79Å; I56-I228 HydrophobicContact CG2-CG1 4.18Å; C62-I228 CarbonylContact O-C 3.59Å; C62-I228 VanDerWaalsContact O-CA 3.3Å; C62-I228 WeakPolarHBondContact O-CA 3.39Å; I64-I228 HydrophobicContact CD1-CG2 3.54Å; I64-I228 HydrophobicContact CG1-CG2 4.22Å; L80-I228 HydrophobicContact CD1-CD1 3.76Å; F162-I228 HydrophobicContact CD1-CD1 4.1Å; I163-I228 PolarHBondContact O-N 3.23Å; I164-I228 CarbonylContact C-O 3.45Å; I164-I228 VanDerWaalsContact CA-O 3.3Å; I164-I228 WeakPolarHBondContact CA-O 3.49Å; I164-I228 HydrophobicContact CD1-CD1 4.3Å; I164-I228 HydrophobicContact CG1-CB 4.11Å; I164-I228 HydrophobicContact CG1-CD1 4.06Å; I164-I228 HydrophobicContact CG2-CG2 4.39Å; L165-I228 PolarHBondContact N-O 2.86Å; I228-M230 HydrophobicContact CG2-CG 4.09Å
229	V	97	Very high	85.2	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	124.9	176.7	-177.8	0	0	0	0	107.9	C62 V63 I64 A168 F179 I227 F239 L243	C62-V229 PolarHBondContact O-N 3.22Å; V63-V229 CarbonylContact C-O 3.57Å; V63-V229 WeakPolarHBondContact CA-O 3.44Å; V63-V229 HydrophobicContact CG1-CB 4.45Å; V63-V229 HydrophobicContact CG2-CB 4.19Å; V63-V229 HydrophobicContact CG2-CG2 4.44Å; I64-V229 PolarHBondContact N-O 2.81Å; A168-V229 HydrophobicContact CB-CG1 3.63Å; F179-V229 HydrophobicContact CE1-CB 4.48Å; F179-V229 HydrophobicContact CE1-CG1 4.06Å; F179-V229 HydrophobicContact CE1-CG2 3.57Å; F179-V229 HydrophobicContact CZ-CG1 3.79Å; F179-V229 HydrophobicContact CZ-CG2 4.12Å; I227-V229 HydrophobicContact CG2-CG2 4.37Å; V229-F239 HydrophobicContact CG1-CB 4.47Å; V229-F239 HydrophobicContact CG1-CD1 4.06Å; V229-F239 HydrophobicContact CG1-CD2 4.3Å; V229-F239 HydrophobicContact CG1-CE1 4.38Å; V229-F239 HydrophobicContact CG1-CG 4.02Å; V229-L243 HydrophobicContact CG2-CD1 3.81Å
230	M	95	Very high	87	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.6	176.3	-56.1	-169.7	-53.1	0	0	109.9	I64 K72 I76 I164 L165 D166 E167 A168 I228	I64-M230 HydrophobicContact CB-CG 4.3Å; I64-M230 WeakPolarHBondContact O-CA 3.32Å; K72-M230 HydrophobicContact CB-SD 4Å; I76-M230 HydrophobicContact CB-SD 4.3Å; I76-M230 HydrophobicContact CD1-SD 3.64Å; I76-M230 HydrophobicContact CG1-SD 4.49Å; I164-M230 HydrophobicContact CG2-CE 3.33Å; I164-M230 HydrophobicContact CG2-CG 3.96Å; I164-M230 HydrophobicContact CG2-SD 3.8Å; L165-M230 PolarHBondContact O-N 2.85Å; D166-M230 HydrophobicContact CB-CB 4.49Å; D166-M230 HydrophobicContact CB-CE 3.6Å; D166-M230 VanDerWaalsContact OD1-CB 3.29Å; D166-M230 WeakPolarHBondContact OD1-CB 3.42Å; D166-M230 VanDerWaalsContact OD1-CE 3.3Å; D166-M230 WeakPolarHBondContact OD1-CE 3.42Å; D166-M230 WeakPolarHBondContact OD2-CE 3.45Å; E167-M230 PolarHBondContact N-O 2.67Å; A168-M230 PolarHBondContact N-O 3.31Å; A168-M230 VanDerWaalsContact N-O 3.09Å; I228-M230 HydrophobicContact CG2-CG 4.09Å
231	S	90.7	Very high	88.5	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	152.3	-179.4	-170.8	0	0	0	0	112.5	I64 V65 G66 H169 T233	I64-S231 PolarHBondContact O-N 2.63Å; V65-S231 WeakPolarHBondContact CA-O 3.34Å; G66-S231 PolarHBondContact N-O 3.04Å; H169-S231 WeakPolarHBondContact CB-OG 3.47Å; H169-S231 PolarHBondContact ND1-OG 2.77Å; S231-T233 PolarHBondContact OG-N 2.93Å; S231-T233 PolarHBondContact OG-OG1 2.61Å
232	A	82.5	Confident	89.6	Confident	13 Å²	13	33.7 Å²	33.7	11%	0.107	18%	0.184	C	C	.	.	S	Bend	trans	-92.6	-4.8	168.2	0	0	0	0	0	112.8	G66 T68 H169	G66-A232 WeakPolarHBondContact O-CA 3.35Å; T68-A232 HydrophobicContact CG2-CB 4.41Å; H169-A232 PolarHBondContact ND1-N 3.16Å; H169-A232 VanDerWaalsContact ND1-N 3.18Å
233	T	73.8	Confident	90.1	Very high	10 Å²	10	31.6 Å²	31.6	6%	0.061	17%	0.173	C	C	.	.			trans	-77.2	141.8	178.8	53.7	0	0	0	0	111.6	V65 H169 S231 D235	V65-T233 WeakPolarHBondContact CG1-O 3.4Å; H169-T233 HydrophobicContact CB-CG2 3.25Å; S231-T233 PolarHBondContact OG-N 2.93Å; S231-T233 PolarHBondContact OG-OG1 2.61Å; T233-D235 VanDerWaalsContact C-N 3.28Å; T233-D235 PolarHBondContact O-N 2.94Å; T233-D235 PolarHBondContact OG1-O 3.04Å
234	I	63.4	Low	90.3	Very high	136 Å²	136	31.4 Å²	31.4	70%	0.697	18%	0.176	S	C	*	.	S	Bend	trans	-69.4	-29.3	178	-62.8	170.2	0	0	0	111.3	P236	I234-P236 VanDerWaalsContact O-CD 3.26Å; I234-P236 WeakPolarHBondContact O-CD 3.5Å
235	D	83.4	Confident	90.3	Very high	65 Å²	65	31.5 Å²	31.5	35%	0.348	18%	0.181	S	C	.	.			trans	-96.4	111.1	-178	-177.1	18	0	0	0	111.8	T233 T237	T233-D235 VanDerWaalsContact C-N 3.28Å; T233-D235 PolarHBondContact O-N 2.94Å; T233-D235 PolarHBondContact OG1-O 3.04Å; D235-T237 WeakPolarHBondContact OD1-CB 3.17Å; D235-T237 PolarHBondContact OD1-N 2.93Å; D235-T237 PolarHBondContact OD1-OG1 2.72Å
236	P	89.1	Confident	90	Very high	6 Å²	6	38 Å²	38	4%	0.039	22%	0.216	C	C	.	.			trans	-88.5	-5.4	173.4	36.8	-36.6	0	0	0	113.2	V63 V65 I234 P238 F239 L240 V250 Y252	V63-P236 HydrophobicContact CG1-CB 3.84Å; V65-P236 HydrophobicContact CG2-CB 3.97Å; I234-P236 VanDerWaalsContact O-CD 3.26Å; I234-P236 WeakPolarHBondContact O-CD 3.5Å; P236-P238 VanDerWaalsContact C-CD 3.47Å; P236-F239 PolarHBondContact O-N 3.3Å; P236-L240 PolarHBondContact O-N 2.75Å; P236-V250 HydrophobicContact CB-CG1 4.02Å; P236-V250 HydrophobicContact CG-CG1 3.88Å; P236-Y252 WeakPolarHBondContact CD-OH 3.35Å; P236-Y252 VanDerWaalsContact CG-OH 3.27Å; P236-Y252 WeakPolarHBondContact CG-OH 3.4Å
237	T	91.1	Very high	89.7	Confident	64 Å²	64	41.4 Å²	41.4	39%	0.393	23%	0.232	S	C	.	.	H	α-helix	trans	-52.1	-45	-169.8	-54.7	0	0	0	0	113.4	D235 F239 L240 N241	D235-T237 WeakPolarHBondContact OD1-CB 3.17Å; D235-T237 PolarHBondContact OD1-N 2.93Å; D235-T237 PolarHBondContact OD1-OG1 2.72Å; T237-F239 VanDerWaalsContact C-N 3.27Å; T237-F239 PolarHBondContact O-N 2.97Å; T237-L240 PolarHBondContact O-N 3.01Å; T237-N241 WeakPolarHBondContact CG2-ND2 3.24Å; T237-N241 WeakPolarHBondContact O-CB 3.47Å; T237-N241 VanDerWaalsContact O-CG 3.27Å; T237-N241 PolarHBondContact O-N 3.34Å
238	P	90.1	Very high	89.6	Confident	51 Å²	51	41.5 Å²	41.5	33%	0.331	23%	0.233	S	C	.	.	H	α-helix	trans	-59.2	-38.4	177.9	-24.2	34.7	0	0	0	113	P236 F242 L469	P236-P238 VanDerWaalsContact C-CD 3.47Å; P238-F242 VanDerWaalsContact O-CB 3.22Å; P238-F242 WeakPolarHBondContact O-CB 3.14Å; P238-F242 PolarHBondContact O-N 3.45Å; P238-L469 WeakPolarHBondContact O-CD1 3.44Å
239	F	93.3	Very high	89.4	Confident	5 Å²	5	46.2 Å²	46.2	2%	0.022	26%	0.255	C	S	.	.	H	α-helix	trans	-76	-39.5	179.4	-52.9	-62.4	0	0	0	111.7	V63 A168 F179 V229 P236 T237 F242 L243 L469	V63-F239 HydrophobicContact CG1-CB 4.33Å; V63-F239 HydrophobicContact CG1-CD2 4.45Å; V63-F239 HydrophobicContact CG2-CB 4.01Å; A168-F239 HydrophobicContact CB-CE1 3.83Å; A168-F239 HydrophobicContact CB-CE2 4.44Å; A168-F239 HydrophobicContact CB-CZ 3.68Å; F179-F239 AromaticContact CE1-CD1 3.89Å; F179-F239 HydrophobicContact CE1-CD1 3.89Å; F179-F239 HydrophobicContact CE1-CE1 4.31Å; F179-F239 HydrophobicContact CE2-CD1 4.38Å; F179-F239 HydrophobicContact CE2-CE1 4.01Å; F179-F239 AromaticContact CZ-CD1 3.65Å; F179-F239 HydrophobicContact CZ-CD1 3.65Å; F179-F239 AromaticContact CZ-CE1 3.62Å; F179-F239 HydrophobicContact CZ-CE1 3.62Å; V229-F239 HydrophobicContact CG1-CB 4.47Å; V229-F239 HydrophobicContact CG1-CD1 4.06Å; V229-F239 HydrophobicContact CG1-CD2 4.3Å; V229-F239 HydrophobicContact CG1-CE1 4.38Å; V229-F239 HydrophobicContact CG1-CG 4.02Å; P236-F239 PolarHBondContact O-N 3.3Å; T237-F239 VanDerWaalsContact C-N 3.27Å; T237-F239 PolarHBondContact O-N 2.97Å; F239-F242 PolarHBondContact O-N 2.64Å; F239-L243 WeakPolarHBondContact O-CB 3.2Å; F239-L243 VanDerWaalsContact O-CG 3.3Å; F239-L243 WeakPolarHBondContact O-CG 3.46Å; F239-L243 PolarHBondContact O-N 3.34Å; F239-L469 HydrophobicContact CD1-CD1 4.11Å; F239-L469 HydrophobicContact CD1-CD2 4.09Å; F239-L469 HydrophobicContact CE1-CD2 3.83Å
240	L	93.4	Very high	89.3	Confident	28 Å²	28	47.5 Å²	47.5	15%	0.147	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-48.3	177.9	-177.9	61.6	0	0	0	111.5	P236 T237 F242 L243 G244 P245 T248 V250	P236-L240 PolarHBondContact O-N 2.75Å; T237-L240 PolarHBondContact O-N 3.01Å; L240-F242 VanDerWaalsContact C-N 3.3Å; L240-F242 PolarHBondContact O-N 2.64Å; L240-L243 PolarHBondContact O-N 3.29Å; L240-G244 CarbonylContact O-C 3.43Å; L240-G244 PolarHBondContact O-N 3.39Å; L240-P245 HydrophobicContact CD1-CB 4.23Å; L240-P245 HydrophobicContact CG-CB 4.3Å; L240-T248 HydrophobicContact CD1-CG2 3.72Å; L240-V250 HydrophobicContact CD1-CG2 4.01Å; L240-V250 HydrophobicContact CD2-CG2 4.32Å
241	N	92.8	Very high	89.2	Confident	111 Å²	111	48.9 Å²	48.9	59%	0.594	27%	0.271	S	S	*	.	H	α-helix	trans	-63	-39	178.7	-69.3	-6.6	0	0	0	111.5	T237	T237-N241 WeakPolarHBondContact CG2-ND2 3.24Å; T237-N241 WeakPolarHBondContact O-CB 3.47Å; T237-N241 VanDerWaalsContact O-CG 3.27Å; T237-N241 PolarHBondContact O-N 3.34Å
242	F	94.1	Very high	89.3	Confident	30 Å²	30	53.9 Å²	53.9	13%	0.132	29%	0.29	C	S	.	.	H	α-helix	trans	-68.2	-44.6	179.3	173.7	-103.2	0	0	0	113.3	F179 L183 P238 F239 L240 G244 P467 L469	F179-F242 HydrophobicContact CB-CE1 3.78Å; F179-F242 HydrophobicContact CB-CZ 4.01Å; F179-F242 HydrophobicContact CD1-CD1 4.11Å; F179-F242 AromaticContact CD1-CE1 3.9Å; F179-F242 HydrophobicContact CD1-CE1 3.9Å; F179-F242 HydrophobicContact CG-CE1 4.3Å; L183-F242 HydrophobicContact CB-CE1 4.19Å; L183-F242 HydrophobicContact CB-CZ 4.16Å; L183-F242 HydrophobicContact CD2-CD1 4.34Å; L183-F242 HydrophobicContact CD2-CE1 3.71Å; L183-F242 HydrophobicContact CD2-CE2 4.15Å; L183-F242 HydrophobicContact CD2-CZ 3.61Å; P238-F242 VanDerWaalsContact O-CB 3.22Å; P238-F242 WeakPolarHBondContact O-CB 3.14Å; P238-F242 PolarHBondContact O-N 3.45Å; F239-F242 PolarHBondContact O-N 2.64Å; L240-F242 VanDerWaalsContact C-N 3.3Å; L240-F242 PolarHBondContact O-N 2.64Å; F242-G244 VanDerWaalsContact C-N 3.35Å; F242-P467 HydrophobicContact CE2-CB 3.81Å; F242-P467 VanDerWaalsContact CE2-O 3.26Å; F242-P467 WeakPolarHBondContact CE2-O 3.4Å; F242-P467 HydrophobicContact CZ-CB 4.13Å; F242-L469 HydrophobicContact CB-CD1 3.56Å; F242-L469 HydrophobicContact CD1-CD1 4.14Å; F242-L469 HydrophobicContact CD2-CB 4.18Å; F242-L469 HydrophobicContact CD2-CD1 4.24Å; F242-L469 HydrophobicContact CE2-CB 4.36Å; F242-L469 HydrophobicContact CG-CB 4.37Å; F242-L469 HydrophobicContact CG-CD1 3.71Å
243	L	94.7	Very high	89.5	Confident	9 Å²	9	53.6 Å²	53.6	5%	0.047	29%	0.287	C	S	.	.	H	α-helix	trans	-79	-20.2	-178.4	-69	169.9	0	0	0	112.9	H61 V63 L183 I227 V229 F239 L240 T248	H61-L243 HydrophobicContact CB-CB 4.35Å; H61-L243 HydrophobicContact CB-CD1 4.07Å; H61-L243 HydrophobicContact CB-CD2 4.49Å; H61-L243 PolarHBondContact CD2-O 3.14Å; V63-L243 HydrophobicContact CG2-CD1 3.88Å; L183-L243 HydrophobicContact CD1-CD2 4.31Å; I227-L243 HydrophobicContact CD1-CD2 4.28Å; I227-L243 HydrophobicContact CG2-CD2 4.37Å; V229-L243 HydrophobicContact CG2-CD1 3.81Å; F239-L243 WeakPolarHBondContact O-CB 3.2Å; F239-L243 VanDerWaalsContact O-CG 3.3Å; F239-L243 WeakPolarHBondContact O-CG 3.46Å; F239-L243 PolarHBondContact O-N 3.34Å; L240-L243 PolarHBondContact O-N 3.29Å; L243-T248 HydrophobicContact CB-CG2 4.39Å; L243-T248 VanDerWaalsContact CB-OG1 3.24Å; L243-T248 WeakPolarHBondContact CB-OG1 3.3Å; L243-T248 HydrophobicContact CD1-CG2 4.25Å
244	G	93.1	Very high	89.6	Confident	20 Å²	20	59.3 Å²	59.3	21%	0.206	31%	0.313	C	S	.	.			trans	94.7	120.9	-176.6	0	0	0	0	0	111	L240 F242 D246 H247 T248	L240-G244 CarbonylContact O-C 3.43Å; L240-G244 PolarHBondContact O-N 3.39Å; F242-G244 VanDerWaalsContact C-N 3.35Å; G244-D246 VanDerWaalsContact C-N 3.3Å; G244-D246 PolarHBondContact O-N 3.44Å; G244-H247 PolarHBondContact O-N 2.67Å; G244-T248 VanDerWaalsContact O-CB 3.28Å; G244-T248 WeakPolarHBondContact O-CB 3.33Å; G244-T248 PolarHBondContact O-N 3.15Å; G244-T248 PolarHBondContact O-OG1 2.65Å
245	P	91.5	Very high	89.7	Confident	79 Å²	79	54.3 Å²	54.3	51%	0.513	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-64.4	-31	-173.3	24.8	-34	0	0	0	113.6	L240 H247 T248	L240-P245 HydrophobicContact CD1-CB 4.23Å; L240-P245 HydrophobicContact CG-CB 4.3Å; P245-H247 VanDerWaalsContact C-N 3.27Å; P245-H247 PolarHBondContact O-N 3.33Å; P245-T248 PolarHBondContact O-N 2.94Å
246	D	90.9	Very high	88.7	Confident	146 Å²	146	53.8 Å²	53.8	78%	0.781	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-70.9	-23.7	-178.2	-60.1	-42.5	0	0	0	113.2	G244	G244-D246 VanDerWaalsContact C-N 3.3Å; G244-D246 PolarHBondContact O-N 3.44Å
247	H	89.1	Confident	87.6	Confident	92 Å²	92	57.2 Å²	57.2	43%	0.426	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-104.4	-5.6	-176.5	-57.8	-82.3	0	0	0	113.1	E60 H61 G244 P245	E60-H247 HydrophobicContact CB-CB 4.28Å; E60-H247 PolarHBondContact N-O 3.32Å; E60-H247 IonicContact OE1-CE1 3.32Å; E60-H247 IonicContact OE1-CG 2.85Å; E60-H247 IonicContact OE1-ND1 3.73Å; E60-H247 PolarHBondContact OE1-ND1 3.26Å; H61-H247 PolarHBondContact N-O 3.03Å; H61-H247 VanDerWaalsContact N-O 3.15Å; G244-H247 PolarHBondContact O-N 2.67Å; P245-H247 VanDerWaalsContact C-N 3.27Å; P245-H247 PolarHBondContact O-N 3.33Å
248	T	94.3	Very high	87.1	Confident	6 Å²	6	57 Å²	57	4%	0.037	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	126.3	-166.8	-55.6	0	0	0	0	111.7	H61 V63 L240 L243 G244 P245	H61-T248 HydrophobicContact CB-CG2 4.22Å; H61-T248 WeakPolarHBondContact O-CA 3.33Å; V63-T248 HydrophobicContact CG2-CG2 3.69Å; L240-T248 HydrophobicContact CD1-CG2 3.72Å; L243-T248 HydrophobicContact CB-CG2 4.39Å; L243-T248 VanDerWaalsContact CB-OG1 3.24Å; L243-T248 WeakPolarHBondContact CB-OG1 3.3Å; L243-T248 HydrophobicContact CD1-CG2 4.25Å; G244-T248 VanDerWaalsContact O-CB 3.28Å; G244-T248 WeakPolarHBondContact O-CB 3.33Å; G244-T248 PolarHBondContact O-N 3.15Å; G244-T248 PolarHBondContact O-OG1 2.65Å; P245-T248 PolarHBondContact O-N 2.94Å
249	Q	95.2	Very high	87	Confident	100 Å²	100	59.1 Å²	59.1	47%	0.467	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	138.1	169.9	-69.5	-64.4	-38.7	0	0	110.6	T55 H61 C62 V63	T55-Q249 HydrophobicContact CG2-CB 3.75Å; T55-Q249 HydrophobicContact CG2-CG 4.24Å; H61-Q249 PolarHBondContact O-N 3.22Å; C62-Q249 CarbonylContact C-O 3.16Å; C62-Q249 WeakPolarHBondContact CA-O 3.38Å; V63-Q249 PolarHBondContact N-O 3.22Å
250	V	94.2	Very high	86.8	Confident	27 Å²	27	60.1 Å²	60.1	16%	0.164	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.3	176.3	-175.9	0	0	0	0	109.1	V63 P236 L240 Y252	V63-V250 HydrophobicContact CB-CG2 4.35Å; V63-V250 CarbonylContact O-C 3.37Å; V63-V250 VanDerWaalsContact O-CA 3.31Å; V63-V250 WeakPolarHBondContact O-CA 3.41Å; P236-V250 HydrophobicContact CB-CG1 4.02Å; P236-V250 HydrophobicContact CG-CG1 3.88Å; L240-V250 HydrophobicContact CD1-CG2 4.01Å; L240-V250 HydrophobicContact CD2-CG2 4.32Å; V250-Y252 HydrophobicContact CG1-CD2 4.18Å; V250-Y252 HydrophobicContact CG1-CE2 3.62Å
251	V	93.4	Very high	86.9	Confident	29 Å²	29	65.3 Å²	65.3	18%	0.176	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.7	178.3	-177.3	0	0	0	0	109.4	L52 T55 V63 I64 V65 I253	L52-V251 HydrophobicContact CD1-CB 4.24Å; L52-V251 HydrophobicContact CD1-CG1 3.82Å; L52-V251 HydrophobicContact CD1-CG2 4.26Å; T55-V251 HydrophobicContact CG2-CG2 3.66Å; V63-V251 PolarHBondContact O-N 3.44Å; I64-V251 CarbonylContact C-O 3.53Å; I64-V251 WeakPolarHBondContact CA-O 3.43Å; I64-V251 HydrophobicContact CG1-CB 4.49Å; V65-V251 PolarHBondContact N-O 2.67Å; V251-I253 HydrophobicContact CG1-CG1 4.47Å
252	Y	91.7	Very high	87	Confident	104 Å²	104	62.7 Å²	62.7	41%	0.408	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	123.4	172	-65.5	-89.6	0	0	0	109.6	V65 P236 V250	V65-Y252 HydrophobicContact CB-CD1 3.76Å; V65-Y252 HydrophobicContact CB-CE1 3.99Å; V65-Y252 HydrophobicContact CG1-CD1 3.75Å; V65-Y252 HydrophobicContact CG1-CE1 3.96Å; V65-Y252 HydrophobicContact CG2-CD1 4.47Å; V65-Y252 HydrophobicContact CG2-CE1 4.23Å; V65-Y252 CarbonylContact O-C 3.53Å; V65-Y252 WeakPolarHBondContact O-CA 3.49Å; P236-Y252 WeakPolarHBondContact CD-OH 3.35Å; P236-Y252 VanDerWaalsContact CG-OH 3.27Å; P236-Y252 WeakPolarHBondContact CG-OH 3.4Å; V250-Y252 HydrophobicContact CG1-CD2 4.18Å; V250-Y252 HydrophobicContact CG1-CE2 3.62Å
253	I	87.5	Confident	87.1	Confident	8 Å²	8	64.6 Å²	64.6	4%	0.041	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	108.2	172.6	-60.4	165.1	0	0	0	107.2	P44 V45 I64 V65 K72 I76 V251	P44-I253 HydrophobicContact CB-CG2 4.27Å; V45-I253 HydrophobicContact CB-CD1 4.24Å; V45-I253 HydrophobicContact CB-CG2 4.42Å; V45-I253 HydrophobicContact CG2-CD1 3.67Å; I64-I253 HydrophobicContact CG2-CD1 3.41Å; I64-I253 VanDerWaalsContact CG2-CD1 3.41Å; I64-I253 HydrophobicContact CG2-CG1 4.17Å; V65-I253 PolarHBondContact O-N 2.74Å; K72-I253 HydrophobicContact CD-CD1 4.16Å; K72-I253 HydrophobicContact CG-CD1 3.72Å; I76-I253 HydrophobicContact CD1-CD1 4.44Å; V251-I253 HydrophobicContact CG1-CG1 4.47Å
254	E	76.4	Confident	87.2	Confident	129 Å²	129	66.3 Å²	66.3	60%	0.603	34%	0.341	S	S	*	.			trans	-64.9	150.9	176.5	-172.1	169.2	-169.4	0	0	111.4	P44	P44-E254 WeakPolarHBondContact CB-O 3.47Å
255	G	64	Low	87.3	Confident	31 Å²	31	67.2 Å²	67.2	32%	0.32	34%	0.342	S	S	.	.			trans	105.8	130.5	161.8	0	0	0	0	0	115	S67	S67-G255 PolarHBondContact OG-O 3.15Å
256	R	63.1	Low	87.4	Confident	55 Å²	55	68.9 Å²	68.9	21%	0.208	36%	0.356	C	S	.	.			trans	-92.6	149.2	141	-72.2	178.1	179.9	171.1	-7.4	106.6	S67 H258 I260 W409	S67-R256 VanDerWaalsContact OG-CG 3.29Å; S67-R256 WeakPolarHBondContact OG-CG 2.97Å; R256-H258 PolarHBondContact O-N 3.13Å; R256-I260 VanDerWaalsContact NH1-CD1 3.28Å; R256-W409 VanDerWaalsContact CZ-CZ2 3.43Å; R256-W409 VanDerWaalsContact NH2-CZ2 3.26Å; R256-W409 VanDerWaalsContact NH2-NE1 3.12Å; R256-W409 PolarHBondContact NH2-O 2.79Å
257	R	65.2	Low	87.4	Confident	77 Å²	77	69.1 Å²	69.1	29%	0.291	35%	0.353	S	S	.	.	S	Bend	trans	-64.5	-31.4	173.2	-74.3	-179.1	160	178.1	-7.4	112.7	T39 S42 L43 P44	T39-R257 PolarHBondContact O-NH2 2.88Å; S42-R257 PolarHBondContact O-NE 3.06Å; S42-R257 PolarHBondContact O-NH2 3.28Å; S42-R257 VanDerWaalsContact O-NH2 3.11Å; S42-R257 PolarHBondContact OG-NH2 3.17Å; L43-R257 VanDerWaalsContact CA-NH2 3.27Å; P44-R257 HydrophobicContact CG-CG 4.31Å
258	H	81.2	Confident	87.4	Confident	59 Å²	59	68.2 Å²	68.2	27%	0.273	36%	0.357	S	S	.	.	S	Bend	trans	-141.6	148.9	-173.5	-52.9	-73.7	0	0	0	113.3	R256 E418 A419	R256-H258 PolarHBondContact O-N 3.13Å; H258-E418 PolarHBondContact NE2-O 3.47Å; H258-A419 VanDerWaalsContact CB-O 3.27Å; H258-A419 WeakPolarHBondContact CB-O 3.24Å; H258-A419 VanDerWaalsContact CD2-CA 3.46Å; H258-A419 WeakPolarHBondContact CD2-CA 3.48Å; H258-A419 PolarHBondContact CD2-N 2.73Å
259	P	88.3	Confident	87.1	Confident	97 Å²	97	70.2 Å²	70.2	63%	0.63	37%	0.367	S	S	*	.			trans	-72.9	157.9	178.8	30.7	-35.7	0	0	0	112.3	A420 G421	P259-A420 HydrophobicContact CG-CB 4.03Å; P259-A420 WeakPolarHBondContact O-CA 3.34Å; P259-G421 PolarHBondContact O-N 2.85Å; P259-G421 VanDerWaalsContact O-N 3.13Å
260	I	89.5	Confident	86.5	Confident	25 Å²	25	71.2 Å²	71.2	13%	0.128	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	119	179.8	-49.9	-175.6	0	0	0	109.1	R256 S412 G413 A415 G421 C423	R256-I260 VanDerWaalsContact NH1-CD1 3.28Å; I260-S412 WeakPolarHBondContact CD1-O 3.39Å; I260-G413 VanDerWaalsContact CD1-CA 3.5Å; I260-A415 HydrophobicContact CG2-CB 4.26Å; I260-G421 CarbonylContact C-O 3.44Å; I260-G421 WeakPolarHBondContact CA-O 3.37Å; I260-C423 HydrophobicContact CG2-CB 4.1Å
261	K	94.8	Very high	86.4	Confident	137 Å²	137	72.2 Å²	72.2	60%	0.596	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	120.6	172.5	-174.3	174.6	-178.4	176.3	0	109.1	L263 G421 V422 C423	K261-L263 HydrophobicContact CG-CG 4.45Å; K261-G421 PolarHBondContact N-O 2.88Å; K261-V422 HydrophobicContact CB-CG2 4.39Å; K261-V422 CarbonylContact O-C 3.56Å; K261-V422 WeakPolarHBondContact O-CA 3.45Å; K261-C423 PolarHBondContact O-N 3.29Å
262	I	94.9	Very high	86.4	Confident	56 Å²	56	71.1 Å²	71.1	29%	0.287	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.2	178.2	-59.6	176.6	0	0	0	108.6	W409 C423 R425	I262-W409 HydrophobicContact CD1-CE3 4.47Å; I262-W409 HydrophobicContact CD1-CZ3 4.08Å; I262-C423 WeakPolarHBondContact CA-O 3.48Å; I262-C423 HydrophobicContact CG1-CB 4.43Å; I262-R425 HydrophobicContact CG2-CG 4.35Å
263	L	96.4	Very high	86.6	Confident	71 Å²	71	66.4 Å²	66.4	37%	0.372	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	132	178.8	-67.3	175.4	0	0	0	108.9	K261 V422 C423 L424 R425	K261-L263 HydrophobicContact CG-CG 4.45Å; L263-V422 HydrophobicContact CD1-CG1 4.14Å; L263-C423 PolarHBondContact N-O 3.45Å; L263-L424 HydrophobicContact CB-CD2 3.88Å; L263-L424 HydrophobicContact CD1-CD2 3.77Å; L263-L424 HydrophobicContact CG-CD2 4.46Å; L263-L424 CarbonylContact O-C 3.47Å; L263-L424 WeakPolarHBondContact O-CA 3.46Å; L263-R425 PolarHBondContact O-N 3.25Å
264	N	95.8	Very high	86.9	Confident	45 Å²	45	67.3 Å²	67.3	24%	0.241	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	152.9	179	-56.7	-23.9	0	0	0	109.8	R425 D429	N264-R425 WeakPolarHBondContact OD1-CB 3.44Å; N264-R425 WeakPolarHBondContact OD1-CD 3.27Å; N264-D429 PolarHBondContact ND2-OD1 3.04Å; N264-D429 PolarHBondContact ND2-OD2 3.39Å
265	V	95.4	Very high	87.8	Confident	38 Å²	38	63.4 Å²	63.4	23%	0.23	35%	0.351	C	S	.	.			trans	-71.5	148.4	167.8	-65.1	0	0	0	0	110.1	Q267 L269 R425 L426 Y427 T428	V265-Q267 VanDerWaalsContact CG2-O 3.3Å; V265-Q267 WeakPolarHBondContact CG2-O 3.27Å; V265-L269 HydrophobicContact CG1-CD1 4.37Å; V265-L269 HydrophobicContact CG2-CG 4.46Å; V265-R425 PolarHBondContact N-O 3.46Å; V265-R425 VanDerWaalsContact N-O 3.13Å; V265-L426 HydrophobicContact CG1-CD2 4.4Å; V265-Y427 VanDerWaalsContact CG2-C 3.47Å; V265-T428 HydrophobicContact CG2-CG2 4.37Å; V265-T428 WeakPolarHBondContact O-CA 3.28Å
266	S	93.1	Very high	89.4	Confident	114 Å²	114	62 Å²	62	80%	0.797	34%	0.336	S	S	*	.	S	Bend	trans	-78.6	-27.6	178.9	49.6	0	0	0	0	113
267	Q	92.1	Very high	91	Very high	152 Å²	152	59.3 Å²	59.3	71%	0.71	33%	0.326	S	S	*	.	S	Bend	trans	-128.4	146.9	-177.2	-65.5	178.8	-10.3	0	0	110.5	V265	V265-Q267 VanDerWaalsContact CG2-O 3.3Å; V265-Q267 WeakPolarHBondContact CG2-O 3.27Å
268	S	89	Confident	92.5	Very high	73 Å²	73	57.9 Å²	57.9	51%	0.51	33%	0.328	S	S	.	.			trans	-63.5	140.8	176.1	-65.8	0	0	0	0	111.2	E431	S268-E431 WeakPolarHBondContact CB-OE1 3.19Å; S268-E431 VanDerWaalsContact OG-CD 3.27Å; S268-E431 PolarHBondContact OG-OE1 3.41Å
269	L	87.9	Confident	93.1	Very high	48 Å²	48	55.8 Å²	55.8	25%	0.251	32%	0.319	S	S	.	.			trans	-99.9	146.1	-176.6	-57.8	175.4	0	0	0	111.7	V265 D275 L426	V265-L269 HydrophobicContact CG1-CD1 4.37Å; V265-L269 HydrophobicContact CG2-CG 4.46Å; L269-D275 HydrophobicContact CD1-CB 3.83Å; L269-L426 HydrophobicContact CD1-CB 3.72Å; L269-L426 HydrophobicContact CD1-CD2 4.37Å; L269-L426 HydrophobicContact CD1-CG 4.47Å
270	T	83.5	Confident	93.5	Very high	121 Å²	121	51.1 Å²	51.1	74%	0.742	29%	0.289	S	S	*	.	S	Bend	trans	-90.9	-44.5	176	51.7	0	0	0	0	112.2
271	D	91	Very high	93.8	Very high	47 Å²	47	50.6 Å²	50.6	25%	0.251	29%	0.286	S	S	.	.			trans	-118.8	76.4	178.5	-169.6	-9.4	0	0	0	111.7	V273 A274 D275 R307	D271-V273 PolarHBondContact O-N 3.48Å; D271-V273 WeakPolarHBondContact OD1-CB 3.38Å; D271-V273 PolarHBondContact OD1-N 3.39Å; D271-A274 HydrophobicContact CB-CB 4.22Å; D271-A274 PolarHBondContact O-N 2.94Å; D271-A274 VanDerWaalsContact O-N 3.08Å; D271-A274 PolarHBondContact OD1-N 2.71Å; D271-D275 PolarHBondContact O-N 2.91Å; D271-D275 VanDerWaalsContact O-OD2 3.07Å; D271-R307 IonicContact OD1-NH1 2.72Å; D271-R307 PolarHBondContact OD1-NH1 3.15Å; D271-R307 VanDerWaalsContact OD1-NH1 3.15Å; D271-R307 IonicContact OD2-CZ 2.74Å; D271-R307 VanDerWaalsContact OD2-CZ 3.28Å; D271-R307 IonicContact OD2-NH1 3.28Å; D271-R307 PolarHBondContact OD2-NH1 3.43Å; D271-R307 IonicContact OD2-NH2 2.75Å; D271-R307 PolarHBondContact OD2-NH2 3.49Å
272	Y	93.6	Very high	93.7	Very high	6 Å²	6	52 Å²	52	2%	0.024	29%	0.288	C	S	.	.	H	α-helix	trans	-57.3	-18.5	178.9	62.7	-102.4	0	0	0	113.9	A276 L299 T300 E304 C381 R383 F785	Y272-A276 WeakPolarHBondContact O-CB 3.34Å; Y272-A276 PolarHBondContact O-N 3.19Å; Y272-L299 HydrophobicContact CD2-CD2 3.83Å; Y272-L299 HydrophobicContact CE2-CD2 4.05Å; Y272-T300 HydrophobicContact CE2-CG2 4.27Å; Y272-T300 WeakPolarHBondContact OH-CG2 3.4Å; Y272-E304 WeakPolarHBondContact CE2-OE2 3.31Å; Y272-E304 VanDerWaalsContact OH-CD 3.29Å; Y272-E304 PolarHBondContact OH-OE1 2.73Å; Y272-E304 PolarHBondContact OH-OE2 3.22Å; Y272-C381 HydrophobicContact CD2-CB 3.76Å; Y272-C381 HydrophobicContact CE2-CB 4.38Å; Y272-C381 HydrophobicContact CG-CB 4.2Å; Y272-R383 VanDerWaalsContact CE1-NH1 3.31Å; Y272-F785 AromaticContact CE1-CE1 3.67Å; Y272-F785 HydrophobicContact CE1-CE1 3.67Å; Y272-F785 HydrophobicContact CE1-CZ 4.11Å; Y272-F785 AromaticContact CZ-CE1 3.91Å; Y272-F785 AromaticContact CZ-CZ 3.98Å; Y272-F785 WeakPolarHBondContact OH-CE1 3.49Å; Y272-F785 WeakPolarHBondContact OH-CZ 3.39Å
273	V	95.1	Very high	93.6	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.03	28%	0.278	C	S	.	.	H	α-helix	trans	-74.9	-48.3	176.9	-176.7	0	0	0	0	110.2	D271 A276 A277 L299 E304 R307 C308	D271-V273 PolarHBondContact O-N 3.48Å; D271-V273 WeakPolarHBondContact OD1-CB 3.38Å; D271-V273 PolarHBondContact OD1-N 3.39Å; V273-A276 PolarHBondContact O-N 2.77Å; V273-A277 PolarHBondContact O-N 3.15Å; V273-L299 HydrophobicContact CG1-CD1 4.31Å; V273-L299 HydrophobicContact CG2-CD2 4.45Å; V273-E304 WeakPolarHBondContact CG1-O 3.5Å; V273-E304 HydrophobicContact CG2-CB 3.96Å; V273-E304 HydrophobicContact CG2-CG 3.94Å; V273-R307 HydrophobicContact CG1-CB 4.3Å; V273-R307 HydrophobicContact CG1-CG 4.23Å; V273-C308 HydrophobicContact CG1-CB 3.82Å
274	A	94.9	Very high	93.4	Very high	28 Å²	28	47.7 Å²	47.7	23%	0.231	27%	0.265	C	S	.	.	H	α-helix	trans	-67	-39.5	176.3	0	0	0	0	0	111.7	D271 A277 S278 L311	D271-A274 HydrophobicContact CB-CB 4.22Å; D271-A274 PolarHBondContact O-N 2.94Å; D271-A274 VanDerWaalsContact O-N 3.08Å; D271-A274 PolarHBondContact OD1-N 2.71Å; A274-A277 PolarHBondContact O-N 3.33Å; A274-S278 WeakPolarHBondContact O-CB 3.41Å; A274-S278 PolarHBondContact O-N 3.24Å; A274-S278 PolarHBondContact O-OG 3.37Å; A274-L311 HydrophobicContact CB-CD1 4.35Å
275	D	95.5	Very high	93.1	Very high	47 Å²	47	49.6 Å²	49.6	25%	0.251	28%	0.275	S	S	.	.	H	α-helix	trans	-63.9	-41.8	175.5	-72.4	-53.8	0	0	0	111.8	L269 D271 A277 S278 V279	L269-D275 HydrophobicContact CD1-CB 3.83Å; D271-D275 PolarHBondContact O-N 2.91Å; D271-D275 VanDerWaalsContact O-OD2 3.07Å; D275-A277 VanDerWaalsContact C-N 3.34Å; D275-A277 PolarHBondContact O-N 3.26Å; D275-S278 PolarHBondContact O-N 3.14Å; D275-V279 WeakPolarHBondContact O-CB 3.5Å; D275-V279 WeakPolarHBondContact O-CG2 3.47Å; D275-V279 PolarHBondContact O-N 3.18Å
276	A	97.5	Very high	92.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.1	-42.8	175.2	0	0	0	0	0	112.3	Y272 V273 C280 I297 L299 I379 L426	Y272-A276 WeakPolarHBondContact O-CB 3.34Å; Y272-A276 PolarHBondContact O-N 3.19Å; V273-A276 PolarHBondContact O-N 2.77Å; A276-C280 WeakPolarHBondContact O-CB 3.25Å; A276-C280 PolarHBondContact O-N 2.78Å; A276-I297 HydrophobicContact CB-CG2 3.88Å; A276-L299 HydrophobicContact CB-CD2 4.35Å; A276-I379 HydrophobicContact CB-CG2 4.16Å; A276-L426 HydrophobicContact CB-CD1 3.72Å
277	A	97.1	Very high	92.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.2	-45	175.6	0	0	0	0	0	111.6	V273 A274 D275 C280 I281 L311 I312 L315	V273-A277 PolarHBondContact O-N 3.15Å; A274-A277 PolarHBondContact O-N 3.33Å; D275-A277 VanDerWaalsContact C-N 3.34Å; D275-A277 PolarHBondContact O-N 3.26Å; A277-C280 WeakPolarHBondContact O-CB 3.45Å; A277-C280 PolarHBondContact O-N 3.32Å; A277-I281 WeakPolarHBondContact O-CG1 3.31Å; A277-I281 PolarHBondContact O-N 3.48Å; A277-I281 VanDerWaalsContact O-N 3.12Å; A277-L311 HydrophobicContact CB-CB 3.71Å; A277-L311 HydrophobicContact CB-CD1 4.38Å; A277-I312 HydrophobicContact CB-CG1 3.76Å; A277-L315 HydrophobicContact CB-CD1 4.3Å
278	S	95.4	Very high	91.5	Very high	47 Å²	47	54.2 Å²	54.2	33%	0.329	29%	0.288	S	S	.	.	H	α-helix	trans	-65.1	-42.8	179.2	-58.8	0	0	0	0	112.5	A274 D275 C280 I281 R282	A274-S278 WeakPolarHBondContact O-CB 3.41Å; A274-S278 PolarHBondContact O-N 3.24Å; A274-S278 PolarHBondContact O-OG 3.37Å; D275-S278 PolarHBondContact O-N 3.14Å; S278-C280 VanDerWaalsContact C-N 3.35Å; S278-I281 PolarHBondContact O-N 3.14Å; S278-R282 WeakPolarHBondContact O-CG 3.44Å; S278-R282 PolarHBondContact O-N 2.89Å
279	V	95.6	Very high	91.1	Very high	14 Å²	14	51.2 Å²	51.2	9%	0.085	27%	0.267	C	S	.	.	H	α-helix	trans	-61.4	-43.1	172.9	172.9	0	0	0	0	110.8	D275 I281 R282 I283 I379 L424 L426	D275-V279 WeakPolarHBondContact O-CB 3.5Å; D275-V279 WeakPolarHBondContact O-CG2 3.47Å; D275-V279 PolarHBondContact O-N 3.18Å; V279-I281 VanDerWaalsContact C-N 3.33Å; V279-I281 PolarHBondContact O-N 2.88Å; V279-R282 PolarHBondContact O-N 3.29Å; V279-I283 HydrophobicContact CG1-CD1 4.07Å; V279-I283 HydrophobicContact CG1-CG1 4.44Å; V279-I283 WeakPolarHBondContact O-CG1 3.33Å; V279-I283 PolarHBondContact O-N 3.01Å; V279-I379 HydrophobicContact CB-CD1 4.09Å; V279-I379 HydrophobicContact CG1-CD1 3.63Å; V279-I379 HydrophobicContact CG1-CG1 4.03Å; V279-L424 HydrophobicContact CG1-CD1 3.81Å; V279-L426 HydrophobicContact CG2-CD2 4.04Å
280	C	96.4	Very high	90.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.3	-45.4	178	179.9	0	0	0	0	112.1	A276 A277 S278 I283 H284 I297 I312 I379	A276-C280 WeakPolarHBondContact O-CB 3.25Å; A276-C280 PolarHBondContact O-N 2.78Å; A277-C280 WeakPolarHBondContact O-CB 3.45Å; A277-C280 PolarHBondContact O-N 3.32Å; S278-C280 VanDerWaalsContact C-N 3.35Å; C280-I283 PolarHBondContact O-N 3.43Å; C280-H284 WeakPolarHBondContact O-CB 3.35Å; C280-H284 PolarHBondContact O-N 2.83Å; C280-I297 HydrophobicContact CB-CD1 3.81Å; C280-I312 HydrophobicContact CB-CD1 4.15Å; C280-I312 HydrophobicContact CB-CG1 4.29Å; C280-I379 HydrophobicContact CB-CD1 3.98Å
281	I	94.6	Very high	90.8	Very high	13 Å²	13	47.6 Å²	47.6	7%	0.067	25%	0.247	C	C	.	.	H	α-helix	trans	-67.8	-39.7	177.7	-64.5	-64	0	0	0	111.9	A277 S278 V279 I283 H284 N285 I312 L315 L331	A277-I281 WeakPolarHBondContact O-CG1 3.31Å; A277-I281 PolarHBondContact O-N 3.48Å; A277-I281 VanDerWaalsContact O-N 3.12Å; S278-I281 PolarHBondContact O-N 3.14Å; V279-I281 VanDerWaalsContact C-N 3.33Å; V279-I281 PolarHBondContact O-N 2.88Å; I281-I283 VanDerWaalsContact C-N 3.33Å; I281-I283 PolarHBondContact O-N 2.98Å; I281-H284 PolarHBondContact O-N 3.42Å; I281-H284 VanDerWaalsContact O-N 3.16Å; I281-N285 WeakPolarHBondContact O-CB 3.23Å; I281-N285 PolarHBondContact O-N 3.38Å; I281-I312 HydrophobicContact CD1-CG2 4.1Å; I281-L315 HydrophobicContact CD1-CB 4.26Å; I281-L315 HydrophobicContact CG1-CB 3.75Å; I281-L315 HydrophobicContact CG1-CD1 4.21Å; I281-L331 HydrophobicContact CD1-CD2 4.1Å
282	R	93.2	Very high	90.4	Very high	167 Å²	167	50.9 Å²	50.9	63%	0.63	26%	0.264	S	S	*	.	H	α-helix	trans	-59.4	-41.4	173.1	-74.9	-172.9	-71.3	170.2	-8.3	112.6	S278 V279 S286	S278-R282 WeakPolarHBondContact O-CG 3.44Å; S278-R282 PolarHBondContact O-N 2.89Å; V279-R282 PolarHBondContact O-N 3.29Å; R282-S286 WeakPolarHBondContact O-CB 3.44Å; R282-S286 PolarHBondContact O-N 3.21Å
283	I	93.5	Very high	90.2	Very high	16 Å²	16	55.1 Å²	55.1	8%	0.082	28%	0.28	C	S	.	.	H	α-helix	trans	-64.8	-45.7	174.1	-62.5	167.3	0	0	0	110.1	V279 C280 I281 N285 S286 S289 I295 Y377 I379 L424	V279-I283 HydrophobicContact CG1-CD1 4.07Å; V279-I283 HydrophobicContact CG1-CG1 4.44Å; V279-I283 WeakPolarHBondContact O-CG1 3.33Å; V279-I283 PolarHBondContact O-N 3.01Å; C280-I283 PolarHBondContact O-N 3.43Å; I281-I283 VanDerWaalsContact C-N 3.33Å; I281-I283 PolarHBondContact O-N 2.98Å; I283-N285 VanDerWaalsContact C-N 3.31Å; I283-N285 PolarHBondContact O-N 2.65Å; I283-S286 WeakPolarHBondContact O-CB 3.36Å; I283-S286 PolarHBondContact O-N 3.01Å; I283-S289 WeakPolarHBondContact O-CB 3.43Å; I283-I295 HydrophobicContact CB-CD1 3.93Å; I283-I295 HydrophobicContact CD1-CD1 4.37Å; I283-I295 HydrophobicContact CG2-CD1 3.74Å; I283-I295 HydrophobicContact CG2-CG1 4.2Å; I283-Y377 HydrophobicContact CD1-CD1 4.32Å; I283-Y377 HydrophobicContact CD1-CG 4.42Å; I283-Y377 HydrophobicContact CG2-CD1 4Å; I283-Y377 HydrophobicContact CG2-CD2 3.93Å; I283-Y377 HydrophobicContact CG2-CE1 4.14Å; I283-Y377 HydrophobicContact CG2-CE2 4.07Å; I283-Y377 HydrophobicContact CG2-CG 3.9Å; I283-I379 HydrophobicContact CD1-CD1 3.93Å; I283-I379 HydrophobicContact CD1-CG1 4.15Å; I283-L424 HydrophobicContact CD1-CD1 3.4Å; I283-L424 HydrophobicContact CG1-CD1 4.01Å
284	H	91.4	Very high	90.1	Very high	20 Å²	20	55 Å²	55	9%	0.093	28%	0.28	C	S	.	.	H	α-helix	trans	-59.5	-41.3	-178.5	-179.8	67.7	0	0	0	112.5	C280 I281 S286 L331 R357	C280-H284 WeakPolarHBondContact O-CB 3.35Å; C280-H284 PolarHBondContact O-N 2.83Å; I281-H284 PolarHBondContact O-N 3.42Å; I281-H284 VanDerWaalsContact O-N 3.16Å; H284-S286 VanDerWaalsContact C-N 3.35Å; H284-L331 HydrophobicContact CB-CD1 4.44Å; H284-R357 PolarHBondContact ND1-NE 3.45Å
285	N	89.4	Confident	90.1	Very high	85 Å²	85	53.7 Å²	53.7	46%	0.455	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-5.8	-179	-64.9	-8.3	0	0	0	113.7	I281 I283 K287	I281-N285 WeakPolarHBondContact O-CB 3.23Å; I281-N285 PolarHBondContact O-N 3.38Å; I283-N285 VanDerWaalsContact C-N 3.31Å; I283-N285 PolarHBondContact O-N 2.65Å; N285-K287 PolarHBondContact O-N 2.77Å
286	S	88	Confident	90.2	Very high	52 Å²	52	51.4 Å²	51.4	36%	0.364	26%	0.257	S	S	.	.			trans	-74	124.9	-179	-173.7	0	0	0	0	111.4	R282 I283 H284 N288 S289	R282-S286 WeakPolarHBondContact O-CB 3.44Å; R282-S286 PolarHBondContact O-N 3.21Å; I283-S286 WeakPolarHBondContact O-CB 3.36Å; I283-S286 PolarHBondContact O-N 3.01Å; H284-S286 VanDerWaalsContact C-N 3.35Å; S286-N288 PolarHBondContact O-N 3.46Å; S286-N288 VanDerWaalsContact O-N 3.11Å; S286-S289 PolarHBondContact O-N 3.34Å
287	K	79.5	Confident	90.3	Very high	209 Å²	209	51.4 Å²	51.4	91%	0.909	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.8	175.3	-65.6	-175.5	179.1	-179.4	0	113.2	N285 S289	N285-K287 PolarHBondContact O-N 2.77Å; K287-S289 PolarHBondContact O-N 2.7Å
288	N	79.4	Confident	90.3	Very high	141 Å²	141	51.4 Å²	51.4	75%	0.754	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	6.1	-178.9	-65.4	-18.6	0	0	0	113.4	S286 P290	S286-N288 PolarHBondContact O-N 3.46Å; S286-N288 VanDerWaalsContact O-N 3.11Å; N288-P290 WeakPolarHBondContact O-CD 3.4Å
289	S	81.4	Confident	90.4	Very high	9 Å²	9	49.2 Å²	49.2	6%	0.063	24%	0.241	C	C	.	.	S	Bend	trans	-116.6	98.7	178.8	-165.8	0	0	0	0	110.1	I283 S286 K287 R357 Y377	I283-S289 WeakPolarHBondContact O-CB 3.43Å; S286-S289 PolarHBondContact O-N 3.34Å; K287-S289 PolarHBondContact O-N 2.7Å; S289-R357 PolarHBondContact O-NH2 3.12Å; S289-R357 PolarHBondContact OG-NH1 2.87Å; S289-R357 PolarHBondContact OG-NH2 2.92Å; S289-Y377 WeakPolarHBondContact CB-OH 3.44Å; S289-Y377 WeakPolarHBondContact OG-CE2 3.14Å; S289-Y377 VanDerWaalsContact OG-CZ 3.24Å; S289-Y377 PolarHBondContact OG-OH 3.14Å
290	P	82.3	Confident	90.2	Very high	54 Å²	54	48.9 Å²	48.9	35%	0.351	24%	0.239	S	C	.	.			trans	-55.8	146.6	170.5	-30.3	38.4	0	0	0	112.8	N288 D292 R293 R357	N288-P290 WeakPolarHBondContact O-CD 3.4Å; P290-D292 VanDerWaalsContact C-N 3.35Å; P290-D292 WeakPolarHBondContact CB-OD1 3.23Å; P290-D292 PolarHBondContact O-N 2.93Å; P290-R293 HydrophobicContact CB-CG 4.24Å; P290-R293 WeakPolarHBondContact O-CB 3.34Å; P290-R293 PolarHBondContact O-N 2.93Å; P290-R357 VanDerWaalsContact O-CZ 3.3Å; P290-R357 PolarHBondContact O-NH1 3.15Å; P290-R357 PolarHBondContact O-NH2 2.77Å
291	L	82.5	Confident	89.8	Confident	40 Å²	40	49.2 Å²	49.2	21%	0.209	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-25.6	-173.4	-68	170.2	0	0	0	113.9	R293 N329 R357	L291-R293 PolarHBondContact O-N 3.14Å; L291-R293 VanDerWaalsContact O-N 3.15Å; L291-N329 HydrophobicContact CD1-CB 3.84Å; L291-N329 VanDerWaalsContact CD1-CG 3.45Å; L291-N329 VanDerWaalsContact CD1-OD1 3.32Å; L291-N329 WeakPolarHBondContact CD1-OD1 2.98Å; L291-N329 HydrophobicContact CD2-CB 4.18Å; L291-R357 HydrophobicContact CD2-CB 4.23Å; L291-R357 WeakPolarHBondContact O-CA 3.36Å
292	D	81.8	Confident	89.4	Confident	115 Å²	115	51.8 Å²	51.8	62%	0.615	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-10.9	174	67.1	-35.1	0	0	0	112.9	P290	P290-D292 VanDerWaalsContact C-N 3.35Å; P290-D292 WeakPolarHBondContact CB-OD1 3.23Å; P290-D292 PolarHBondContact O-N 2.93Å
293	R	89	Confident	89	Confident	96 Å²	96	50.7 Å²	50.7	36%	0.362	26%	0.256	S	S	.	.	S	Bend	trans	-92.2	101.9	179	-57.6	-170.1	-175.1	175.8	-0.7	111.6	P290 L291 R357 G374 R376 Y377	P290-R293 HydrophobicContact CB-CG 4.24Å; P290-R293 WeakPolarHBondContact O-CB 3.34Å; P290-R293 PolarHBondContact O-N 2.93Å; L291-R293 PolarHBondContact O-N 3.14Å; L291-R293 VanDerWaalsContact O-N 3.15Å; R293-R357 PolarHBondContact O-NH1 3.16Å; R293-G374 CarbonylContact C-O 3.58Å; R293-R376 HydrophobicContact CB-CB 3.94Å; R293-R376 HydrophobicContact CB-CG 3.82Å; R293-R376 HydrophobicContact CG-CB 4.25Å; R293-R376 HydrophobicContact CG-CG 3.77Å; R293-Y377 HydrophobicContact CB-CD2 4.25Å; R293-Y377 HydrophobicContact CB-CE2 3.81Å
294	G	93.3	Very high	88.9	Confident	2 Å²	2	50.8 Å²	50.8	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	161.1	178.2	0	0	0	0	0	114.7	K358 G374 R376 Y377	G294-K358 CarbonylContact C-O 3.56Å; G294-K358 WeakPolarHBondContact CA-O 3.33Å; G294-G374 PolarHBondContact N-O 3.45Å; G294-R376 PolarHBondContact O-N 3.34Å; G294-Y377 PolarHBondContact O-N 3.44Å; G294-Y377 VanDerWaalsContact O-N 3.12Å
295	I	96.2	Very high	89.1	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	131.7	179.4	-52.8	172.6	0	0	0	109.2	I283 I297 K358 V359 I360 Y377 I379	I283-I295 HydrophobicContact CB-CD1 3.93Å; I283-I295 HydrophobicContact CD1-CD1 4.37Å; I283-I295 HydrophobicContact CG2-CD1 3.74Å; I283-I295 HydrophobicContact CG2-CG1 4.2Å; I295-I297 HydrophobicContact CG2-CG1 4.01Å; I295-K358 PolarHBondContact N-O 3.43Å; I295-V359 HydrophobicContact CB-CG1 4.43Å; I295-V359 HydrophobicContact CB-CG2 4.21Å; I295-V359 HydrophobicContact CD1-CG2 4.21Å; I295-V359 HydrophobicContact CG1-CG2 4.49Å; I295-V359 CarbonylContact O-C 3.54Å; I295-V359 WeakPolarHBondContact O-CA 3.46Å; I295-I360 PolarHBondContact O-N 2.84Å; I295-Y377 CarbonylContact C-O 3.54Å; I295-Y377 WeakPolarHBondContact CA-O 3.47Å; I295-Y377 HydrophobicContact CG1-CD2 4.41Å; I295-I379 HydrophobicContact CG2-CD1 3.88Å; I295-I379 HydrophobicContact CG2-CG1 4.15Å
296	L	97.1	Very high	89.2	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	122.5	171.6	176.2	64	0	0	0	109.8	F298 I360 A366 I372 I375 Y377 V378 I379 R414	L296-F298 HydrophobicContact CD2-CE2 3.65Å; L296-F298 HydrophobicContact CD2-CZ 3.62Å; L296-F298 HydrophobicContact CG-CD2 4.48Å; L296-F298 HydrophobicContact CG-CE2 3.94Å; L296-F298 HydrophobicContact CG-CZ 4.17Å; L296-I360 CarbonylContact C-O 3.59Å; L296-I360 WeakPolarHBondContact CA-O 3.31Å; L296-I360 HydrophobicContact CD1-CB 3.83Å; L296-I360 HydrophobicContact CD1-CG2 3.83Å; L296-A366 HydrophobicContact CD1-CB 3.95Å; L296-A366 HydrophobicContact CD2-CB 4.03Å; L296-I372 HydrophobicContact CD1-CD1 4.37Å; L296-I372 HydrophobicContact CD2-CD1 4.27Å; L296-I375 HydrophobicContact CB-CD1 4.21Å; L296-I375 HydrophobicContact CB-CG1 4.45Å; L296-I375 HydrophobicContact CB-CG2 3.79Å; L296-Y377 PolarHBondContact N-O 2.98Å; L296-V378 HydrophobicContact CB-CG2 4.41Å; L296-V378 CarbonylContact O-C 3.37Å; L296-V378 VanDerWaalsContact O-CA 3.24Å; L296-V378 WeakPolarHBondContact O-CA 3.49Å; L296-I379 PolarHBondContact O-N 3.35Å; L296-R414 HydrophobicContact CD2-CB 3.78Å; L296-R414 HydrophobicContact CD2-CG 3.82Å
297	I	98.2	Very high	89.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	128.6	-179.1	-48	-172.1	0	0	0	108.7	A276 C280 I295 L299 I312 V359 I360 V361 S362 I379	A276-I297 HydrophobicContact CB-CG2 3.88Å; C280-I297 HydrophobicContact CB-CD1 3.81Å; I295-I297 HydrophobicContact CG2-CG1 4.01Å; I297-L299 HydrophobicContact CG2-CG 4.22Å; I297-I312 HydrophobicContact CD1-CD1 3.82Å; I297-V359 HydrophobicContact CD1-CG1 4.14Å; I297-V359 HydrophobicContact CG1-CG1 4.44Å; I297-I360 PolarHBondContact N-O 3.45Å; I297-V361 HydrophobicContact CB-CB 4.49Å; I297-V361 HydrophobicContact CB-CG1 4.19Å; I297-V361 HydrophobicContact CB-CG2 4.4Å; I297-V361 HydrophobicContact CD1-CG2 4.14Å; I297-V361 HydrophobicContact CG1-CG2 4.47Å; I297-V361 HydrophobicContact CG2-CG1 4.34Å; I297-S362 PolarHBondContact O-N 2.86Å; I297-I379 CarbonylContact C-O 3.59Å; I297-I379 WeakPolarHBondContact CA-O 3.32Å; I297-I379 HydrophobicContact CB-CB 4.4Å; I297-I379 HydrophobicContact CD1-CD1 4.04Å; I297-I379 HydrophobicContact CG1-CB 4.16Å; I297-I379 HydrophobicContact CG1-CD1 4.06Å; I297-I379 HydrophobicContact CG1-CG1 4.46Å; I297-I379 HydrophobicContact CG2-CB 4.15Å; I297-I379 HydrophobicContact CG2-CG2 4.21Å
298	F	98.1	Very high	90.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	122.3	172.4	-71.2	-81.2	0	0	0	110.7	L296 S362 T363 A366 E367 V378 I379 C381 R411 R414	L296-F298 HydrophobicContact CD2-CE2 3.65Å; L296-F298 HydrophobicContact CD2-CZ 3.62Å; L296-F298 HydrophobicContact CG-CD2 4.48Å; L296-F298 HydrophobicContact CG-CE2 3.94Å; L296-F298 HydrophobicContact CG-CZ 4.17Å; F298-S362 CarbonylContact C-O 3.49Å; F298-S362 WeakPolarHBondContact CA-O 3.39Å; F298-T363 WeakPolarHBondContact CD1-O 3.5Å; F298-A366 HydrophobicContact CE1-CB 3.72Å; F298-A366 HydrophobicContact CZ-CB 3.94Å; F298-E367 HydrophobicContact CD1-CG 4.37Å; F298-E367 HydrophobicContact CE1-CG 3.73Å; F298-E367 HydrophobicContact CZ-CG 4.23Å; F298-V378 HydrophobicContact CD2-CG1 3.94Å; F298-V378 HydrophobicContact CE2-CG1 3.95Å; F298-I379 PolarHBondContact N-O 2.95Å; F298-C381 WeakPolarHBondContact O-CB 3.34Å; F298-C381 PolarHBondContact O-N 3.23Å; F298-C381 PolarHBondContact O-SG 2.87Å; F298-R411 HydrophobicContact CD1-CG 4.15Å; F298-R411 HydrophobicContact CD2-CB 3.86Å; F298-R411 HydrophobicContact CD2-CG 3.73Å; F298-R411 HydrophobicContact CE1-CG 4.11Å; F298-R411 HydrophobicContact CE2-CB 3.66Å; F298-R411 HydrophobicContact CE2-CG 3.68Å; F298-R411 HydrophobicContact CG-CG 3.96Å; F298-R411 HydrophobicContact CZ-CB 4.23Å; F298-R411 HydrophobicContact CZ-CG 3.88Å; F298-R414 HydrophobicContact CE2-CG 4.25Å; F298-R414 HydrophobicContact CZ-CG 4.07Å
299	L	97.1	Very high	91	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.177	C	C	.	.			trans	-127.7	-176.7	172.5	-65.6	-179.9	0	0	0	110	Y272 V273 A276 I297 E304 I305 C308 V361 S362 T363 C381	Y272-L299 HydrophobicContact CD2-CD2 3.83Å; Y272-L299 HydrophobicContact CE2-CD2 4.05Å; V273-L299 HydrophobicContact CG1-CD1 4.31Å; V273-L299 HydrophobicContact CG2-CD2 4.45Å; A276-L299 HydrophobicContact CB-CD2 4.35Å; I297-L299 HydrophobicContact CG2-CG 4.22Å; L299-E304 HydrophobicContact CB-CB 4.43Å; L299-E304 HydrophobicContact CD1-CB 4.33Å; L299-I305 HydrophobicContact CB-CG1 4.03Å; L299-I305 HydrophobicContact CD1-CG1 4.43Å; L299-C308 HydrophobicContact CD1-CB 3.48Å; L299-C308 VanDerWaalsContact CD1-CB 3.48Å; L299-V361 HydrophobicContact CD1-CG1 3.63Å; L299-V361 HydrophobicContact CG-CG1 4.2Å; L299-S362 PolarHBondContact N-O 3.05Å; L299-T363 WeakPolarHBondContact O-CA 3.39Å; L299-C381 HydrophobicContact CD2-CB 4.13Å
300	T	91.8	Very high	91.6	Very high	7 Å²	7	39.1 Å²	39.1	4%	0.043	19%	0.194	C	C	.	.	S	Bend	trans	-96.8	-31.2	-167.5	85.6	0	0	0	0	114.5	Y272 E304 R383 K385 V400	Y272-T300 HydrophobicContact CE2-CG2 4.27Å; Y272-T300 WeakPolarHBondContact OH-CG2 3.4Å; T300-E304 WeakPolarHBondContact CB-OE2 3.48Å; T300-E304 WeakPolarHBondContact CG2-OE2 3.29Å; T300-E304 PolarHBondContact N-OE2 3.09Å; T300-E304 PolarHBondContact OG1-OE1 3.3Å; T300-E304 PolarHBondContact OG1-OE2 3.45Å; T300-R383 HydrophobicContact CG2-CB 3.78Å; T300-K385 WeakPolarHBondContact OG1-CE 3.09Å; T300-V400 HydrophobicContact CG2-CG1 3.93Å; T300-V400 HydrophobicContact CG2-CG2 4.48Å
301	G	88.1	Confident	92.2	Very high	7 Å²	7	38.4 Å²	38.4	7%	0.072	19%	0.187	C	C	.	.	S	Bend	trans	-160.4	175.2	-173.1	0	0	0	0	0	115.4	E303 E304 I305	G301-E303 PolarHBondContact O-N 3.42Å; G301-E304 PolarHBondContact O-N 3.22Å; G301-I305 WeakPolarHBondContact O-CB 3.25Å; G301-I305 WeakPolarHBondContact O-CD1 3.12Å; G301-I305 WeakPolarHBondContact O-CG1 3.18Å; G301-I305 PolarHBondContact O-N 3.17Å
302	E	86.7	Confident	92.8	Very high	68 Å²	68	36.5 Å²	36.5	32%	0.318	18%	0.177	S	C	.	.	H	α-helix	trans	-56	-47.7	-174.2	176.1	165.9	-176.1	0	0	113.2	I305 M306 F337 S339 R662	E302-I305 PolarHBondContact O-N 3.35Å; E302-M306 WeakPolarHBondContact O-CB 3.43Å; E302-M306 VanDerWaalsContact O-CG 3.28Å; E302-M306 WeakPolarHBondContact O-CG 3.5Å; E302-M306 PolarHBondContact O-N 3.14Å; E302-F337 HydrophobicContact CB-CD1 4.43Å; E302-F337 HydrophobicContact CB-CD2 4.3Å; E302-F337 HydrophobicContact CB-CE1 4.44Å; E302-F337 HydrophobicContact CB-CE2 4.33Å; E302-F337 HydrophobicContact CB-CG 4.36Å; E302-F337 HydrophobicContact CB-CZ 4.4Å; E302-F337 HydrophobicContact CG-CD1 4.45Å; E302-F337 HydrophobicContact CG-CD2 4.2Å; E302-F337 HydrophobicContact CG-CE1 3.98Å; E302-F337 HydrophobicContact CG-CE2 3.72Å; E302-F337 HydrophobicContact CG-CZ 3.6Å; E302-S339 PolarHBondContact OE2-OG 2.76Å; E302-R662 IonicContact OE1-NH2 2.89Å; E302-R662 PolarHBondContact OE1-NH2 3.35Å; E302-R662 IonicContact OE2-NH2 3.21Å; E302-R662 PolarHBondContact OE2-NH2 3.23Å
303	E	84.4	Confident	93.3	Very high	144 Å²	144	36.3 Å²	36.3	67%	0.673	17%	0.171	S	C	*	.	H	α-helix	trans	-63.2	-47.6	-178.6	-63.7	-178.4	167.2	0	0	112.8	G301 I305 M306 R307	G301-E303 PolarHBondContact O-N 3.42Å; E303-I305 VanDerWaalsContact C-N 3.31Å; E303-I305 PolarHBondContact O-N 3.13Å; E303-M306 PolarHBondContact O-N 3.01Å; E303-R307 WeakPolarHBondContact O-CB 3.38Å; E303-R307 PolarHBondContact O-N 2.82Å
304	E	91.7	Very high	93.4	Very high	18 Å²	18	37.4 Å²	37.4	8%	0.084	18%	0.18	C	C	.	.	H	α-helix	trans	-60.7	-41.6	176	-65.8	179.5	-170.2	0	0	111.7	Y272 V273 L299 T300 G301 R307 C308	Y272-E304 WeakPolarHBondContact CE2-OE2 3.31Å; Y272-E304 VanDerWaalsContact OH-CD 3.29Å; Y272-E304 PolarHBondContact OH-OE1 2.73Å; Y272-E304 PolarHBondContact OH-OE2 3.22Å; V273-E304 WeakPolarHBondContact CG1-O 3.5Å; V273-E304 HydrophobicContact CG2-CB 3.96Å; V273-E304 HydrophobicContact CG2-CG 3.94Å; L299-E304 HydrophobicContact CB-CB 4.43Å; L299-E304 HydrophobicContact CD1-CB 4.33Å; T300-E304 WeakPolarHBondContact CB-OE2 3.48Å; T300-E304 WeakPolarHBondContact CG2-OE2 3.29Å; T300-E304 PolarHBondContact N-OE2 3.09Å; T300-E304 PolarHBondContact OG1-OE1 3.3Å; T300-E304 PolarHBondContact OG1-OE2 3.45Å; G301-E304 PolarHBondContact O-N 3.22Å; E304-R307 PolarHBondContact O-N 2.84Å; E304-C308 VanDerWaalsContact O-CB 3.29Å; E304-C308 WeakPolarHBondContact O-CB 3.26Å; E304-C308 PolarHBondContact O-N 3.12Å
305	I	94.1	Very high	93.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-62.4	-45.8	177.6	-72.3	168.1	0	0	0	110.5	L299 G301 E302 E303 C308 C309 P335 F337 V361 T363	L299-I305 HydrophobicContact CB-CG1 4.03Å; L299-I305 HydrophobicContact CD1-CG1 4.43Å; G301-I305 WeakPolarHBondContact O-CB 3.25Å; G301-I305 WeakPolarHBondContact O-CD1 3.12Å; G301-I305 WeakPolarHBondContact O-CG1 3.18Å; G301-I305 PolarHBondContact O-N 3.17Å; E302-I305 PolarHBondContact O-N 3.35Å; E303-I305 VanDerWaalsContact C-N 3.31Å; E303-I305 PolarHBondContact O-N 3.13Å; I305-C308 PolarHBondContact O-N 2.92Å; I305-C309 WeakPolarHBondContact O-CB 3.38Å; I305-C309 PolarHBondContact O-N 2.77Å; I305-C309 PolarHBondContact O-SG 3.14Å; I305-P335 HydrophobicContact CG2-CB 3.72Å; I305-F337 HydrophobicContact CB-CD1 4.2Å; I305-F337 HydrophobicContact CD1-CB 4.02Å; I305-F337 HydrophobicContact CD1-CD1 3.85Å; I305-F337 HydrophobicContact CD1-CG 4.41Å; I305-F337 HydrophobicContact CG2-CD1 3.84Å; I305-F337 HydrophobicContact CG2-CE1 4.01Å; I305-V361 HydrophobicContact CB-CG1 4.26Å; I305-V361 HydrophobicContact CG1-CG1 4.07Å; I305-V361 HydrophobicContact CG2-CB 4.04Å; I305-V361 HydrophobicContact CG2-CG1 4Å; I305-V361 WeakPolarHBondContact CG2-O 3.45Å; I305-T363 HydrophobicContact CD1-CG2 3.51Å
306	M	92.4	Very high	92.8	Very high	89 Å²	89	41 Å²	41	44%	0.438	20%	0.2	S	C	.	.	H	α-helix	trans	-68.2	-37.9	179.5	-68.7	-59.2	-66.6	0	0	111.9	E302 E303 C309 S310 P335 F337	E302-M306 WeakPolarHBondContact O-CB 3.43Å; E302-M306 VanDerWaalsContact O-CG 3.28Å; E302-M306 WeakPolarHBondContact O-CG 3.5Å; E302-M306 PolarHBondContact O-N 3.14Å; E303-M306 PolarHBondContact O-N 3.01Å; M306-C309 PolarHBondContact O-N 3.13Å; M306-S310 WeakPolarHBondContact O-CB 3Å; M306-S310 PolarHBondContact O-N 3.01Å; M306-S310 PolarHBondContact O-OG 3Å; M306-P335 HydrophobicContact SD-CB 4.21Å; M306-P335 HydrophobicContact SD-CG 4.38Å; M306-F337 HydrophobicContact CG-CE1 4.35Å; M306-F337 HydrophobicContact SD-CE1 4.18Å; M306-F337 HydrophobicContact SD-CZ 4.43Å
307	R	94.1	Very high	92	Very high	119 Å²	119	47.4 Å²	47.4	45%	0.449	23%	0.23	S	C	.	.	H	α-helix	trans	-60.9	-51.3	172	-177.2	179.3	177.5	-136.5	-4.8	110.8	D271 V273 E303 E304 C309 S310 L311	D271-R307 IonicContact OD1-NH1 2.72Å; D271-R307 PolarHBondContact OD1-NH1 3.15Å; D271-R307 VanDerWaalsContact OD1-NH1 3.15Å; D271-R307 IonicContact OD2-CZ 2.74Å; D271-R307 VanDerWaalsContact OD2-CZ 3.28Å; D271-R307 IonicContact OD2-NH1 3.28Å; D271-R307 PolarHBondContact OD2-NH1 3.43Å; D271-R307 IonicContact OD2-NH2 2.75Å; D271-R307 PolarHBondContact OD2-NH2 3.49Å; V273-R307 HydrophobicContact CG1-CB 4.3Å; V273-R307 HydrophobicContact CG1-CG 4.23Å; E303-R307 WeakPolarHBondContact O-CB 3.38Å; E303-R307 PolarHBondContact O-N 2.82Å; E304-R307 PolarHBondContact O-N 2.84Å; R307-C309 PolarHBondContact O-N 3.21Å; R307-S310 PolarHBondContact O-N 2.99Å; R307-S310 VanDerWaalsContact O-N 3.12Å; R307-L311 HydrophobicContact CG-CD1 4.08Å; R307-L311 HydrophobicContact CG-CG 4.47Å; R307-L311 WeakPolarHBondContact O-CG 3.37Å; R307-L311 PolarHBondContact O-N 2.91Å
308	C	96.3	Very high	90.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59.2	-45.1	177.4	-177.1	0	0	0	0	112	V273 L299 E304 I305 S310 L311 I312 V361	V273-C308 HydrophobicContact CG1-CB 3.82Å; L299-C308 HydrophobicContact CD1-CB 3.48Å; L299-C308 VanDerWaalsContact CD1-CB 3.48Å; E304-C308 VanDerWaalsContact O-CB 3.29Å; E304-C308 WeakPolarHBondContact O-CB 3.26Å; E304-C308 PolarHBondContact O-N 3.12Å; I305-C308 PolarHBondContact O-N 2.92Å; C308-S310 VanDerWaalsContact C-N 3.27Å; C308-S310 PolarHBondContact O-N 2.91Å; C308-L311 PolarHBondContact O-N 3.41Å; C308-I312 WeakPolarHBondContact O-CB 3.47Å; C308-I312 VanDerWaalsContact O-CG1 3.25Å; C308-I312 WeakPolarHBondContact O-CG1 3.42Å; C308-I312 PolarHBondContact O-N 2.97Å; C308-V361 HydrophobicContact CB-CG1 4.07Å
309	C	95.2	Very high	89.1	Confident	4 Å²	4	53.9 Å²	53.9	3%	0.027	27%	0.272	C	S	.	.	H	α-helix	trans	-59.7	-37.6	175.8	-71.2	0	0	0	0	112.5	I305 M306 R307 K313 V333	I305-C309 WeakPolarHBondContact O-CB 3.38Å; I305-C309 PolarHBondContact O-N 2.77Å; I305-C309 PolarHBondContact O-SG 3.14Å; M306-C309 PolarHBondContact O-N 3.13Å; R307-C309 PolarHBondContact O-N 3.21Å; C309-K313 VanDerWaalsContact O-CG 3.3Å; C309-K313 WeakPolarHBondContact O-CG 3.41Å; C309-K313 PolarHBondContact O-N 3.48Å; C309-V333 HydrophobicContact CB-CG1 4.02Å
310	S	93.3	Very high	87.1	Confident	59 Å²	59	58.8 Å²	58.8	41%	0.413	30%	0.299	S	S	.	.	H	α-helix	trans	-70.9	-44.6	178	-55.6	0	0	0	0	111.2	M306 R307 C308 K313 Q314	M306-S310 WeakPolarHBondContact O-CB 3Å; M306-S310 PolarHBondContact O-N 3.01Å; M306-S310 PolarHBondContact O-OG 3Å; R307-S310 PolarHBondContact O-N 2.99Å; R307-S310 VanDerWaalsContact O-N 3.12Å; C308-S310 VanDerWaalsContact C-N 3.27Å; C308-S310 PolarHBondContact O-N 2.91Å; S310-K313 PolarHBondContact O-N 3.35Å; S310-Q314 WeakPolarHBondContact O-CG 3.25Å; S310-Q314 PolarHBondContact O-N 2.72Å
311	L	95.1	Very high	85.3	Confident	39 Å²	39	65 Å²	65	20%	0.204	33%	0.33	C	S	.	.	H	α-helix	trans	-60	-46.5	175.3	-70.9	172.5	0	0	0	111.9	A274 A277 R307 C308 K313 Q314 L315	A274-L311 HydrophobicContact CB-CD1 4.35Å; A277-L311 HydrophobicContact CB-CB 3.71Å; A277-L311 HydrophobicContact CB-CD1 4.38Å; R307-L311 HydrophobicContact CG-CD1 4.08Å; R307-L311 HydrophobicContact CG-CG 4.47Å; R307-L311 WeakPolarHBondContact O-CG 3.37Å; R307-L311 PolarHBondContact O-N 2.91Å; C308-L311 PolarHBondContact O-N 3.41Å; L311-K313 VanDerWaalsContact C-N 3.29Å; L311-K313 PolarHBondContact O-N 2.94Å; L311-Q314 PolarHBondContact O-N 2.84Å; L311-L315 WeakPolarHBondContact O-CB 3.38Å; L311-L315 VanDerWaalsContact O-CG 3.26Å; L311-L315 WeakPolarHBondContact O-CG 3.2Å; L311-L315 PolarHBondContact O-N 3.26Å
312	I	95.3	Very high	83.4	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-57.9	-44.1	176.5	-69.6	167.2	0	0	0	110.5	A277 C280 I281 I297 C308 S316 L331 V333 V359 V361	A277-I312 HydrophobicContact CB-CG1 3.76Å; C280-I312 HydrophobicContact CB-CD1 4.15Å; C280-I312 HydrophobicContact CB-CG1 4.29Å; I281-I312 HydrophobicContact CD1-CG2 4.1Å; I297-I312 HydrophobicContact CD1-CD1 3.82Å; C308-I312 WeakPolarHBondContact O-CB 3.47Å; C308-I312 VanDerWaalsContact O-CG1 3.25Å; C308-I312 WeakPolarHBondContact O-CG1 3.42Å; C308-I312 PolarHBondContact O-N 2.97Å; I312-S316 WeakPolarHBondContact O-CB 3.47Å; I312-S316 PolarHBondContact O-N 3.06Å; I312-L331 HydrophobicContact CG2-CD2 3.4Å; I312-V333 HydrophobicContact CB-CG2 4.48Å; I312-V333 HydrophobicContact CG2-CG2 3.63Å; I312-V359 HydrophobicContact CD1-CG1 4.23Å; I312-V361 HydrophobicContact CD1-CG2 4.03Å
313	K	92.1	Very high	81.5	Confident	111 Å²	111	75.2 Å²	75.2	48%	0.483	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-48.1	176.7	-72.4	171.5	-176.4	178.1	0	111.2	C309 S310 L311 S316 H317 V333	C309-K313 VanDerWaalsContact O-CG 3.3Å; C309-K313 WeakPolarHBondContact O-CG 3.41Å; C309-K313 PolarHBondContact O-N 3.48Å; S310-K313 PolarHBondContact O-N 3.35Å; L311-K313 VanDerWaalsContact C-N 3.29Å; L311-K313 PolarHBondContact O-N 2.94Å; K313-S316 PolarHBondContact O-N 3.04Å; K313-H317 PolarHBondContact O-N 2.72Å; K313-H317 VanDerWaalsContact O-N 3.17Å; K313-H317 PolarHBondContact O-ND1 3.32Å; K313-V333 HydrophobicContact CG-CG2 4.48Å
314	Q	90.4	Very high	79.4	Confident	118 Å²	118	77.1 Å²	77.1	55%	0.551	39%	0.392	S	S	*	.	H	α-helix	trans	-60.3	-47.6	179.7	-73.3	171.6	-33.9	0	0	112.6	S310 L311 S316 H317 S318	S310-Q314 WeakPolarHBondContact O-CG 3.25Å; S310-Q314 PolarHBondContact O-N 2.72Å; L311-Q314 PolarHBondContact O-N 2.84Å; Q314-S316 VanDerWaalsContact C-N 3.31Å; Q314-S316 PolarHBondContact O-N 3Å; Q314-H317 PolarHBondContact O-N 3.03Å; Q314-S318 PolarHBondContact O-N 3.39Å; Q314-S318 VanDerWaalsContact O-N 3.09Å; Q314-S318 PolarHBondContact O-OG 3.47Å
315	L	90.9	Very high	76.9	Confident	60 Å²	60	84.2 Å²	84.2	31%	0.314	43%	0.431	S	S	.	.	H	α-helix	trans	-63.9	-37.2	178.6	-68.9	172.6	0	0	0	111.8	A277 I281 L311 H317 S318 T319	A277-L315 HydrophobicContact CB-CD1 4.3Å; I281-L315 HydrophobicContact CD1-CB 4.26Å; I281-L315 HydrophobicContact CG1-CB 3.75Å; I281-L315 HydrophobicContact CG1-CD1 4.21Å; L311-L315 WeakPolarHBondContact O-CB 3.38Å; L311-L315 VanDerWaalsContact O-CG 3.26Å; L311-L315 WeakPolarHBondContact O-CG 3.2Å; L311-L315 PolarHBondContact O-N 3.26Å; L315-H317 VanDerWaalsContact C-N 3.31Å; L315-H317 PolarHBondContact O-N 2.83Å; L315-S318 PolarHBondContact O-N 3.27Å; L315-T319 PolarHBondContact O-N 3.02Å; L315-T319 PolarHBondContact O-OG1 2.88Å
316	S	86.2	Confident	74.3	Confident	19 Å²	19	88.3 Å²	88.3	13%	0.133	46%	0.459	C	S	.	.	H	α-helix	trans	-65.8	-29.9	175.5	177.4	0	0	0	0	113.3	I312 K313 Q314 T319 N320	I312-S316 WeakPolarHBondContact O-CB 3.47Å; I312-S316 PolarHBondContact O-N 3.06Å; K313-S316 PolarHBondContact O-N 3.04Å; Q314-S316 VanDerWaalsContact C-N 3.31Å; Q314-S316 PolarHBondContact O-N 3Å; S316-T319 PolarHBondContact O-OG1 3.49Å; S316-N320 PolarHBondContact O-ND2 3.1Å
317	H	80.8	Confident	72.1	Confident	134 Å²	134	91.2 Å²	91.2	62%	0.62	48%	0.475	S	S	*	.	H	α-helix	trans	-78.5	-34.9	174.7	-70.5	73	0	0	0	111.8	K313 Q314 L315 T319 N320	K313-H317 PolarHBondContact O-N 2.72Å; K313-H317 VanDerWaalsContact O-N 3.17Å; K313-H317 PolarHBondContact O-ND1 3.32Å; Q314-H317 PolarHBondContact O-N 3.03Å; L315-H317 VanDerWaalsContact C-N 3.31Å; L315-H317 PolarHBondContact O-N 2.83Å; H317-T319 VanDerWaalsContact C-N 3.33Å; H317-T319 PolarHBondContact O-N 3.14Å; H317-N320 PolarHBondContact O-N 2.88Å
318	S	73.2	Confident	70.1	Confident	77 Å²	77	95 Å²	95	54%	0.538	49%	0.494	S	S	.	.	H	α-helix	trans	-67.3	-33.6	-177.2	-55.2	0	0	0	0	112.5	Q314 L315 N320	Q314-S318 PolarHBondContact O-N 3.39Å; Q314-S318 VanDerWaalsContact O-N 3.09Å; Q314-S318 PolarHBondContact O-OG 3.47Å; L315-S318 PolarHBondContact O-N 3.27Å; S318-N320 PolarHBondContact O-N 3.38Å
319	T	61.2	Low	68.5	Low	58 Å²	58	99.7 Å²	99.7	36%	0.356	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-10.9	176.2	49	0	0	0	0	114.1	L315 S316 H317	L315-T319 PolarHBondContact O-N 3.02Å; L315-T319 PolarHBondContact O-OG1 2.88Å; S316-T319 PolarHBondContact O-OG1 3.49Å; H317-T319 VanDerWaalsContact C-N 3.33Å; H317-T319 PolarHBondContact O-N 3.14Å
320	N	55.6	Low	67.7	Low	104 Å²	104	100.2 Å²	100.2	56%	0.556	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-3.7	-174.3	-70.5	-20.4	0	0	0	114.1	S316 H317 S318 D322	S316-N320 PolarHBondContact O-ND2 3.1Å; H317-N320 PolarHBondContact O-N 2.88Å; S318-N320 PolarHBondContact O-N 3.38Å; N320-D322 VanDerWaalsContact C-N 3.25Å; N320-D322 PolarHBondContact O-N 3.2Å
321	I	53.6	Low	67.4	Low	138 Å²	138	99 Å²	99	71%	0.708	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-24.1	-177	-63.6	175.5	0	0	0	111.5
322	D	49	Very low	67.2	Low	147 Å²	147	97.6 Å²	97.6	79%	0.786	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-2.2	-173.9	-60.7	-30.9	0	0	0	115.2	N320	N320-D322 VanDerWaalsContact C-N 3.25Å; N320-D322 PolarHBondContact O-N 3.2Å
323	Q	47.4	Very low	67.2	Low	141 Å²	141	98.6 Å²	98.6	66%	0.659	51%	0.514	S	S	*	.			trans	-125.5	78.4	-175.9	-67.4	-170.6	14.5	0	0	112.3	N325	Q323-N325 VanDerWaalsContact C-N 3.25Å; Q323-N325 PolarHBondContact O-N 3.49Å
324	M	40.3	Very low	67.3	Low	184 Å²	184	95 Å²	95	91%	0.906	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	4.6	-173.4	-147.9	165.5	136.5	0	0	115.1
325	N	37.8	Very low	67.5	Low	168 Å²	168	90.9 Å²	90.9	90%	0.898	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.8	28.7	-170.2	-93.7	-25.6	0	0	0	117.9	Q323	Q323-N325 VanDerWaalsContact C-N 3.25Å; Q323-N325 PolarHBondContact O-N 3.49Å
326	S	40.2	Very low	67.6	Low	85 Å²	85	88.1 Å²	88.1	59%	0.594	47%	0.468	S	S	*	.	S	Bend	trans	-134.2	149.1	172.7	92.4	0	0	0	0	114.5	K328	S326-K328 PolarHBondContact O-N 3.32Å
327	I	46.9	Very low	67.7	Low	150 Å²	150	87.5 Å²	87.5	77%	0.769	46%	0.463	S	S	*	.			trans	-38.4	123.5	-171.9	-65.3	161	0	0	0	112.3	N329	I327-N329 PolarHBondContact O-N 3.18Å
328	K	51.7	Low	67.8	Low	199 Å²	199	85.9 Å²	85.9	87%	0.865	47%	0.467	S	S	*	.			trans	-53.5	94.7	177.8	-69.9	177.4	178.1	175.7	0	111.6	S326 G330	S326-K328 PolarHBondContact O-N 3.32Å; K328-G330 PolarHBondContact O-N 2.85Å; K328-G330 VanDerWaalsContact O-N 3.14Å
329	N	61.9	Low	67.9	Low	98 Å²	98	83.6 Å²	83.6	52%	0.524	45%	0.451	S	S	.	.			trans	-78.1	96.3	168.1	-71	-16.3	0	0	0	108.5	L291 I327	L291-N329 HydrophobicContact CD1-CB 3.84Å; L291-N329 VanDerWaalsContact CD1-CG 3.45Å; L291-N329 VanDerWaalsContact CD1-OD1 3.32Å; L291-N329 WeakPolarHBondContact CD1-OD1 2.98Å; L291-N329 HydrophobicContact CD2-CB 4.18Å; I327-N329 PolarHBondContact O-N 3.18Å
330	G	78.4	Confident	68.8	Low	16 Å²	16	81.6 Å²	81.6	17%	0.165	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	149.1	-173.1	0	0	0	0	0	113.3	K328 Q356 R357	K328-G330 PolarHBondContact O-N 2.85Å; K328-G330 VanDerWaalsContact O-N 3.14Å; G330-Q356 CarbonylContact O-C 3.51Å; G330-Q356 VanDerWaalsContact O-CA 3.23Å; G330-Q356 WeakPolarHBondContact O-CA 3.28Å; G330-R357 PolarHBondContact O-N 2.96Å
331	L	88.1	Confident	69.8	Low	33 Å²	33	77.9 Å²	77.9	17%	0.173	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	119.8	171.9	-169.8	70.5	0	0	0	109.7	I281 H284 I312 V333 R357 V359	I281-L331 HydrophobicContact CD1-CD2 4.1Å; H284-L331 HydrophobicContact CB-CD1 4.44Å; I312-L331 HydrophobicContact CG2-CD2 3.4Å; L331-V333 HydrophobicContact CD2-CG2 3.97Å; L331-V333 HydrophobicContact CG-CG2 3.96Å; L331-R357 HydrophobicContact CD1-CB 4.09Å; L331-R357 HydrophobicContact CD1-CG 4.44Å; L331-V359 HydrophobicContact CD1-CG2 3.41Å; L331-V359 VanDerWaalsContact CD1-CG2 3.41Å; L331-V359 HydrophobicContact CG-CG2 4.13Å
332	A	90.8	Very high	70.7	Confident	10 Å²	10	74.1 Å²	74.1	8%	0.083	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	103.4	179.2	0	0	0	0	0	110.3	F334 Q356 R357 V359	A332-F334 HydrophobicContact CB-CE2 3.6Å; A332-F334 HydrophobicContact CB-CZ 4.09Å; A332-F334 WeakPolarHBondContact O-CD2 3.5Å; A332-F334 WeakPolarHBondContact O-CE2 3.05Å; A332-Q356 HydrophobicContact CB-CB 4.24Å; A332-R357 PolarHBondContact N-O 2.92Å; A332-V359 PolarHBondContact O-N 3.34Å
333	V	94.2	Very high	72.1	Confident	20 Å²	20	73.9 Å²	73.9	12%	0.121	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.6	-175	-170.5	0	0	0	0	111.3	C309 I312 K313 L331 V359 V361	C309-V333 HydrophobicContact CB-CG1 4.02Å; I312-V333 HydrophobicContact CB-CG2 4.48Å; I312-V333 HydrophobicContact CG2-CG2 3.63Å; K313-V333 HydrophobicContact CG-CG2 4.48Å; L331-V333 HydrophobicContact CD2-CG2 3.97Å; L331-V333 HydrophobicContact CG-CG2 3.96Å; V333-V359 CarbonylContact C-O 3.45Å; V333-V359 WeakPolarHBondContact CA-O 3.43Å; V333-V359 HydrophobicContact CG2-CB 4.39Å; V333-V361 HydrophobicContact CG1-CG2 4.31Å
334	F	94.3	Very high	73.8	Confident	35 Å²	35	72 Å²	72	15%	0.154	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	124.1	-177.6	-60.4	-86.4	0	0	0	111.6	A332 K347 A348 K358 V359 I360 V361	A332-F334 HydrophobicContact CB-CE2 3.6Å; A332-F334 HydrophobicContact CB-CZ 4.09Å; A332-F334 WeakPolarHBondContact O-CD2 3.5Å; A332-F334 WeakPolarHBondContact O-CE2 3.05Å; F334-K347 HydrophobicContact CE1-CD 4.21Å; F334-K347 HydrophobicContact CE1-CG 4.19Å; F334-A348 HydrophobicContact CB-CB 3.83Å; F334-A348 HydrophobicContact CG-CB 4.38Å; F334-K358 HydrophobicContact CD2-CG 4.11Å; F334-K358 HydrophobicContact CE2-CG 4.06Å; F334-V359 PolarHBondContact N-O 3Å; F334-I360 HydrophobicContact CB-CG1 4.49Å; F334-I360 CarbonylContact O-C 3.56Å; F334-I360 VanDerWaalsContact O-CA 3.31Å; F334-I360 WeakPolarHBondContact O-CA 3.39Å; F334-V361 PolarHBondContact O-N 3Å
335	P	94.4	Very high	76.1	Confident	32 Å²	32	64 Å²	64	21%	0.208	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	149.1	167.3	31.3	-33.6	0	0	0	110.8	I305 M306 F337 L340 V361	I305-P335 HydrophobicContact CG2-CB 3.72Å; M306-P335 HydrophobicContact SD-CB 4.21Å; M306-P335 HydrophobicContact SD-CG 4.38Å; P335-F337 HydrophobicContact CB-CD1 4.21Å; P335-F337 HydrophobicContact CB-CE1 3.7Å; P335-L340 HydrophobicContact CG-CD1 4.36Å; P335-L340 WeakPolarHBondContact O-CD2 3.47Å; P335-V361 CarbonylContact C-O 3.55Å; P335-V361 WeakPolarHBondContact CA-O 3.48Å
336	L	92.9	Very high	78.2	Confident	2 Å²	2	58.2 Å²	58.2	1%	0.01	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	97.4	176.1	-179.2	62.6	0	0	0	112.2	Q345 A348 L349 I360 V361 S362 T363 L365 A366	L336-Q345 HydrophobicContact CD1-CB 3.86Å; L336-Q345 HydrophobicContact CD1-CG 4Å; L336-A348 HydrophobicContact CB-CB 4.49Å; L336-A348 HydrophobicContact CD1-CB 4.39Å; L336-L349 HydrophobicContact CD2-CD2 3.87Å; L336-L349 HydrophobicContact CD2-CG 4.48Å; L336-I360 HydrophobicContact CB-CG2 3.73Å; L336-I360 HydrophobicContact CD2-CG2 3.95Å; L336-V361 PolarHBondContact N-O 3.33Å; L336-S362 WeakPolarHBondContact CB-OG 3.32Å; L336-S362 WeakPolarHBondContact CD2-OG 3.38Å; L336-S362 WeakPolarHBondContact CG-OG 3.25Å; L336-S362 WeakPolarHBondContact O-CA 3.37Å; L336-S362 WeakPolarHBondContact O-CB 3.44Å; L336-S362 PolarHBondContact O-OG 3.48Å; L336-T363 PolarHBondContact O-N 2.87Å; L336-T363 VanDerWaalsContact O-N 3.16Å; L336-L365 HydrophobicContact CD1-CD2 3.85Å; L336-L365 HydrophobicContact CG-CD2 4.06Å; L336-A366 HydrophobicContact CD2-CB 4.22Å
337	F	89.2	Confident	80.5	Confident	7 Å²	7	60.7 Å²	60.7	3%	0.031	32%	0.317	C	S	.	.			trans	-143.6	165.6	178.2	49	-105.1	0	0	0	111.2	E302 I305 M306 P335 S339 L340 Q345 T363	E302-F337 HydrophobicContact CB-CD1 4.43Å; E302-F337 HydrophobicContact CB-CD2 4.3Å; E302-F337 HydrophobicContact CB-CE1 4.44Å; E302-F337 HydrophobicContact CB-CE2 4.33Å; E302-F337 HydrophobicContact CB-CG 4.36Å; E302-F337 HydrophobicContact CB-CZ 4.4Å; E302-F337 HydrophobicContact CG-CD1 4.45Å; E302-F337 HydrophobicContact CG-CD2 4.2Å; E302-F337 HydrophobicContact CG-CE1 3.98Å; E302-F337 HydrophobicContact CG-CE2 3.72Å; E302-F337 HydrophobicContact CG-CZ 3.6Å; I305-F337 HydrophobicContact CB-CD1 4.2Å; I305-F337 HydrophobicContact CD1-CB 4.02Å; I305-F337 HydrophobicContact CD1-CD1 3.85Å; I305-F337 HydrophobicContact CD1-CG 4.41Å; I305-F337 HydrophobicContact CG2-CD1 3.84Å; I305-F337 HydrophobicContact CG2-CE1 4.01Å; M306-F337 HydrophobicContact CG-CE1 4.35Å; M306-F337 HydrophobicContact SD-CE1 4.18Å; M306-F337 HydrophobicContact SD-CZ 4.43Å; P335-F337 HydrophobicContact CB-CD1 4.21Å; P335-F337 HydrophobicContact CB-CE1 3.7Å; F337-S339 WeakPolarHBondContact CD2-OG 3.41Å; F337-S339 WeakPolarHBondContact CE2-OG 3.42Å; F337-S339 PolarHBondContact O-N 3.01Å; F337-L340 HydrophobicContact CD2-CB 3.84Å; F337-L340 HydrophobicContact CE2-CB 3.79Å; F337-L340 HydrophobicContact CE2-CD1 4.02Å; F337-L340 HydrophobicContact CG-CB 4.49Å; F337-L340 HydrophobicContact CZ-CB 4.41Å; F337-L340 HydrophobicContact CZ-CD1 3.89Å; F337-L340 WeakPolarHBondContact O-CB 3.38Å; F337-L340 PolarHBondContact O-N 2.79Å; F337-L340 VanDerWaalsContact O-N 3.14Å; F337-Q345 PolarHBondContact O-NE2 2.82Å; F337-T363 HydrophobicContact CB-CG2 3.88Å
338	S	81.7	Confident	82.4	Confident	99 Å²	99	53.6 Å²	53.6	69%	0.692	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-36.9	-168.4	56	0	0	0	0	114.8	L340 Q345	S338-L340 VanDerWaalsContact C-N 3.25Å; S338-L340 PolarHBondContact O-N 3.39Å; S338-Q345 PolarHBondContact O-NE2 3.03Å
339	S	75.2	Confident	84	Confident	30 Å²	30	44.8 Å²	44.8	21%	0.21	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-11	179.2	61.9	0	0	0	0	113.7	E302 F337 R662	E302-S339 PolarHBondContact OE2-OG 2.76Å; F337-S339 WeakPolarHBondContact CD2-OG 3.41Å; F337-S339 WeakPolarHBondContact CE2-OG 3.42Å; F337-S339 PolarHBondContact O-N 3.01Å; S339-R662 VanDerWaalsContact CB-NH2 3.25Å; S339-R662 PolarHBondContact OG-NH2 3.12Å
340	L	81.5	Confident	85.1	Confident	15 Å²	15	44.9 Å²	44.9	8%	0.079	24%	0.243	C	C	.	.	S	Bend	trans	-66.5	140.4	177.8	-164.9	70.9	0	0	0	110.2	P335 F337 S338 Q342 Q344 Q345	P335-L340 HydrophobicContact CG-CD1 4.36Å; P335-L340 WeakPolarHBondContact O-CD2 3.47Å; F337-L340 HydrophobicContact CD2-CB 3.84Å; F337-L340 HydrophobicContact CE2-CB 3.79Å; F337-L340 HydrophobicContact CE2-CD1 4.02Å; F337-L340 HydrophobicContact CG-CB 4.49Å; F337-L340 HydrophobicContact CZ-CB 4.41Å; F337-L340 HydrophobicContact CZ-CD1 3.89Å; F337-L340 WeakPolarHBondContact O-CB 3.38Å; F337-L340 PolarHBondContact O-N 2.79Å; F337-L340 VanDerWaalsContact O-N 3.14Å; S338-L340 VanDerWaalsContact C-N 3.25Å; S338-L340 PolarHBondContact O-N 3.39Å; L340-Q342 PolarHBondContact O-N 3.06Å; L340-Q344 HydrophobicContact CD1-CB 4.38Å; L340-Q344 HydrophobicContact CD2-CB 3.94Å; L340-Q344 HydrophobicContact CG-CB 3.87Å; L340-Q345 HydrophobicContact CB-CG 3.91Å; L340-Q345 HydrophobicContact CD2-CG 4.04Å; L340-Q345 HydrophobicContact CG-CG 4.27Å; L340-Q345 PolarHBondContact O-NE2 3.4Å
341	P	75.7	Confident	85.2	Confident	27 Å²	27	51.9 Å²	51.9	18%	0.175	27%	0.269	C	S	.	.			trans	-57	140.2	177.4	-18.2	26	0	0	0	112.4	I343 Q344 Q345 S661	P341-I343 VanDerWaalsContact C-N 3.27Å; P341-I343 PolarHBondContact O-N 2.74Å; P341-I343 VanDerWaalsContact O-N 3.13Å; P341-Q344 HydrophobicContact CB-CG 4.32Å; P341-Q344 HydrophobicContact CG-CG 4.3Å; P341-Q344 WeakPolarHBondContact O-CA 3.29Å; P341-Q344 WeakPolarHBondContact O-CB 3.02Å; P341-Q344 PolarHBondContact O-N 2.86Å; P341-Q345 PolarHBondContact O-N 3.22Å; P341-S661 WeakPolarHBondContact CA-OG 3.42Å; P341-S661 WeakPolarHBondContact CB-OG 3.3Å
342	Q	73.8	Confident	84.6	Confident	58 Å²	58	51.8 Å²	51.8	27%	0.271	27%	0.271	S	S	.	.	H	α-helix	trans	-52.6	-40.4	-176.5	-175.4	-179.3	-0.1	0	0	113.6	L340 Q344 Q345 L346	L340-Q342 PolarHBondContact O-N 3.06Å; Q342-Q344 VanDerWaalsContact C-N 3.27Å; Q342-Q344 PolarHBondContact O-N 3.27Å; Q342-Q345 PolarHBondContact O-N 3.27Å; Q342-L346 HydrophobicContact CG-CD1 4.32Å; Q342-L346 WeakPolarHBondContact O-CG 3.16Å; Q342-L346 PolarHBondContact O-N 3.16Å
343	I	78	Confident	83.6	Confident	143 Å²	143	57.4 Å²	57.4	73%	0.733	30%	0.3	S	S	*	.	H	α-helix	trans	-61.8	-37.1	177.5	-64.2	170.3	0	0	0	111.3	P341 K347	P341-I343 VanDerWaalsContact C-N 3.27Å; P341-I343 PolarHBondContact O-N 2.74Å; P341-I343 VanDerWaalsContact O-N 3.13Å; I343-K347 WeakPolarHBondContact O-CB 3.3Å; I343-K347 PolarHBondContact O-N 3.11Å
344	Q	83.4	Confident	82.3	Confident	100 Å²	100	63.5 Å²	63.5	47%	0.467	33%	0.331	S	S	.	.	H	α-helix	trans	-75.5	-37.8	178.3	-65	-178.1	9.3	0	0	111.5	L340 P341 Q342 L346 K347 A348	L340-Q344 HydrophobicContact CD1-CB 4.38Å; L340-Q344 HydrophobicContact CD2-CB 3.94Å; L340-Q344 HydrophobicContact CG-CB 3.87Å; P341-Q344 HydrophobicContact CB-CG 4.32Å; P341-Q344 HydrophobicContact CG-CG 4.3Å; P341-Q344 WeakPolarHBondContact O-CA 3.29Å; P341-Q344 WeakPolarHBondContact O-CB 3.02Å; P341-Q344 PolarHBondContact O-N 2.86Å; Q342-Q344 VanDerWaalsContact C-N 3.27Å; Q342-Q344 PolarHBondContact O-N 3.27Å; Q344-L346 VanDerWaalsContact C-N 3.34Å; Q344-L346 PolarHBondContact O-N 3.43Å; Q344-K347 WeakPolarHBondContact O-CB 3.28Å; Q344-K347 PolarHBondContact O-N 3.39Å; Q344-A348 PolarHBondContact O-N 3.45Å
345	Q	87.1	Confident	81.5	Confident	16 Å²	16	68 Å²	68	8%	0.075	36%	0.357	C	S	.	.	H	α-helix	trans	-58.4	-47.7	171.4	-61.6	-176.1	17.7	0	0	110.6	L336 F337 S338 L340 P341 Q342 K347 A348 L349	L336-Q345 HydrophobicContact CD1-CB 3.86Å; L336-Q345 HydrophobicContact CD1-CG 4Å; F337-Q345 PolarHBondContact O-NE2 2.82Å; S338-Q345 PolarHBondContact O-NE2 3.03Å; L340-Q345 HydrophobicContact CB-CG 3.91Å; L340-Q345 HydrophobicContact CD2-CG 4.04Å; L340-Q345 HydrophobicContact CG-CG 4.27Å; L340-Q345 PolarHBondContact O-NE2 3.4Å; P341-Q345 PolarHBondContact O-N 3.22Å; Q342-Q345 PolarHBondContact O-N 3.27Å; Q345-K347 VanDerWaalsContact C-N 3.34Å; Q345-K347 PolarHBondContact O-N 3.49Å; Q345-A348 WeakPolarHBondContact O-CB 3.22Å; Q345-A348 PolarHBondContact O-N 3.24Å; Q345-L349 VanDerWaalsContact O-CG 3.31Å; Q345-L349 WeakPolarHBondContact O-CG 3.29Å; Q345-L349 PolarHBondContact O-N 3.18Å; Q345-L349 VanDerWaalsContact O-N 3.09Å
346	L	83.7	Confident	81	Confident	48 Å²	48	70.4 Å²	70.4	25%	0.251	37%	0.366	S	S	.	.	H	α-helix	trans	-62.2	-39	175.6	-69.7	172.5	0	0	0	112.2	Q342 Q344 A348 L349 N350	Q342-L346 HydrophobicContact CG-CD1 4.32Å; Q342-L346 WeakPolarHBondContact O-CG 3.16Å; Q342-L346 PolarHBondContact O-N 3.16Å; Q344-L346 VanDerWaalsContact C-N 3.34Å; Q344-L346 PolarHBondContact O-N 3.43Å; L346-A348 VanDerWaalsContact C-N 3.32Å; L346-A348 PolarHBondContact O-N 3.13Å; L346-L349 PolarHBondContact O-N 3.29Å; L346-L349 VanDerWaalsContact O-N 3.07Å; L346-N350 PolarHBondContact O-N 3.35Å; L346-N350 PolarHBondContact O-ND2 3.11Å
347	K	86.6	Confident	80.9	Confident	137 Å²	137	70.3 Å²	70.3	60%	0.596	37%	0.365	S	S	*	.	H	α-helix	trans	-59.7	-42.1	173.9	-170	-177.6	-177.4	-173.4	0	111.8	F334 I343 Q344 Q345 L349	F334-K347 HydrophobicContact CE1-CD 4.21Å; F334-K347 HydrophobicContact CE1-CG 4.19Å; I343-K347 WeakPolarHBondContact O-CB 3.3Å; I343-K347 PolarHBondContact O-N 3.11Å; Q344-K347 WeakPolarHBondContact O-CB 3.28Å; Q344-K347 PolarHBondContact O-N 3.39Å; Q345-K347 VanDerWaalsContact C-N 3.34Å; Q345-K347 PolarHBondContact O-N 3.49Å; K347-L349 VanDerWaalsContact C-N 3.25Å; K347-L349 PolarHBondContact O-N 3.39Å
348	A	87.7	Confident	81.1	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-65.7	-28.7	175.3	0	0	0	0	0	112.2	F334 L336 Q344 Q345 L346 K358 I360	F334-A348 HydrophobicContact CB-CB 3.83Å; F334-A348 HydrophobicContact CG-CB 4.38Å; L336-A348 HydrophobicContact CB-CB 4.49Å; L336-A348 HydrophobicContact CD1-CB 4.39Å; Q344-A348 PolarHBondContact O-N 3.45Å; Q345-A348 WeakPolarHBondContact O-CB 3.22Å; Q345-A348 PolarHBondContact O-N 3.24Å; L346-A348 VanDerWaalsContact C-N 3.32Å; L346-A348 PolarHBondContact O-N 3.13Å; A348-K358 WeakPolarHBondContact O-CE 3.22Å; A348-K358 PolarHBondContact O-NZ 3.01Å; A348-I360 WeakPolarHBondContact O-CD1 3.32Å
349	L	86.2	Confident	81.7	Confident	15 Å²	15	65.8 Å²	65.8	8%	0.079	33%	0.333	C	S	.	.	H	α-helix	trans	-87.9	-23.2	-178.6	-64.7	171.8	0	0	0	114	V99 L336 Q345 L346 K347 I370 I372 P373	V99-L349 HydrophobicContact CG1-CD1 3.47Å; V99-L349 VanDerWaalsContact CG1-CD1 3.47Å; L336-L349 HydrophobicContact CD2-CD2 3.87Å; L336-L349 HydrophobicContact CD2-CG 4.48Å; Q345-L349 VanDerWaalsContact O-CG 3.31Å; Q345-L349 WeakPolarHBondContact O-CG 3.29Å; Q345-L349 PolarHBondContact O-N 3.18Å; Q345-L349 VanDerWaalsContact O-N 3.09Å; L346-L349 PolarHBondContact O-N 3.29Å; L346-L349 VanDerWaalsContact O-N 3.07Å; K347-L349 VanDerWaalsContact C-N 3.25Å; K347-L349 PolarHBondContact O-N 3.39Å; L349-I370 HydrophobicContact CD1-CD1 4.29Å; L349-I370 HydrophobicContact CD1-CG2 4.43Å; L349-I370 HydrophobicContact CD2-CG2 4.31Å; L349-I372 HydrophobicContact CD2-CD1 3.7Å; L349-I372 HydrophobicContact CD2-CG1 3.67Å; L349-P373 WeakPolarHBondContact O-CD 3.29Å
350	N	84.5	Confident	82.8	Confident	99 Å²	99	64.3 Å²	64.3	53%	0.529	32%	0.323	S	S	.	.	S	Bend	trans	-78.8	166.8	179.4	-71.2	-16.8	0	0	0	113.5	L346 K358	L346-N350 PolarHBondContact O-N 3.35Å; L346-N350 PolarHBondContact O-ND2 3.11Å; N350-K358 WeakPolarHBondContact O-CE 3.47Å; N350-K358 PolarHBondContact O-NZ 3.4Å
351	F	80.7	Confident	83.5	Confident	164 Å²	164	63.6 Å²	63.6	72%	0.719	32%	0.319	S	S	*	.			trans	-55.3	149.4	174.8	-72.7	-87.9	0	0	0	112.6	P373	F351-P373 HydrophobicContact CD1-CB 3.59Å; F351-P373 HydrophobicContact CD1-CG 4.34Å; F351-P373 HydrophobicContact CD2-CB 4.13Å; F351-P373 HydrophobicContact CD2-CG 3.98Å; F351-P373 HydrophobicContact CE1-CB 3.2Å; F351-P373 HydrophobicContact CE1-CG 4.04Å; F351-P373 HydrophobicContact CE2-CB 3.78Å; F351-P373 HydrophobicContact CE2-CG 3.64Å; F351-P373 HydrophobicContact CG-CB 4.04Å; F351-P373 HydrophobicContact CG-CG 4.32Å; F351-P373 HydrophobicContact CZ-CB 3.31Å; F351-P373 HydrophobicContact CZ-CG 3.68Å
352	C	75.8	Confident	84.5	Confident	31 Å²	31	62.3 Å²	62.3	21%	0.209	31%	0.311	C	S	.	.			trans	-110	156.8	171.3	-162.8	0	0	0	0	108.6	K358	C352-K358 HydrophobicContact CB-CB 4.03Å; C352-K358 HydrophobicContact CB-CD 4.03Å; C352-K358 HydrophobicContact CB-CG 4.13Å
353	D	69	Low	85.5	Confident	128 Å²	128	60.2 Å²	60.2	68%	0.684	30%	0.302	S	S	*	.			trans	-61	143.9	-178.9	-57.2	-41.3	0	0	0	111.5	N355 Q356	D353-N355 PolarHBondContact O-N 2.84Å; D353-Q356 PolarHBondContact O-N 3.03Å; D353-Q356 VanDerWaalsContact O-N 3.17Å
354	N	67.8	Low	86.1	Confident	147 Å²	147	56.4 Å²	56.4	79%	0.786	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.6	-169	-68.5	-7.9	0	0	0	115.4
355	N	75.8	Confident	86.3	Confident	129 Å²	129	52.7 Å²	52.7	69%	0.69	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.7	6.3	-176.6	-69.9	6.7	0	0	0	113.9	D353	D353-N355 PolarHBondContact O-N 2.84Å
356	Q	84.6	Confident	86.4	Confident	83 Å²	83	52.2 Å²	52.2	39%	0.388	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.2	-179.5	-57	-168.9	-24.6	0	0	112	G330 A332 D353 K358	G330-Q356 CarbonylContact O-C 3.51Å; G330-Q356 VanDerWaalsContact O-CA 3.23Å; G330-Q356 WeakPolarHBondContact O-CA 3.28Å; A332-Q356 HydrophobicContact CB-CB 4.24Å; D353-Q356 PolarHBondContact O-N 3.03Å; D353-Q356 VanDerWaalsContact O-N 3.17Å; Q356-K358 PolarHBondContact O-N 3.01Å
357	R	90.6	Very high	86.5	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	121.4	169.4	-173	-176.2	-59	-84.7	4	109.3	H284 S289 P290 L291 R293 G330 L331 A332	H284-R357 PolarHBondContact ND1-NE 3.45Å; S289-R357 PolarHBondContact O-NH2 3.12Å; S289-R357 PolarHBondContact OG-NH1 2.87Å; S289-R357 PolarHBondContact OG-NH2 2.92Å; P290-R357 VanDerWaalsContact O-CZ 3.3Å; P290-R357 PolarHBondContact O-NH1 3.15Å; P290-R357 PolarHBondContact O-NH2 2.77Å; L291-R357 HydrophobicContact CD2-CB 4.23Å; L291-R357 WeakPolarHBondContact O-CA 3.36Å; R293-R357 PolarHBondContact O-NH1 3.16Å; G330-R357 PolarHBondContact O-N 2.96Å; L331-R357 HydrophobicContact CD1-CB 4.09Å; L331-R357 HydrophobicContact CD1-CG 4.44Å; A332-R357 PolarHBondContact N-O 2.92Å
358	K	93	Very high	86.1	Confident	11 Å²	11	43.6 Å²	43.6	5%	0.048	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	126.6	174.5	-170	-177.1	-176	-169.1	0	110.9	G294 I295 F334 A348 N350 C352 Q356 I360	G294-K358 CarbonylContact C-O 3.56Å; G294-K358 WeakPolarHBondContact CA-O 3.33Å; I295-K358 PolarHBondContact N-O 3.43Å; F334-K358 HydrophobicContact CD2-CG 4.11Å; F334-K358 HydrophobicContact CE2-CG 4.06Å; A348-K358 WeakPolarHBondContact O-CE 3.22Å; A348-K358 PolarHBondContact O-NZ 3.01Å; N350-K358 WeakPolarHBondContact O-CE 3.47Å; N350-K358 PolarHBondContact O-NZ 3.4Å; C352-K358 HydrophobicContact CB-CB 4.03Å; C352-K358 HydrophobicContact CB-CD 4.03Å; C352-K358 HydrophobicContact CB-CG 4.13Å; Q356-K358 PolarHBondContact O-N 3.01Å; K358-I360 HydrophobicContact CD-CD1 4.48Å; K358-I360 HydrophobicContact CG-CG1 4.38Å
359	V	96	Very high	85.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	126	171.7	-178.5	0	0	0	0	108.9	I295 I297 I312 L331 A332 V333 F334 V361	I295-V359 HydrophobicContact CB-CG1 4.43Å; I295-V359 HydrophobicContact CB-CG2 4.21Å; I295-V359 HydrophobicContact CD1-CG2 4.21Å; I295-V359 HydrophobicContact CG1-CG2 4.49Å; I295-V359 CarbonylContact O-C 3.54Å; I295-V359 WeakPolarHBondContact O-CA 3.46Å; I297-V359 HydrophobicContact CD1-CG1 4.14Å; I297-V359 HydrophobicContact CG1-CG1 4.44Å; I312-V359 HydrophobicContact CD1-CG1 4.23Å; L331-V359 HydrophobicContact CD1-CG2 3.41Å; L331-V359 VanDerWaalsContact CD1-CG2 3.41Å; L331-V359 HydrophobicContact CG-CG2 4.13Å; A332-V359 PolarHBondContact O-N 3.34Å; V333-V359 CarbonylContact C-O 3.45Å; V333-V359 WeakPolarHBondContact CA-O 3.43Å; V333-V359 HydrophobicContact CG2-CB 4.39Å; F334-V359 PolarHBondContact N-O 3Å; V359-V361 HydrophobicContact CG1-CG2 4.28Å
360	I	96.7	Very high	84.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	127.2	174.1	-55.8	171.7	0	0	0	108.2	I295 L296 I297 F334 L336 A348 K358 I372 I375	I295-I360 PolarHBondContact O-N 2.84Å; L296-I360 CarbonylContact C-O 3.59Å; L296-I360 WeakPolarHBondContact CA-O 3.31Å; L296-I360 HydrophobicContact CD1-CB 3.83Å; L296-I360 HydrophobicContact CD1-CG2 3.83Å; I297-I360 PolarHBondContact N-O 3.45Å; F334-I360 HydrophobicContact CB-CG1 4.49Å; F334-I360 CarbonylContact O-C 3.56Å; F334-I360 VanDerWaalsContact O-CA 3.31Å; F334-I360 WeakPolarHBondContact O-CA 3.39Å; L336-I360 HydrophobicContact CB-CG2 3.73Å; L336-I360 HydrophobicContact CD2-CG2 3.95Å; A348-I360 WeakPolarHBondContact O-CD1 3.32Å; K358-I360 HydrophobicContact CD-CD1 4.48Å; K358-I360 HydrophobicContact CG-CG1 4.38Å; I360-I372 HydrophobicContact CD1-CD1 4.02Å; I360-I372 HydrophobicContact CD1-CG2 3.46Å; I360-I372 VanDerWaalsContact CD1-CG2 3.46Å; I360-I375 HydrophobicContact CD1-CD1 4.24Å
361	V	97.8	Very high	84.6	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	113.2	173.8	-167.5	0	0	0	0	107.8	I297 L299 I305 C308 I312 V333 F334 P335 L336 V359	I297-V361 HydrophobicContact CB-CB 4.49Å; I297-V361 HydrophobicContact CB-CG1 4.19Å; I297-V361 HydrophobicContact CB-CG2 4.4Å; I297-V361 HydrophobicContact CD1-CG2 4.14Å; I297-V361 HydrophobicContact CG1-CG2 4.47Å; I297-V361 HydrophobicContact CG2-CG1 4.34Å; L299-V361 HydrophobicContact CD1-CG1 3.63Å; L299-V361 HydrophobicContact CG-CG1 4.2Å; I305-V361 HydrophobicContact CB-CG1 4.26Å; I305-V361 HydrophobicContact CG1-CG1 4.07Å; I305-V361 HydrophobicContact CG2-CB 4.04Å; I305-V361 HydrophobicContact CG2-CG1 4Å; I305-V361 WeakPolarHBondContact CG2-O 3.45Å; C308-V361 HydrophobicContact CB-CG1 4.07Å; I312-V361 HydrophobicContact CD1-CG2 4.03Å; V333-V361 HydrophobicContact CG1-CG2 4.31Å; F334-V361 PolarHBondContact O-N 3Å; P335-V361 CarbonylContact C-O 3.55Å; P335-V361 WeakPolarHBondContact CA-O 3.48Å; L336-V361 PolarHBondContact N-O 3.33Å; V359-V361 HydrophobicContact CG1-CG2 4.28Å
362	S	96.3	Very high	84.9	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	156.2	-165.7	-162.2	0	0	0	0	113.8	I297 F298 L299 L336	I297-S362 PolarHBondContact O-N 2.86Å; F298-S362 CarbonylContact C-O 3.49Å; F298-S362 WeakPolarHBondContact CA-O 3.39Å; L299-S362 PolarHBondContact N-O 3.05Å; L336-S362 WeakPolarHBondContact CB-OG 3.32Å; L336-S362 WeakPolarHBondContact CD2-OG 3.38Å; L336-S362 WeakPolarHBondContact CG-OG 3.25Å; L336-S362 WeakPolarHBondContact O-CA 3.37Å; L336-S362 WeakPolarHBondContact O-CB 3.44Å; L336-S362 PolarHBondContact O-OG 3.48Å
363	T	94.1	Very high	85.3	Confident	13 Å²	13	35.2 Å²	35.2	8%	0.08	19%	0.19	C	C	.	.	S	Bend	trans	-76.3	-167.5	160.8	65.8	0	0	0	0	110.2	F298 L299 I305 L336 F337 L365 A366	F298-T363 WeakPolarHBondContact CD1-O 3.5Å; L299-T363 WeakPolarHBondContact O-CA 3.39Å; I305-T363 HydrophobicContact CD1-CG2 3.51Å; L336-T363 PolarHBondContact O-N 2.87Å; L336-T363 VanDerWaalsContact O-N 3.16Å; F337-T363 HydrophobicContact CB-CG2 3.88Å; T363-L365 PolarHBondContact O-N 3.08Å; T363-L365 WeakPolarHBondContact OG1-CB 3.43Å; T363-L365 PolarHBondContact OG1-N 3.26Å; T363-A366 PolarHBondContact O-N 2.69Å
364	N	90.4	Very high	86.2	Confident	63 Å²	63	29.9 Å²	29.9	34%	0.337	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-52.8	-12.6	165.9	65	-20.6	0	0	0	114.1	R97 A366 E367	R97-N364 PolarHBondContact NH1-O 3Å; R97-N364 PolarHBondContact NH2-O 3.38Å; N364-A366 PolarHBondContact O-N 3.12Å; N364-E367 VanDerWaalsContact CB-CD 3.47Å; N364-E367 HydrophobicContact CB-CG 4.2Å; N364-E367 WeakPolarHBondContact CB-OE1 3.42Å; N364-E367 WeakPolarHBondContact O-CB 3.23Å; N364-E367 WeakPolarHBondContact O-CG 3.34Å; N364-E367 PolarHBondContact O-N 2.69Å
365	L	88.2	Confident	87.3	Confident	23 Å²	23	23 Å²	23	12%	0.12	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-51.6	-27.4	177.3	-172.1	60.1	0	0	0	114.3	R97 L336 T363 T368	R97-L365 VanDerWaalsContact NH1-CA 3.32Å; R97-L365 PolarHBondContact NH1-O 3.08Å; L336-L365 HydrophobicContact CD1-CD2 3.85Å; L336-L365 HydrophobicContact CG-CD2 4.06Å; T363-L365 PolarHBondContact O-N 3.08Å; T363-L365 WeakPolarHBondContact OG1-CB 3.43Å; T363-L365 PolarHBondContact OG1-N 3.26Å; L365-T368 PolarHBondContact O-OG1 3.39Å
366	A	89.5	Confident	88.2	Confident	5 Å²	5	18.9 Å²	18.9	4%	0.041	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-87.3	-3.4	175.1	0	0	0	0	0	114.8	L296 F298 L336 T363 N364 T368 I372 R414	L296-A366 HydrophobicContact CD1-CB 3.95Å; L296-A366 HydrophobicContact CD2-CB 4.03Å; F298-A366 HydrophobicContact CE1-CB 3.72Å; F298-A366 HydrophobicContact CZ-CB 3.94Å; L336-A366 HydrophobicContact CD2-CB 4.22Å; T363-A366 PolarHBondContact O-N 2.69Å; N364-A366 PolarHBondContact O-N 3.12Å; A366-T368 VanDerWaalsContact C-N 3.34Å; A366-T368 PolarHBondContact O-N 3.49Å; A366-I372 HydrophobicContact CB-CD1 4.26Å; A366-R414 VanDerWaalsContact O-CD 3.27Å; A366-R414 WeakPolarHBondContact O-CD 3.45Å; A366-R414 PolarHBondContact O-NE 3.17Å
367	E	86.3	Confident	88.7	Confident	3 Å²	3	16.1 Å²	16.1	1%	0.014	9%	0.09	C	C	.	.	G	3₁₀ helix	trans	-71.1	-17.5	178.4	-67.5	173.3	-168.8	0	0	114.8	F298 N364 R411 R414	F298-E367 HydrophobicContact CD1-CG 4.37Å; F298-E367 HydrophobicContact CE1-CG 3.73Å; F298-E367 HydrophobicContact CZ-CG 4.23Å; N364-E367 VanDerWaalsContact CB-CD 3.47Å; N364-E367 HydrophobicContact CB-CG 4.2Å; N364-E367 WeakPolarHBondContact CB-OE1 3.42Å; N364-E367 WeakPolarHBondContact O-CB 3.23Å; N364-E367 WeakPolarHBondContact O-CG 3.34Å; N364-E367 PolarHBondContact O-N 2.69Å; E367-R411 HydrophobicContact CG-CG 3.85Å; E367-R411 IonicContact OE1-CZ 2.74Å; E367-R411 IonicContact OE1-NE 3.14Å; E367-R411 PolarHBondContact OE1-NE 2.92Å; E367-R411 IonicContact OE1-NH2 3.79Å; E367-R411 PolarHBondContact OE1-NH2 2.78Å; E367-R414 VanDerWaalsContact C-NH2 3.33Å; E367-R414 VanDerWaalsContact O-CZ 3.28Å; E367-R414 PolarHBondContact O-NH2 3.48Å
368	T	78.1	Confident	89	Confident	2 Å²	2	16.1 Å²	16.1	1%	0.012	9%	0.09	C	C	.	.	S	Bend	trans	-78.7	161.5	-175.4	35	0	0	0	0	113.8	P96 R97 E170 L365 A366 I370 R414	P96-T368 HydrophobicContact CG-CG2 4.34Å; R97-T368 HydrophobicContact CB-CG2 4.37Å; R97-T368 VanDerWaalsContact CD-CG2 3.43Å; R97-T368 HydrophobicContact CG-CG2 3.82Å; R97-T368 VanDerWaalsContact NE-CG2 3.31Å; R97-T368 VanDerWaalsContact NH1-CG2 3.34Å; R97-T368 PolarHBondContact NH1-OG1 2.84Å; E170-T368 WeakPolarHBondContact OE1-CG2 3.38Å; L365-T368 PolarHBondContact O-OG1 3.39Å; A366-T368 VanDerWaalsContact C-N 3.34Å; A366-T368 PolarHBondContact O-N 3.49Å; T368-I370 PolarHBondContact O-N 2.81Å; T368-R414 PolarHBondContact O-NH1 2.56Å; T368-R414 PolarHBondContact O-NH2 2.95Å
369	S	72.2	Confident	89.3	Confident	15 Å²	15	15.6 Å²	15.6	11%	0.105	9%	0.088	C	C	.	.	S	Bend	trans	-35.4	-4.8	172.7	57	0	0	0	0	120.4	Q95 E167 R417	Q95-S369 PolarHBondContact OE1-OG 3.21Å; E167-S369 WeakPolarHBondContact OE1-CB 3.21Å; E167-S369 PolarHBondContact OE2-N 2.71Å; S369-R417 PolarHBondContact O-NH1 3.09Å; S369-R417 PolarHBondContact O-NH2 2.74Å
370	I	76.1	Confident	89.4	Confident	19 Å²	19	15.6 Å²	15.6	10%	0.097	9%	0.088	C	C	.	.			trans	-69.1	128.2	175.4	-51.9	176.2	0	0	0	111.7	V99 A100 L349 T368 R414 R417	V99-I370 HydrophobicContact CB-CD1 4.07Å; V99-I370 HydrophobicContact CG1-CD1 3.82Å; A100-I370 HydrophobicContact CB-CD1 4.15Å; A100-I370 HydrophobicContact CB-CG1 4.04Å; L349-I370 HydrophobicContact CD1-CD1 4.29Å; L349-I370 HydrophobicContact CD1-CG2 4.43Å; L349-I370 HydrophobicContact CD2-CG2 4.31Å; T368-I370 PolarHBondContact O-N 2.81Å; I370-R414 PolarHBondContact O-NH1 3.23Å; I370-R417 PolarHBondContact O-NH1 3.18Å
371	T	78.7	Confident	89.4	Confident	66 Å²	66	15.7 Å²	15.7	41%	0.405	9%	0.088	S	C	.	.			trans	-85.3	124.9	170.3	-59.9	0	0	0	0	109.2	R417 E418	T371-R417 HydrophobicContact CG2-CB 4.3Å; T371-R417 VanDerWaalsContact N-NH1 3.2Å; T371-R417 PolarHBondContact OG1-NH1 2.85Å; T371-E418 HydrophobicContact CG2-CG 4.21Å
372	I	85.6	Confident	89.3	Confident	12 Å²	12	15.7 Å²	15.7	6%	0.062	9%	0.088	C	C	.	.			trans	-100.6	113.3	174.2	-53.7	-178.9	0	0	0	107.3	L296 L349 I360 A366 I375	L296-I372 HydrophobicContact CD1-CD1 4.37Å; L296-I372 HydrophobicContact CD2-CD1 4.27Å; L349-I372 HydrophobicContact CD2-CD1 3.7Å; L349-I372 HydrophobicContact CD2-CG1 3.67Å; I360-I372 HydrophobicContact CD1-CD1 4.02Å; I360-I372 HydrophobicContact CD1-CG2 3.46Å; I360-I372 VanDerWaalsContact CD1-CG2 3.46Å; A366-I372 HydrophobicContact CB-CD1 4.26Å; I372-I375 HydrophobicContact CB-CG1 3.76Å; I372-I375 HydrophobicContact CG2-CD1 4.16Å; I372-I375 HydrophobicContact CG2-CG1 3.51Å
373	P	83.7	Confident	89.3	Confident	20 Å²	20	18.5 Å²	18.5	13%	0.13	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	140.5	-174.4	-21.4	32.6	0	0	0	112.9	L349 F351 I375 E418	L349-P373 WeakPolarHBondContact O-CD 3.29Å; F351-P373 HydrophobicContact CD1-CB 3.59Å; F351-P373 HydrophobicContact CD1-CG 4.34Å; F351-P373 HydrophobicContact CD2-CB 4.13Å; F351-P373 HydrophobicContact CD2-CG 3.98Å; F351-P373 HydrophobicContact CE1-CB 3.2Å; F351-P373 HydrophobicContact CE1-CG 4.04Å; F351-P373 HydrophobicContact CE2-CB 3.78Å; F351-P373 HydrophobicContact CE2-CG 3.64Å; F351-P373 HydrophobicContact CG-CB 4.04Å; F351-P373 HydrophobicContact CG-CG 4.32Å; F351-P373 HydrophobicContact CZ-CB 3.31Å; F351-P373 HydrophobicContact CZ-CG 3.68Å; P373-I375 VanDerWaalsContact C-N 3.28Å; P373-I375 PolarHBondContact O-N 3.36Å; P373-E418 WeakPolarHBondContact CA-OE1 3.44Å
374	G	88.1	Confident	89.2	Confident	16 Å²	16	18.1 Å²	18.1	17%	0.165	10%	0.097	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	-8.7	174.8	0	0	0	0	0	115.7	R293 G294 R376 E418	R293-G374 CarbonylContact C-O 3.58Å; G294-G374 PolarHBondContact N-O 3.45Å; G374-R376 PolarHBondContact O-N 3.48Å; G374-E418 PolarHBondContact N-OE2 3.29Å
375	I	92.2	Very high	89	Confident	3 Å²	3	18.4 Å²	18.4	2%	0.015	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	124.4	177.6	-61	-59.6	0	0	0	110.1	L296 I360 I372 P373	L296-I375 HydrophobicContact CB-CD1 4.21Å; L296-I375 HydrophobicContact CB-CG1 4.45Å; L296-I375 HydrophobicContact CB-CG2 3.79Å; I360-I375 HydrophobicContact CD1-CD1 4.24Å; I372-I375 HydrophobicContact CB-CG1 3.76Å; I372-I375 HydrophobicContact CG2-CD1 4.16Å; I372-I375 HydrophobicContact CG2-CG1 3.51Å; P373-I375 VanDerWaalsContact C-N 3.28Å; P373-I375 PolarHBondContact O-N 3.36Å
376	R	93.3	Very high	88.8	Confident	42 Å²	42	19.4 Å²	19.4	16%	0.158	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	-16.4	173.9	-55.2	-64.2	176.3	-98.7	2.6	113.1	R293 G294 G374 A415 E418 G421 V422	R293-R376 HydrophobicContact CB-CB 3.94Å; R293-R376 HydrophobicContact CB-CG 3.82Å; R293-R376 HydrophobicContact CG-CB 4.25Å; R293-R376 HydrophobicContact CG-CG 3.77Å; G294-R376 PolarHBondContact O-N 3.34Å; G374-R376 PolarHBondContact O-N 3.48Å; R376-A415 WeakPolarHBondContact O-CB 3.48Å; R376-E418 IonicContact CZ-OE2 3.9Å; R376-E418 IonicContact NH1-OE2 2.85Å; R376-E418 PolarHBondContact NH1-OE2 3.32Å; R376-E418 IonicContact NH2-OE2 2.77Å; R376-E418 PolarHBondContact NH2-OE2 2.82Å; R376-G421 CarbonylContact O-C 3.59Å; R376-G421 WeakPolarHBondContact O-CA 3.15Å; R376-V422 PolarHBondContact O-N 2.79Å
377	Y	96.6	Very high	88.3	Confident	26 Å²	26	23.8 Å²	23.8	10%	0.102	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.5	175.6	-61.3	-85.8	0	0	0	110	I283 S289 R293 G294 I295 L296 V422	I283-Y377 HydrophobicContact CD1-CD1 4.32Å; I283-Y377 HydrophobicContact CD1-CG 4.42Å; I283-Y377 HydrophobicContact CG2-CD1 4Å; I283-Y377 HydrophobicContact CG2-CD2 3.93Å; I283-Y377 HydrophobicContact CG2-CE1 4.14Å; I283-Y377 HydrophobicContact CG2-CE2 4.07Å; I283-Y377 HydrophobicContact CG2-CG 3.9Å; S289-Y377 WeakPolarHBondContact CB-OH 3.44Å; S289-Y377 WeakPolarHBondContact OG-CE2 3.14Å; S289-Y377 VanDerWaalsContact OG-CZ 3.24Å; S289-Y377 PolarHBondContact OG-OH 3.14Å; R293-Y377 HydrophobicContact CB-CD2 4.25Å; R293-Y377 HydrophobicContact CB-CE2 3.81Å; G294-Y377 PolarHBondContact O-N 3.44Å; G294-Y377 VanDerWaalsContact O-N 3.12Å; I295-Y377 CarbonylContact C-O 3.54Å; I295-Y377 WeakPolarHBondContact CA-O 3.47Å; I295-Y377 HydrophobicContact CG1-CD2 4.41Å; L296-Y377 PolarHBondContact N-O 2.98Å; Y377-V422 CarbonylContact C-O 3.53Å; Y377-V422 VanDerWaalsContact CA-O 3.32Å; Y377-V422 WeakPolarHBondContact CA-O 3.17Å; Y377-V422 HydrophobicContact CD1-CB 3.86Å; Y377-V422 HydrophobicContact CD1-CG2 4.34Å; Y377-V422 HydrophobicContact CE1-CB 4.07Å; Y377-V422 HydrophobicContact CE1-CG2 4.04Å
378	V	97.1	Very high	87.9	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	133.1	169.6	170.8	0	0	0	0	108.4	L296 F298 D380 R414 A415 V422 C423 L424	L296-V378 HydrophobicContact CB-CG2 4.41Å; L296-V378 CarbonylContact O-C 3.37Å; L296-V378 VanDerWaalsContact O-CA 3.24Å; L296-V378 WeakPolarHBondContact O-CA 3.49Å; F298-V378 HydrophobicContact CD2-CG1 3.94Å; F298-V378 HydrophobicContact CE2-CG1 3.95Å; V378-D380 HydrophobicContact CG1-CB 4.46Å; V378-R414 HydrophobicContact CG2-CB 3.79Å; V378-A415 HydrophobicContact CB-CB 4.48Å; V378-A415 HydrophobicContact CG2-CB 3.82Å; V378-V422 PolarHBondContact N-O 2.88Å; V378-C423 HydrophobicContact CB-CB 4.35Å; V378-C423 CarbonylContact O-C 3.46Å; V378-C423 WeakPolarHBondContact O-CA 3.5Å; V378-L424 PolarHBondContact O-N 3.03Å
379	I	98.3	Very high	87.9	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	118.6	168.5	-58.7	174.7	0	0	0	106.7	A276 V279 C280 I283 I295 L296 I297 F298 L424 L426	A276-I379 HydrophobicContact CB-CG2 4.16Å; V279-I379 HydrophobicContact CB-CD1 4.09Å; V279-I379 HydrophobicContact CG1-CD1 3.63Å; V279-I379 HydrophobicContact CG1-CG1 4.03Å; C280-I379 HydrophobicContact CB-CD1 3.98Å; I283-I379 HydrophobicContact CD1-CD1 3.93Å; I283-I379 HydrophobicContact CD1-CG1 4.15Å; I295-I379 HydrophobicContact CG2-CD1 3.88Å; I295-I379 HydrophobicContact CG2-CG1 4.15Å; L296-I379 PolarHBondContact O-N 3.35Å; I297-I379 CarbonylContact C-O 3.59Å; I297-I379 WeakPolarHBondContact CA-O 3.32Å; I297-I379 HydrophobicContact CB-CB 4.4Å; I297-I379 HydrophobicContact CD1-CD1 4.04Å; I297-I379 HydrophobicContact CG1-CB 4.16Å; I297-I379 HydrophobicContact CG1-CD1 4.06Å; I297-I379 HydrophobicContact CG1-CG1 4.46Å; I297-I379 HydrophobicContact CG2-CB 4.15Å; I297-I379 HydrophobicContact CG2-CG2 4.21Å; F298-I379 PolarHBondContact N-O 2.95Å; I379-L424 CarbonylContact C-O 3.55Å; I379-L424 WeakPolarHBondContact CA-O 3.35Å; I379-L424 HydrophobicContact CG1-CD1 4.46Å; I379-L426 HydrophobicContact CG2-CD1 3.66Å; I379-L426 HydrophobicContact CG2-CD2 4.11Å; I379-L426 HydrophobicContact CG2-CG 3.86Å
380	D	98	Very high	87.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	114.5	-174.2	-179.6	16.2	0	0	0	111	V378 G382 R411 L424 L426 Y427	V378-D380 HydrophobicContact CG1-CB 4.46Å; D380-G382 PolarHBondContact O-N 3.28Å; D380-G382 PolarHBondContact OD1-N 3.23Å; D380-R411 VanDerWaalsContact CG-CD 3.45Å; D380-R411 WeakPolarHBondContact OD1-CD 3.49Å; D380-R411 IonicContact OD1-CZ 3.79Å; D380-R411 IonicContact OD1-NE 3.91Å; D380-R411 IonicContact OD1-NH1 2.69Å; D380-R411 PolarHBondContact OD1-NH1 2.82Å; D380-L424 PolarHBondContact N-O 3.02Å; D380-L426 PolarHBondContact O-N 2.94Å; D380-Y427 HydrophobicContact CB-CE1 4.25Å; D380-Y427 WeakPolarHBondContact O-CE1 3.45Å; D380-Y427 WeakPolarHBondContact OD2-CE1 3.22Å; D380-Y427 PolarHBondContact OD2-OH 2.7Å
381	C	96.9	Very high	87.5	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.014	15%	0.153	C	C	.	.			trans	-72.4	-12.3	175.4	76.4	0	0	0	0	114.2	Y272 F298 L299 R383	Y272-C381 HydrophobicContact CD2-CB 3.76Å; Y272-C381 HydrophobicContact CE2-CB 4.38Å; Y272-C381 HydrophobicContact CG-CB 4.2Å; F298-C381 WeakPolarHBondContact O-CB 3.34Å; F298-C381 PolarHBondContact O-N 3.23Å; F298-C381 PolarHBondContact O-SG 2.87Å; L299-C381 HydrophobicContact CD2-CB 4.13Å; C381-R383 PolarHBondContact O-N 3.42Å; C381-R383 PolarHBondContact SG-N 2.91Å; C381-R383 VanDerWaalsContact SG-N 3.39Å
382	G	96.4	Very high	86.8	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	75.1	4.4	-179.2	0	0	0	0	0	114.7	D380 W402 I403 Y427	D380-G382 PolarHBondContact O-N 3.28Å; D380-G382 PolarHBondContact OD1-N 3.23Å; G382-W402 VanDerWaalsContact O-CE3 3.25Å; G382-I403 WeakPolarHBondContact O-CG1 3.29Å; G382-I403 PolarHBondContact O-N 2.59Å; G382-Y427 VanDerWaalsContact CA-CD1 3.44Å; G382-Y427 VanDerWaalsContact N-CE1 3.35Å
383	R	94.7	Very high	85.8	Confident	58 Å²	58	37.9 Å²	37.9	22%	0.219	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	157.9	-176.7	-61.4	-179.2	-176.9	171.6	5.5	112.6	Y272 T300 C381 V400 Q401 W402 R411	Y272-R383 VanDerWaalsContact CE1-NH1 3.31Å; T300-R383 HydrophobicContact CG2-CB 3.78Å; C381-R383 PolarHBondContact O-N 3.42Å; C381-R383 PolarHBondContact SG-N 2.91Å; C381-R383 VanDerWaalsContact SG-N 3.39Å; R383-V400 HydrophobicContact CB-CG1 3.9Å; R383-V400 HydrophobicContact CG-CG1 4.37Å; R383-Q401 VanDerWaalsContact CA-O 3.28Å; R383-Q401 WeakPolarHBondContact CA-O 3.44Å; R383-W402 HydrophobicContact CG-CE3 4.22Å; R383-W402 HydrophobicContact CG-CZ3 4.45Å; R383-R411 PolarHBondContact O-NH1 2.89Å; R383-R411 VanDerWaalsContact O-NH1 3.13Å; R383-R411 PolarHBondContact O-NH2 2.81Å; R383-R411 VanDerWaalsContact O-NH2 3.08Å
384	A	92	Very high	84.9	Confident	5 Å²	5	38.4 Å²	38.4	4%	0.041	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	150.9	171.4	0	0	0	0	0	110.5	V400 Q401 I403	A384-V400 WeakPolarHBondContact O-CA 3.28Å; A384-Q401 PolarHBondContact N-O 3.42Å; A384-Q401 PolarHBondContact O-N 3.35Å; A384-I403 HydrophobicContact CB-CG2 3.83Å
385	K	87	Confident	83.9	Confident	70 Å²	70	38.6 Å²	38.6	30%	0.304	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	120.9	167.6	-73.6	-175.3	-177.7	-165.5	0	109.2	T300 R399 V400	T300-K385 WeakPolarHBondContact OG1-CE 3.09Å; K385-R399 WeakPolarHBondContact CA-O 3.23Å; K385-V400 HydrophobicContact CG-CG2 3.76Å
386	I	83.5	Confident	82.9	Confident	44 Å²	44	41.7 Å²	41.7	23%	0.226	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	134	-179.9	-57.1	-176.3	0	0	0	108.4	R399 Q401 Q445	I386-R399 PolarHBondContact N-O 3.36Å; I386-R399 PolarHBondContact O-N 2.89Å; I386-Q401 HydrophobicContact CD1-CB 3.98Å; I386-Q401 HydrophobicContact CG1-CB 4.44Å; I386-Q445 VanDerWaalsContact CG2-NE2 3.27Å
387	K	79.1	Confident	81.7	Confident	96 Å²	96	40.2 Å²	40.2	42%	0.417	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	125.4	172.9	-76.2	-173.8	159.8	-135.3	0	110.1	E396 C397 L398 Q445	K387-E396 IonicContact NZ-OE2 3.84Å; K387-E396 PolarHBondContact NZ-OE2 3.41Å; K387-C397 CarbonylContact C-O 3.59Å; K387-C397 WeakPolarHBondContact CA-O 3.32Å; K387-L398 HydrophobicContact CB-CD2 4.28Å; K387-L398 HydrophobicContact CG-CD2 3.4Å; K387-L398 VanDerWaalsContact CG-CD2 3.4Å; K387-L398 HydrophobicContact CG-CG 4.34Å; K387-Q445 PolarHBondContact O-NE2 2.96Å
388	D	77.6	Confident	80.6	Confident	46 Å²	46	42.1 Å²	42.1	25%	0.246	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.8	176.3	-172	29.8	0	0	0	108.8	E396 C397 R399	D388-E396 CarbonylContact O-C 3.57Å; D388-E396 WeakPolarHBondContact O-CA 3.38Å; D388-C397 PolarHBondContact N-O 3.02Å; D388-C397 PolarHBondContact O-N 3.41Å; D388-C397 PolarHBondContact O-SG 3.45Å; D388-R399 IonicContact OD2-NE 3.85Å
389	W	79.4	Confident	79.7	Confident	27 Å²	27	45.8 Å²	45.8	10%	0.102	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.4	-177.9	179.8	73	0	0	0	110.1	P391 G394 F395 E396 Q445 P447 A479	W389-P391 HydrophobicContact CE3-CB 4.24Å; W389-P391 VanDerWaalsContact CH2-CA 3.45Å; W389-P391 HydrophobicContact CH2-CB 3.62Å; W389-P391 HydrophobicContact CZ2-CB 4.43Å; W389-P391 HydrophobicContact CZ3-CB 3.5Å; W389-P391 VanDerWaalsContact CZ3-CB 3.5Å; W389-P391 HydrophobicContact CZ3-CG 4.34Å; W389-G394 PolarHBondContact NE1-O 2.99Å; W389-G394 VanDerWaalsContact NE1-O 3.08Å; W389-F395 WeakPolarHBondContact CA-O 3.07Å; W389-E396 HydrophobicContact CB-CG 4.36Å; W389-E396 HydrophobicContact CG-CG 4.35Å; W389-Q445 WeakPolarHBondContact CB-O 2.99Å; W389-Q445 PolarHBondContact N-O 2.82Å; W389-P447 HydrophobicContact CD2-CB 4.24Å; W389-P447 HydrophobicContact CZ2-CB 4.2Å; W389-A479 HydrophobicContact CH2-CB 4.1Å
390	D	72	Confident	79	Confident	62 Å²	62	48 Å²	48	33%	0.332	24%	0.238	S	C	.	.			trans	-96.7	115	176.2	177.3	6.4	0	0	0	110.2	K392 T393 G394 F395	D390-K392 PolarHBondContact O-N 3.3Å; D390-K392 WeakPolarHBondContact OD1-CB 3.49Å; D390-K392 PolarHBondContact OD1-N 3.19Å; D390-T393 VanDerWaalsContact CB-OG1 3.29Å; D390-T393 WeakPolarHBondContact CB-OG1 3.39Å; D390-T393 VanDerWaalsContact CG-OG1 3.23Å; D390-T393 WeakPolarHBondContact OD2-CG2 3.45Å; D390-T393 PolarHBondContact OD2-OG1 2.75Å; D390-G394 WeakPolarHBondContact O-CA 3.2Å; D390-G394 PolarHBondContact O-N 2.95Å; D390-F395 PolarHBondContact N-O 2.7Å
391	P	67.1	Low	78.6	Confident	43 Å²	43	51.4 Å²	51.4	28%	0.279	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-25.4	179.2	25.1	-33.5	0	0	0	114.1	W389	W389-P391 HydrophobicContact CE3-CB 4.24Å; W389-P391 VanDerWaalsContact CH2-CA 3.45Å; W389-P391 HydrophobicContact CH2-CB 3.62Å; W389-P391 HydrophobicContact CZ2-CB 4.43Å; W389-P391 HydrophobicContact CZ3-CB 3.5Å; W389-P391 VanDerWaalsContact CZ3-CB 3.5Å; W389-P391 HydrophobicContact CZ3-CG 4.34Å
392	K	63.6	Low	78.5	Confident	196 Å²	196	55.5 Å²	55.5	85%	0.852	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-46.9	-177.2	-66.6	-175.4	176.9	-175.2	0	111	D390	D390-K392 PolarHBondContact O-N 3.3Å; D390-K392 WeakPolarHBondContact OD1-CB 3.49Å; D390-K392 PolarHBondContact OD1-N 3.19Å
393	T	64.5	Low	78.4	Confident	39 Å²	39	55.5 Å²	55.5	24%	0.239	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-20.4	-179.2	61.4	0	0	0	0	112	D390 F395	D390-T393 VanDerWaalsContact CB-OG1 3.29Å; D390-T393 WeakPolarHBondContact CB-OG1 3.39Å; D390-T393 VanDerWaalsContact CG-OG1 3.23Å; D390-T393 WeakPolarHBondContact OD2-CG2 3.45Å; D390-T393 PolarHBondContact OD2-OG1 2.75Å; T393-F395 HydrophobicContact CG2-CD2 4.29Å; T393-F395 HydrophobicContact CG2-CE2 4.41Å; T393-F395 PolarHBondContact O-N 3.18Å; T393-F395 WeakPolarHBondContact OG1-CD2 3.27Å
394	G	66.2	Low	78.3	Confident	32 Å²	32	52.8 Å²	52.8	33%	0.33	26%	0.259	S	S	.	.			trans	76.6	3.9	-175.6	0	0	0	0	0	113.8	W389 D390	W389-G394 PolarHBondContact NE1-O 2.99Å; W389-G394 VanDerWaalsContact NE1-O 3.08Å; D390-G394 WeakPolarHBondContact O-CA 3.2Å; D390-G394 PolarHBondContact O-N 2.95Å
395	F	67	Low	78.3	Confident	19 Å²	19	55.3 Å²	55.3	8%	0.083	27%	0.269	C	S	.	.			trans	-85.5	135.9	-173	-57.5	-35.2	0	0	0	113.1	W389 D390 T393 H738 Q750 L752 F774 A777 V797	W389-F395 WeakPolarHBondContact CA-O 3.07Å; D390-F395 PolarHBondContact N-O 2.7Å; T393-F395 HydrophobicContact CG2-CD2 4.29Å; T393-F395 HydrophobicContact CG2-CE2 4.41Å; T393-F395 PolarHBondContact O-N 3.18Å; T393-F395 WeakPolarHBondContact OG1-CD2 3.27Å; F395-H738 AromaticContact CZ-NE2 3.58Å; F395-Q750 VanDerWaalsContact CE2-OE1 3.31Å; F395-L752 HydrophobicContact CE2-CD2 4.21Å; F395-L752 HydrophobicContact CZ-CD2 4.1Å; F395-F774 HydrophobicContact CD1-CE2 4.38Å; F395-F774 AromaticContact CE1-CE2 3.66Å; F395-F774 HydrophobicContact CE1-CE2 3.66Å; F395-F774 AromaticContact CE1-CZ 3.58Å; F395-F774 HydrophobicContact CE1-CZ 3.58Å; F395-F774 HydrophobicContact CZ-CE2 4.42Å; F395-F774 HydrophobicContact CZ-CZ 4.01Å; F395-A777 HydrophobicContact CD1-CB 3.72Å; F395-A777 HydrophobicContact CD2-CB 4.43Å; F395-A777 HydrophobicContact CE1-CB 3.88Å; F395-A777 HydrophobicContact CG-CB 4.04Å; F395-A777 HydrophobicContact CZ-CB 4.28Å; F395-V797 HydrophobicContact CD2-CG1 4.36Å; F395-V797 HydrophobicContact CE2-CG1 4.28Å
396	E	71	Confident	78.4	Confident	69 Å²	69	52.6 Å²	52.6	32%	0.322	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	128.4	162.4	-70.8	-167.1	-178.6	0	0	109.1	K387 D388 W389 P447	K387-E396 IonicContact NZ-OE2 3.84Å; K387-E396 PolarHBondContact NZ-OE2 3.41Å; D388-E396 CarbonylContact O-C 3.57Å; D388-E396 WeakPolarHBondContact O-CA 3.38Å; W389-E396 HydrophobicContact CB-CG 4.36Å; W389-E396 HydrophobicContact CG-CG 4.35Å; E396-P447 VanDerWaalsContact OE1-CD 3.25Å; E396-P447 WeakPolarHBondContact OE1-CD 3.39Å; E396-P447 WeakPolarHBondContact OE1-CG 3.35Å
397	C	68.6	Low	78.8	Confident	11 Å²	11	51.6 Å²	51.6	7%	0.074	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.1	174.1	64	0	0	0	0	110.9	K387 D388 R399 T779	K387-C397 CarbonylContact C-O 3.59Å; K387-C397 WeakPolarHBondContact CA-O 3.32Å; D388-C397 PolarHBondContact N-O 3.02Å; D388-C397 PolarHBondContact O-N 3.41Å; D388-C397 PolarHBondContact O-SG 3.45Å; C397-R399 PolarHBondContact SG-NE 2.86Å; C397-R399 VanDerWaalsContact SG-NE 3.35Å; C397-T779 HydrophobicContact CB-CG2 4.33Å
398	L	73.2	Confident	79.5	Confident	65 Å²	65	47 Å²	47	34%	0.34	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	110.9	171.2	-75.7	168.7	0	0	0	109.1	K387	K387-L398 HydrophobicContact CB-CD2 4.28Å; K387-L398 HydrophobicContact CG-CD2 3.4Å; K387-L398 VanDerWaalsContact CG-CD2 3.4Å; K387-L398 HydrophobicContact CG-CG 4.34Å
399	R	77	Confident	80	Confident	77 Å²	77	50 Å²	50	29%	0.291	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	135.2	177.1	-63.3	-173.6	-173.7	-89.1	-2.6	110.5	K385 I386 D388 C397 Q401 D795	K385-R399 WeakPolarHBondContact CA-O 3.23Å; I386-R399 PolarHBondContact N-O 3.36Å; I386-R399 PolarHBondContact O-N 2.89Å; D388-R399 IonicContact OD2-NE 3.85Å; C397-R399 PolarHBondContact SG-NE 2.86Å; C397-R399 VanDerWaalsContact SG-NE 3.35Å; R399-Q401 HydrophobicContact CB-CG 4.23Å; R399-Q401 PolarHBondContact O-N 3.47Å; R399-D795 IonicContact CZ-OD2 2.84Å; R399-D795 IonicContact NH1-OD2 2.75Å; R399-D795 PolarHBondContact NH1-OD2 3.05Å
400	V	85.4	Confident	80.4	Confident	47 Å²	47	49.1 Å²	49.1	29%	0.285	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	121.2	167.5	177.8	0	0	0	0	107.9	T300 R383 A384 K385 F785	T300-V400 HydrophobicContact CG2-CG1 3.93Å; T300-V400 HydrophobicContact CG2-CG2 4.48Å; R383-V400 HydrophobicContact CB-CG1 3.9Å; R383-V400 HydrophobicContact CG-CG1 4.37Å; A384-V400 WeakPolarHBondContact O-CA 3.28Å; K385-V400 HydrophobicContact CG-CG2 3.76Å; V400-F785 HydrophobicContact CG2-CE2 4.24Å; V400-F785 HydrophobicContact CG2-CZ 4.29Å
401	Q	89.1	Confident	81.4	Confident	71 Å²	71	46.1 Å²	46.1	33%	0.332	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	160.5	-179.6	-61.1	-177.3	23.7	0	0	110.4	R383 A384 I386 R399	R383-Q401 VanDerWaalsContact CA-O 3.28Å; R383-Q401 WeakPolarHBondContact CA-O 3.44Å; A384-Q401 PolarHBondContact N-O 3.42Å; A384-Q401 PolarHBondContact O-N 3.35Å; I386-Q401 HydrophobicContact CD1-CB 3.98Å; I386-Q401 HydrophobicContact CG1-CB 4.44Å; R399-Q401 HydrophobicContact CB-CG 4.23Å; R399-Q401 PolarHBondContact O-N 3.47Å
402	W	94.6	Very high	82.6	Confident	88 Å²	88	44.1 Å²	44.1	33%	0.333	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	138.6	167.7	-71.8	108	0	0	0	110.4	G382 R383 Y427 E431 M435	G382-W402 VanDerWaalsContact O-CE3 3.25Å; R383-W402 HydrophobicContact CG-CE3 4.22Å; R383-W402 HydrophobicContact CG-CZ3 4.45Å; W402-Y427 HydrophobicContact CZ3-CD1 4.29Å; W402-Y427 HydrophobicContact CZ3-CG 4.05Å; W402-E431 HydrophobicContact CH2-CB 4Å; W402-E431 HydrophobicContact CH2-CG 4.08Å; W402-E431 HydrophobicContact CZ2-CB 4.26Å; W402-E431 HydrophobicContact CZ2-CG 4.06Å; W402-M435 HydrophobicContact CB-CG 4.47Å; W402-M435 HydrophobicContact CD2-CE 4.32Å; W402-M435 HydrophobicContact CE3-CE 3.36Å; W402-M435 HydrophobicContact CZ3-CE 3.56Å
403	I	94.6	Very high	83.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-73.3	165.4	171.4	69.2	-176.5	0	0	0	110.7	G382 A384 Q407 A408 M435	G382-I403 WeakPolarHBondContact O-CG1 3.29Å; G382-I403 PolarHBondContact O-N 2.59Å; A384-I403 HydrophobicContact CB-CG2 3.83Å; I403-Q407 HydrophobicContact CB-CB 3.93Å; I403-Q407 HydrophobicContact CD1-CB 4.25Å; I403-Q407 HydrophobicContact CG1-CB 4.32Å; I403-A408 HydrophobicContact CD1-CB 3.89Å; I403-A408 HydrophobicContact CG1-CB 4.37Å; I403-M435 HydrophobicContact CG1-SD 4.24Å; I403-M435 WeakPolarHBondContact O-CB 3.4Å; I403-M435 WeakPolarHBondContact O-CG 3.21Å
404	S	92.7	Very high	84.9	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.007	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-77.2	160.4	170.3	63.4	0	0	0	0	113.2	G406 Q407 A408 P436 P439	S404-G406 PolarHBondContact O-N 2.91Å; S404-Q407 WeakPolarHBondContact O-CB 3.31Å; S404-Q407 PolarHBondContact O-N 3Å; S404-Q407 VanDerWaalsContact O-N 3.08Å; S404-Q407 WeakPolarHBondContact OG-CG 3.36Å; S404-Q407 PolarHBondContact OG-N 3.38Å; S404-Q407 VanDerWaalsContact OG-N 3.14Å; S404-Q407 PolarHBondContact OG-OE1 3.16Å; S404-A408 PolarHBondContact O-N 2.89Å; S404-P436 CarbonylContact C-O 3.56Å; S404-P436 WeakPolarHBondContact CA-O 3.47Å; S404-P436 VanDerWaalsContact CB-O 3.29Å; S404-P436 WeakPolarHBondContact CB-O 3.14Å; S404-P439 VanDerWaalsContact OG-CD 3.25Å; S404-P439 WeakPolarHBondContact OG-CD 3.15Å; S404-P439 WeakPolarHBondContact OG-CG 3.08Å
405	K	92.3	Very high	86	Confident	59 Å²	59	31.8 Å²	31.8	26%	0.257	15%	0.145	S	C	.	.	H	α-helix	trans	-56.3	-38.4	170.8	-66.6	177.7	177.9	162.9	0	111.5	A408 W409 Y432 K433 M435 P436 L437	K405-A408 PolarHBondContact O-N 3.43Å; K405-W409 WeakPolarHBondContact O-CB 3.48Å; K405-W409 PolarHBondContact O-N 2.72Å; K405-Y432 HydrophobicContact CB-CE2 4.17Å; K405-Y432 WeakPolarHBondContact CE-O 3.31Å; K405-Y432 HydrophobicContact CG-CD2 4.45Å; K405-Y432 HydrophobicContact CG-CE2 3.86Å; K405-K433 WeakPolarHBondContact CE-O 3.32Å; K405-K433 PolarHBondContact NZ-O 3.14Å; K405-M435 VanDerWaalsContact CE-O 3.26Å; K405-M435 WeakPolarHBondContact CE-O 3.46Å; K405-M435 HydrophobicContact CG-CB 4.02Å; K405-P436 PolarHBondContact N-O 3.3Å; K405-L437 HydrophobicContact CD-CD1 4.42Å
406	G	88.5	Confident	86.8	Confident	13 Å²	13	31.1 Å²	31.1	13%	0.134	14%	0.143	C	C	.	.	H	α-helix	trans	-60	-44.8	173.1	0	0	0	0	0	113.2	S404 W409 Q410 L437	S404-G406 PolarHBondContact O-N 2.91Å; G406-W409 WeakPolarHBondContact O-CB 3.48Å; G406-W409 PolarHBondContact O-N 2.78Å; G406-Q410 WeakPolarHBondContact O-CG 3.3Å; G406-Q410 PolarHBondContact O-N 2.79Å; G406-L437 PolarHBondContact N-O 3.43Å
407	Q	91.3	Very high	87.2	Confident	22 Å²	22	28.7 Å²	28.7	10%	0.103	13%	0.131	C	C	.	.	H	α-helix	trans	-66.4	-44.6	175.3	-76.8	168.7	-67.5	0	0	112.3	I403 S404 W409 Q410 R411 P439	I403-Q407 HydrophobicContact CB-CB 3.93Å; I403-Q407 HydrophobicContact CD1-CB 4.25Å; I403-Q407 HydrophobicContact CG1-CB 4.32Å; S404-Q407 WeakPolarHBondContact O-CB 3.31Å; S404-Q407 PolarHBondContact O-N 3Å; S404-Q407 VanDerWaalsContact O-N 3.08Å; S404-Q407 WeakPolarHBondContact OG-CG 3.36Å; S404-Q407 PolarHBondContact OG-N 3.38Å; S404-Q407 VanDerWaalsContact OG-N 3.14Å; S404-Q407 PolarHBondContact OG-OE1 3.16Å; Q407-W409 PolarHBondContact O-N 2.73Å; Q407-Q410 WeakPolarHBondContact O-CB 3.35Å; Q407-Q410 PolarHBondContact O-N 3.5Å; Q407-R411 WeakPolarHBondContact O-CG 3.38Å; Q407-R411 PolarHBondContact O-N 3.17Å; Q407-P439 HydrophobicContact CG-CG 3.85Å
408	A	93.1	Very high	87.7	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-56.9	-38.3	174.7	0	0	0	0	0	111.5	I403 S404 K405 S412 Y427 Y432	I403-A408 HydrophobicContact CD1-CB 3.89Å; I403-A408 HydrophobicContact CG1-CB 4.37Å; S404-A408 PolarHBondContact O-N 2.89Å; K405-A408 PolarHBondContact O-N 3.43Å; A408-S412 WeakPolarHBondContact O-CB 3.49Å; A408-S412 PolarHBondContact O-N 2.94Å; A408-S412 PolarHBondContact O-OG 3.25Å; A408-Y427 WeakPolarHBondContact CB-OH 3.28Å; A408-Y432 HydrophobicContact CB-CE2 3.96Å
409	W	88.9	Confident	88.2	Confident	108 Å²	108	29.9 Å²	29.9	41%	0.409	14%	0.14	S	C	.	.	H	α-helix	trans	-65.1	-41.6	174.4	-170.1	-109.6	0	0	0	112.2	R256 I262 K405 G406 Q407 S412 G413	R256-W409 VanDerWaalsContact CZ-CZ2 3.43Å; R256-W409 VanDerWaalsContact NH2-CZ2 3.26Å; R256-W409 VanDerWaalsContact NH2-NE1 3.12Å; R256-W409 PolarHBondContact NH2-O 2.79Å; I262-W409 HydrophobicContact CD1-CE3 4.47Å; I262-W409 HydrophobicContact CD1-CZ3 4.08Å; K405-W409 WeakPolarHBondContact O-CB 3.48Å; K405-W409 PolarHBondContact O-N 2.72Å; G406-W409 WeakPolarHBondContact O-CB 3.48Å; G406-W409 PolarHBondContact O-N 2.78Å; Q407-W409 PolarHBondContact O-N 2.73Å; W409-S412 PolarHBondContact O-N 2.88Å; W409-S412 PolarHBondContact O-OG 3.37Å; W409-G413 PolarHBondContact O-N 2.77Å
410	Q	88.4	Confident	88.9	Confident	9 Å²	9	29.1 Å²	29.1	4%	0.042	15%	0.149	C	C	.	.	H	α-helix	trans	-67.2	-39.8	176.3	-70.7	166.8	15.1	0	0	113.3	H169 G406 Q407 G413 R414	H169-Q410 PolarHBondContact CD2-NE2 3.46Å; H169-Q410 PolarHBondContact NE2-NE2 3.09Å; G406-Q410 WeakPolarHBondContact O-CG 3.3Å; G406-Q410 PolarHBondContact O-N 2.79Å; Q407-Q410 WeakPolarHBondContact O-CB 3.35Å; Q407-Q410 PolarHBondContact O-N 3.5Å; Q410-G413 PolarHBondContact O-N 2.82Å; Q410-R414 PolarHBondContact O-NE 2.7Å
411	R	92.6	Very high	89.2	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.7	-49.9	172.5	-71	-175.8	-179.9	-168.2	-2.5	110.3	F298 E367 D380 R383 Q407 G413 R414	F298-R411 HydrophobicContact CD1-CG 4.15Å; F298-R411 HydrophobicContact CD2-CB 3.86Å; F298-R411 HydrophobicContact CD2-CG 3.73Å; F298-R411 HydrophobicContact CE1-CG 4.11Å; F298-R411 HydrophobicContact CE2-CB 3.66Å; F298-R411 HydrophobicContact CE2-CG 3.68Å; F298-R411 HydrophobicContact CG-CG 3.96Å; F298-R411 HydrophobicContact CZ-CB 4.23Å; F298-R411 HydrophobicContact CZ-CG 3.88Å; E367-R411 HydrophobicContact CG-CG 3.85Å; E367-R411 IonicContact OE1-CZ 2.74Å; E367-R411 IonicContact OE1-NE 3.14Å; E367-R411 PolarHBondContact OE1-NE 2.92Å; E367-R411 IonicContact OE1-NH2 3.79Å; E367-R411 PolarHBondContact OE1-NH2 2.78Å; D380-R411 VanDerWaalsContact CG-CD 3.45Å; D380-R411 WeakPolarHBondContact OD1-CD 3.49Å; D380-R411 IonicContact OD1-CZ 3.79Å; D380-R411 IonicContact OD1-NE 3.91Å; D380-R411 IonicContact OD1-NH1 2.69Å; D380-R411 PolarHBondContact OD1-NH1 2.82Å; R383-R411 PolarHBondContact O-NH1 2.89Å; R383-R411 VanDerWaalsContact O-NH1 3.13Å; R383-R411 PolarHBondContact O-NH2 2.81Å; R383-R411 VanDerWaalsContact O-NH2 3.08Å; Q407-R411 WeakPolarHBondContact O-CG 3.38Å; Q407-R411 PolarHBondContact O-N 3.17Å; R411-G413 VanDerWaalsContact C-N 3.27Å; R411-G413 PolarHBondContact O-N 2.66Å; R411-R414 WeakPolarHBondContact O-CB 3.35Å; R411-R414 WeakPolarHBondContact O-CG 3.48Å; R411-R414 PolarHBondContact O-N 3.39Å
412	S	91.5	Very high	89.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.2	-40	176.4	75.7	0	0	0	0	112.1	I260 A408 W409 R414 A415 C423	I260-S412 WeakPolarHBondContact CD1-O 3.39Å; A408-S412 WeakPolarHBondContact O-CB 3.49Å; A408-S412 PolarHBondContact O-N 2.94Å; A408-S412 PolarHBondContact O-OG 3.25Å; W409-S412 PolarHBondContact O-N 2.88Å; W409-S412 PolarHBondContact O-OG 3.37Å; S412-R414 PolarHBondContact O-N 2.7Å; S412-A415 PolarHBondContact O-N 3.19Å; S412-A415 VanDerWaalsContact O-N 3.09Å; S412-C423 VanDerWaalsContact CB-SG 3.6Å
413	G	87.1	Confident	89.6	Confident	1 Å²	1	21.2 Å²	21.2	1%	0.01	12%	0.117	C	C	.	.	H	α-helix	trans	-55.8	-20.2	179.6	0	0	0	0	0	114.9	I260 W409 Q410 R411 A415 G416 R417	I260-G413 VanDerWaalsContact CD1-CA 3.5Å; W409-G413 PolarHBondContact O-N 2.77Å; Q410-G413 PolarHBondContact O-N 2.82Å; R411-G413 VanDerWaalsContact C-N 3.27Å; R411-G413 PolarHBondContact O-N 2.66Å; G413-A415 VanDerWaalsContact C-N 3.32Å; G413-A415 PolarHBondContact O-N 2.9Å; G413-G416 PolarHBondContact O-N 3.15Å; G413-R417 WeakPolarHBondContact O-CG 3.3Å
414	R	89.6	Confident	89.8	Confident	8 Å²	8	23 Å²	23	3%	0.03	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-32.4	177.7	-54.6	-66.3	134.6	-175.6	3.3	113	L296 F298 A366 E367 T368 I370 V378 Q410 R411 S412 G416 R417	L296-R414 HydrophobicContact CD2-CB 3.78Å; L296-R414 HydrophobicContact CD2-CG 3.82Å; F298-R414 HydrophobicContact CE2-CG 4.25Å; F298-R414 HydrophobicContact CZ-CG 4.07Å; A366-R414 VanDerWaalsContact O-CD 3.27Å; A366-R414 WeakPolarHBondContact O-CD 3.45Å; A366-R414 PolarHBondContact O-NE 3.17Å; E367-R414 VanDerWaalsContact C-NH2 3.33Å; E367-R414 VanDerWaalsContact O-CZ 3.28Å; E367-R414 PolarHBondContact O-NH2 3.48Å; T368-R414 PolarHBondContact O-NH1 2.56Å; T368-R414 PolarHBondContact O-NH2 2.95Å; I370-R414 PolarHBondContact O-NH1 3.23Å; V378-R414 HydrophobicContact CG2-CB 3.79Å; Q410-R414 PolarHBondContact O-NE 2.7Å; R411-R414 WeakPolarHBondContact O-CB 3.35Å; R411-R414 WeakPolarHBondContact O-CG 3.48Å; R411-R414 PolarHBondContact O-N 3.39Å; S412-R414 PolarHBondContact O-N 2.7Å; R414-G416 VanDerWaalsContact C-N 3.33Å; R414-R417 VanDerWaalsContact CZ-NH2 3.25Å
415	A	89.7	Confident	90	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-27.4	179.7	0	0	0	0	0	113	I260 R376 V378 S412 G413	I260-A415 HydrophobicContact CG2-CB 4.26Å; R376-A415 WeakPolarHBondContact O-CB 3.48Å; V378-A415 HydrophobicContact CB-CB 4.48Å; V378-A415 HydrophobicContact CG2-CB 3.82Å; S412-A415 PolarHBondContact O-N 3.19Å; S412-A415 VanDerWaalsContact O-N 3.09Å; G413-A415 VanDerWaalsContact C-N 3.32Å; G413-A415 PolarHBondContact O-N 2.9Å
416	G	82.8	Confident	90.3	Very high	4 Å²	4	21.1 Å²	21.1	4%	0.041	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	19.9	-169.3	0	0	0	0	0	115.7	G413 R414 A419	G413-G416 PolarHBondContact O-N 3.15Å; R414-G416 VanDerWaalsContact C-N 3.33Å; G416-A419 CarbonylContact C-O 3.51Å; G416-A419 WeakPolarHBondContact CA-O 3.49Å
417	R	79.6	Confident	90.7	Very high	19 Å²	19	20.5 Å²	20.5	7%	0.072	11%	0.112	C	C	.	.	S	Bend	trans	-79.5	-37.9	-173.5	-73.2	-167.8	164.7	-139	-4	114.5	S369 I370 T371 G413 R414	S369-R417 PolarHBondContact O-NH1 3.09Å; S369-R417 PolarHBondContact O-NH2 2.74Å; I370-R417 PolarHBondContact O-NH1 3.18Å; T371-R417 HydrophobicContact CG2-CB 4.3Å; T371-R417 VanDerWaalsContact N-NH1 3.2Å; T371-R417 PolarHBondContact OG1-NH1 2.85Å; G413-R417 WeakPolarHBondContact O-CG 3.3Å; R414-R417 VanDerWaalsContact CZ-NH2 3.25Å
418	E	79.1	Confident	90.9	Very high	69 Å²	69	20.1 Å²	20.1	32%	0.322	11%	0.111	S	C	.	.	S	Bend	trans	-118.5	-22.7	-174.2	-61.7	175.8	154.9	0	0	113.4	H258 T371 P373 G374 R376	H258-E418 PolarHBondContact NE2-O 3.47Å; T371-E418 HydrophobicContact CG2-CG 4.21Å; P373-E418 WeakPolarHBondContact CA-OE1 3.44Å; G374-E418 PolarHBondContact N-OE2 3.29Å; R376-E418 IonicContact CZ-OE2 3.9Å; R376-E418 IonicContact NH1-OE2 2.85Å; R376-E418 PolarHBondContact NH1-OE2 3.32Å; R376-E418 IonicContact NH2-OE2 2.77Å; R376-E418 PolarHBondContact NH2-OE2 2.82Å
419	A	84.8	Confident	91.1	Very high	32 Å²	32	24.4 Å²	24.4	26%	0.264	13%	0.134	S	C	.	.	S	Bend	trans	-157.7	178.5	172.8	0	0	0	0	0	109.3	H258 G416	H258-A419 VanDerWaalsContact CB-O 3.27Å; H258-A419 WeakPolarHBondContact CB-O 3.24Å; H258-A419 VanDerWaalsContact CD2-CA 3.46Å; H258-A419 WeakPolarHBondContact CD2-CA 3.48Å; H258-A419 PolarHBondContact CD2-N 2.73Å; G416-A419 CarbonylContact C-O 3.51Å; G416-A419 WeakPolarHBondContact CA-O 3.49Å
420	A	90.8	Very high	91.4	Very high	60 Å²	60	22.8 Å²	22.8	50%	0.496	14%	0.139	S	C	.	.			trans	-59.5	141.8	173.9	0	0	0	0	0	111.1	P259	P259-A420 HydrophobicContact CG-CB 4.03Å; P259-A420 WeakPolarHBondContact O-CA 3.34Å
421	G	92.9	Very high	91.7	Very high	7 Å²	7	24 Å²	24	7%	0.072	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	173.8	-173.3	0	0	0	0	0	114.2	P259 I260 K261 R376	P259-G421 PolarHBondContact O-N 2.85Å; P259-G421 VanDerWaalsContact O-N 3.13Å; I260-G421 CarbonylContact C-O 3.44Å; I260-G421 WeakPolarHBondContact CA-O 3.37Å; K261-G421 PolarHBondContact N-O 2.88Å; R376-G421 CarbonylContact O-C 3.59Å; R376-G421 WeakPolarHBondContact O-CA 3.15Å
422	V	95.3	Very high	91.9	Very high	33 Å²	33	26.4 Å²	26.4	20%	0.2	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.3	178.9	-174.9	0	0	0	0	109.6	K261 L263 R376 Y377 V378 L424	K261-V422 HydrophobicContact CB-CG2 4.39Å; K261-V422 CarbonylContact O-C 3.56Å; K261-V422 WeakPolarHBondContact O-CA 3.45Å; L263-V422 HydrophobicContact CD1-CG1 4.14Å; R376-V422 PolarHBondContact O-N 2.79Å; Y377-V422 CarbonylContact C-O 3.53Å; Y377-V422 VanDerWaalsContact CA-O 3.32Å; Y377-V422 WeakPolarHBondContact CA-O 3.17Å; Y377-V422 HydrophobicContact CD1-CB 3.86Å; Y377-V422 HydrophobicContact CD1-CG2 4.34Å; Y377-V422 HydrophobicContact CE1-CB 4.07Å; Y377-V422 HydrophobicContact CE1-CG2 4.04Å; V378-V422 PolarHBondContact N-O 2.88Å; V422-L424 HydrophobicContact CG1-CG 4.38Å
423	C	96.6	Very high	92.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	119.6	172.1	-174	0	0	0	0	109.3	I260 K261 I262 L263 V378 S412	I260-C423 HydrophobicContact CG2-CB 4.1Å; K261-C423 PolarHBondContact O-N 3.29Å; I262-C423 WeakPolarHBondContact CA-O 3.48Å; I262-C423 HydrophobicContact CG1-CB 4.43Å; L263-C423 PolarHBondContact N-O 3.45Å; V378-C423 HydrophobicContact CB-CB 4.35Å; V378-C423 CarbonylContact O-C 3.46Å; V378-C423 WeakPolarHBondContact O-CA 3.5Å; S412-C423 VanDerWaalsContact CB-SG 3.6Å
424	L	97.7	Very high	92.5	Very high	39 Å²	39	39.7 Å²	39.7	20%	0.204	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	110.2	176.5	-68	154.7	0	0	0	108.2	L263 V279 I283 V378 I379 D380 V422	L263-L424 HydrophobicContact CB-CD2 3.88Å; L263-L424 HydrophobicContact CD1-CD2 3.77Å; L263-L424 HydrophobicContact CG-CD2 4.46Å; L263-L424 CarbonylContact O-C 3.47Å; L263-L424 WeakPolarHBondContact O-CA 3.46Å; V279-L424 HydrophobicContact CG1-CD1 3.81Å; I283-L424 HydrophobicContact CD1-CD1 3.4Å; I283-L424 HydrophobicContact CG1-CD1 4.01Å; V378-L424 PolarHBondContact O-N 3.03Å; I379-L424 CarbonylContact C-O 3.55Å; I379-L424 WeakPolarHBondContact CA-O 3.35Å; I379-L424 HydrophobicContact CG1-CD1 4.46Å; D380-L424 PolarHBondContact N-O 3.02Å; V422-L424 HydrophobicContact CG1-CG 4.38Å
425	R	97.9	Very high	92.7	Very high	10 Å²	10	39.6 Å²	39.6	4%	0.038	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	121.1	179.1	-68.6	173.1	163.6	175.3	2.3	109.1	I262 L263 N264 V265 Y427	I262-R425 HydrophobicContact CG2-CG 4.35Å; L263-R425 PolarHBondContact O-N 3.25Å; N264-R425 WeakPolarHBondContact OD1-CB 3.44Å; N264-R425 WeakPolarHBondContact OD1-CD 3.27Å; V265-R425 PolarHBondContact N-O 3.46Å; V265-R425 VanDerWaalsContact N-O 3.13Å; R425-Y427 HydrophobicContact CB-CD1 4.12Å; R425-Y427 HydrophobicContact CB-CD2 4.1Å; R425-Y427 HydrophobicContact CB-CE1 3.76Å; R425-Y427 HydrophobicContact CB-CE2 3.76Å; R425-Y427 HydrophobicContact CB-CG 4.3Å; R425-Y427 WeakPolarHBondContact CD-OH 3.35Å; R425-Y427 HydrophobicContact CG-CE1 3.98Å; R425-Y427 HydrophobicContact CG-CE2 3.87Å; R425-Y427 VanDerWaalsContact CG-CZ 3.48Å; R425-Y427 WeakPolarHBondContact CG-OH 3.27Å; R425-Y427 PolarHBondContact NE-OH 2.8Å; R425-Y427 PolarHBondContact O-N 3.26Å; R425-Y427 VanDerWaalsContact O-N 3.08Å
426	L	97.4	Very high	92.8	Very high	10 Å²	10	42.9 Å²	42.9	5%	0.052	24%	0.24	C	C	.	.	S	Bend	trans	-84.3	36.2	178.4	-54.5	-174.2	0	0	0	111.5	V265 L269 A276 V279 I379 D380	V265-L426 HydrophobicContact CG1-CD2 4.4Å; L269-L426 HydrophobicContact CD1-CB 3.72Å; L269-L426 HydrophobicContact CD1-CD2 4.37Å; L269-L426 HydrophobicContact CD1-CG 4.47Å; A276-L426 HydrophobicContact CB-CD1 3.72Å; V279-L426 HydrophobicContact CG2-CD2 4.04Å; I379-L426 HydrophobicContact CG2-CD1 3.66Å; I379-L426 HydrophobicContact CG2-CD2 4.11Å; I379-L426 HydrophobicContact CG2-CG 3.86Å; D380-L426 PolarHBondContact O-N 2.94Å
427	Y	97.2	Very high	93.1	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.267	C	S	.	.	S	Bend	trans	-147.7	153.2	175.8	47.9	-91.2	0	0	0	109.3	V265 D380 G382 W402 A408 R425 E431 Y432 M435	V265-Y427 VanDerWaalsContact CG2-C 3.47Å; D380-Y427 HydrophobicContact CB-CE1 4.25Å; D380-Y427 WeakPolarHBondContact O-CE1 3.45Å; D380-Y427 WeakPolarHBondContact OD2-CE1 3.22Å; D380-Y427 PolarHBondContact OD2-OH 2.7Å; G382-Y427 VanDerWaalsContact CA-CD1 3.44Å; G382-Y427 VanDerWaalsContact N-CE1 3.35Å; W402-Y427 HydrophobicContact CZ3-CD1 4.29Å; W402-Y427 HydrophobicContact CZ3-CG 4.05Å; A408-Y427 WeakPolarHBondContact CB-OH 3.28Å; R425-Y427 HydrophobicContact CB-CD1 4.12Å; R425-Y427 HydrophobicContact CB-CD2 4.1Å; R425-Y427 HydrophobicContact CB-CE1 3.76Å; R425-Y427 HydrophobicContact CB-CE2 3.76Å; R425-Y427 HydrophobicContact CB-CG 4.3Å; R425-Y427 WeakPolarHBondContact CD-OH 3.35Å; R425-Y427 HydrophobicContact CG-CE1 3.98Å; R425-Y427 HydrophobicContact CG-CE2 3.87Å; R425-Y427 VanDerWaalsContact CG-CZ 3.48Å; R425-Y427 WeakPolarHBondContact CG-OH 3.27Å; R425-Y427 PolarHBondContact NE-OH 2.8Å; R425-Y427 PolarHBondContact O-N 3.26Å; R425-Y427 VanDerWaalsContact O-N 3.08Å; Y427-E431 VanDerWaalsContact CA-OE2 3.24Å; Y427-E431 WeakPolarHBondContact CA-OE2 3.42Å; Y427-E431 WeakPolarHBondContact CB-OE2 3.32Å; Y427-Y432 AromaticContact CE2-CD2 3.87Å; Y427-Y432 HydrophobicContact CE2-CD2 3.87Å; Y427-Y432 HydrophobicContact CE2-CG 4.35Å; Y427-M435 HydrophobicContact CD1-CE 4.23Å; Y427-M435 HydrophobicContact CD2-CE 3.42Å; Y427-M435 VanDerWaalsContact CD2-CE 3.42Å; Y427-M435 HydrophobicContact CE1-CE 4.33Å; Y427-M435 HydrophobicContact CE2-CE 3.51Å; Y427-M435 HydrophobicContact CE2-SD 4.33Å; Y427-M435 HydrophobicContact CG-CE 3.77Å
428	T	96.7	Very high	93.5	Very high	14 Å²	14	50.1 Å²	50.1	9%	0.086	28%	0.276	C	S	.	.			trans	-76.9	164.6	-175.7	65.6	0	0	0	0	112.3	V265 S430 E431 Y432	V265-T428 HydrophobicContact CG2-CG2 4.37Å; V265-T428 WeakPolarHBondContact O-CA 3.28Å; T428-S430 PolarHBondContact O-N 2.77Å; T428-E431 PolarHBondContact N-OE2 3.47Å; T428-E431 PolarHBondContact O-N 2.97Å; T428-E431 WeakPolarHBondContact OG1-CG 3.37Å; T428-E431 PolarHBondContact OG1-N 3.35Å; T428-E431 VanDerWaalsContact OG1-N 3.15Å; T428-E431 PolarHBondContact OG1-OE2 3.12Å; T428-Y432 PolarHBondContact O-N 3.19Å
429	D	95.7	Very high	93.9	Very high	90 Å²	90	47.9 Å²	47.9	48%	0.481	27%	0.268	S	S	.	.	H	α-helix	trans	-58.6	-35.5	170.7	-80.2	-73.3	0	0	0	112.9	N264 Y432 K433	N264-D429 PolarHBondContact ND2-OD1 3.04Å; N264-D429 PolarHBondContact ND2-OD2 3.39Å; D429-Y432 PolarHBondContact O-N 2.82Å; D429-K433 WeakPolarHBondContact O-CB 3.32Å; D429-K433 VanDerWaalsContact O-CG 3.25Å; D429-K433 WeakPolarHBondContact O-CG 3.45Å; D429-K433 PolarHBondContact O-N 2.95Å
430	S	95.7	Very high	94	Very high	73 Å²	73	53.4 Å²	53.4	51%	0.51	28%	0.282	S	S	.	.	H	α-helix	trans	-64.4	-48	176.3	-175.7	0	0	0	0	111.2	T428 Y432 K433 N434	T428-S430 PolarHBondContact O-N 2.77Å; S430-Y432 VanDerWaalsContact C-N 3.34Å; S430-Y432 PolarHBondContact O-N 3.46Å; S430-K433 WeakPolarHBondContact O-CB 3.48Å; S430-K433 PolarHBondContact O-N 3.23Å; S430-N434 PolarHBondContact O-N 3.16Å; S430-N434 PolarHBondContact O-ND2 3.11Å
431	E	96.1	Very high	94.1	Very high	34 Å²	34	51.3 Å²	51.3	16%	0.159	26%	0.263	C	S	.	.	H	α-helix	trans	-61.2	-43.5	176.5	-71.5	165.1	150.1	0	0	111	S268 W402 Y427 T428 K433 N434 M435	S268-E431 WeakPolarHBondContact CB-OE1 3.19Å; S268-E431 VanDerWaalsContact OG-CD 3.27Å; S268-E431 PolarHBondContact OG-OE1 3.41Å; W402-E431 HydrophobicContact CH2-CB 4Å; W402-E431 HydrophobicContact CH2-CG 4.08Å; W402-E431 HydrophobicContact CZ2-CB 4.26Å; W402-E431 HydrophobicContact CZ2-CG 4.06Å; Y427-E431 VanDerWaalsContact CA-OE2 3.24Å; Y427-E431 WeakPolarHBondContact CA-OE2 3.42Å; Y427-E431 WeakPolarHBondContact CB-OE2 3.32Å; T428-E431 PolarHBondContact N-OE2 3.47Å; T428-E431 PolarHBondContact O-N 2.97Å; T428-E431 WeakPolarHBondContact OG1-CG 3.37Å; T428-E431 PolarHBondContact OG1-N 3.35Å; T428-E431 VanDerWaalsContact OG1-N 3.15Å; T428-E431 PolarHBondContact OG1-OE2 3.12Å; E431-K433 VanDerWaalsContact C-N 3.35Å; E431-K433 PolarHBondContact O-N 3.47Å; E431-N434 PolarHBondContact O-N 2.97Å; E431-M435 WeakPolarHBondContact O-CG 3.43Å; E431-M435 PolarHBondContact O-N 3.48Å
432	Y	95.8	Very high	94	Very high	51 Å²	51	53.8 Å²	53.8	20%	0.2	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-40.1	175.3	-179.2	-109.2	0	0	0	112.9	K405 A408 Y427 T428 D429 S430 N434 M435	K405-Y432 HydrophobicContact CB-CE2 4.17Å; K405-Y432 WeakPolarHBondContact CE-O 3.31Å; K405-Y432 HydrophobicContact CG-CD2 4.45Å; K405-Y432 HydrophobicContact CG-CE2 3.86Å; A408-Y432 HydrophobicContact CB-CE2 3.96Å; Y427-Y432 AromaticContact CE2-CD2 3.87Å; Y427-Y432 HydrophobicContact CE2-CD2 3.87Å; Y427-Y432 HydrophobicContact CE2-CG 4.35Å; T428-Y432 PolarHBondContact O-N 3.19Å; D429-Y432 PolarHBondContact O-N 2.82Å; S430-Y432 VanDerWaalsContact C-N 3.34Å; S430-Y432 PolarHBondContact O-N 3.46Å; Y432-N434 VanDerWaalsContact C-N 3.27Å; Y432-N434 PolarHBondContact O-N 3.27Å; Y432-M435 HydrophobicContact CD2-SD 3.94Å; Y432-M435 WeakPolarHBondContact O-CB 3.47Å; Y432-M435 PolarHBondContact O-N 2.85Å
433	K	95.3	Very high	93.8	Very high	146 Å²	146	52.3 Å²	52.3	64%	0.635	26%	0.264	S	S	*	.	H	α-helix	trans	-61.2	-37	177	-78.1	171.7	-176.2	-179.8	0	111.9	K405 D429 S430 E431 M435	K405-K433 WeakPolarHBondContact CE-O 3.32Å; K405-K433 PolarHBondContact NZ-O 3.14Å; D429-K433 WeakPolarHBondContact O-CB 3.32Å; D429-K433 VanDerWaalsContact O-CG 3.25Å; D429-K433 WeakPolarHBondContact O-CG 3.45Å; D429-K433 PolarHBondContact O-N 2.95Å; S430-K433 WeakPolarHBondContact O-CB 3.48Å; S430-K433 PolarHBondContact O-N 3.23Å; E431-K433 VanDerWaalsContact C-N 3.35Å; E431-K433 PolarHBondContact O-N 3.47Å; K433-M435 VanDerWaalsContact C-N 3.34Å
434	N	95.4	Very high	93.5	Very high	134 Å²	134	54 Å²	54	72%	0.717	27%	0.273	S	S	*	.	H	α-helix	trans	-79.2	-11.1	179.9	-66.4	-19.5	0	0	0	114.1	S430 E431 Y432	S430-N434 PolarHBondContact O-N 3.16Å; S430-N434 PolarHBondContact O-ND2 3.11Å; E431-N434 PolarHBondContact O-N 2.97Å; Y432-N434 VanDerWaalsContact C-N 3.27Å; Y432-N434 PolarHBondContact O-N 3.27Å
435	M	94.3	Very high	93	Very high	6 Å²	6	52.8 Å²	52.8	3%	0.03	27%	0.266	C	S	.	.	S	Bend	trans	-66.1	144.3	175.9	-66.7	-177.8	-165.6	0	0	111.8	W402 I403 K405 Y427 E431 Y432 K433	W402-M435 HydrophobicContact CB-CG 4.47Å; W402-M435 HydrophobicContact CD2-CE 4.32Å; W402-M435 HydrophobicContact CE3-CE 3.36Å; W402-M435 HydrophobicContact CZ3-CE 3.56Å; I403-M435 HydrophobicContact CG1-SD 4.24Å; I403-M435 WeakPolarHBondContact O-CB 3.4Å; I403-M435 WeakPolarHBondContact O-CG 3.21Å; K405-M435 VanDerWaalsContact CE-O 3.26Å; K405-M435 WeakPolarHBondContact CE-O 3.46Å; K405-M435 HydrophobicContact CG-CB 4.02Å; Y427-M435 HydrophobicContact CD1-CE 4.23Å; Y427-M435 HydrophobicContact CD2-CE 3.42Å; Y427-M435 VanDerWaalsContact CD2-CE 3.42Å; Y427-M435 HydrophobicContact CE1-CE 4.33Å; Y427-M435 HydrophobicContact CE2-CE 3.51Å; Y427-M435 HydrophobicContact CE2-SD 4.33Å; Y427-M435 HydrophobicContact CG-CE 3.77Å; E431-M435 WeakPolarHBondContact O-CG 3.43Å; E431-M435 PolarHBondContact O-N 3.48Å; Y432-M435 HydrophobicContact CD2-SD 3.94Å; Y432-M435 WeakPolarHBondContact O-CB 3.47Å; Y432-M435 PolarHBondContact O-N 2.85Å; K433-M435 VanDerWaalsContact C-N 3.34Å
436	P	92.1	Very high	92.4	Very high	70 Å²	70	52.6 Å²	52.6	46%	0.455	27%	0.266	S	S	.	.			trans	-63.2	151.4	175.7	27	-33.2	0	0	0	110.7	S404 K405 Q438	S404-P436 CarbonylContact C-O 3.56Å; S404-P436 WeakPolarHBondContact CA-O 3.47Å; S404-P436 VanDerWaalsContact CB-O 3.29Å; S404-P436 WeakPolarHBondContact CB-O 3.14Å; K405-P436 PolarHBondContact N-O 3.3Å; P436-Q438 PolarHBondContact O-N 3.16Å
437	L	89.4	Confident	92	Very high	116 Å²	116	53.1 Å²	53.1	61%	0.607	27%	0.27	S	S	*	.	S	Bend	trans	-65.1	-42.7	-177.8	-174.6	63.7	0	0	0	112.3	K405 G406	K405-L437 HydrophobicContact CD-CD1 4.42Å; G406-L437 PolarHBondContact N-O 3.43Å
438	Q	86.8	Confident	91.8	Very high	58 Å²	58	53.1 Å²	53.1	27%	0.271	27%	0.27	S	S	.	.	S	Bend	trans	-130	158	-177.8	-64.5	-60.4	-17	0	0	111.2	P436	P436-Q438 PolarHBondContact O-N 3.16Å
439	P	87.5	Confident	91.6	Very high	22 Å²	22	52.8 Å²	52.8	14%	0.143	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-59.4	139.8	172.2	-19.4	31.6	0	0	0	110.8	S404 Q407	S404-P439 VanDerWaalsContact OG-CD 3.25Å; S404-P439 WeakPolarHBondContact OG-CD 3.15Å; S404-P439 WeakPolarHBondContact OG-CG 3.08Å; Q407-P439 HydrophobicContact CG-CG 3.85Å
440	R	88.6	Confident	91.4	Very high	148 Å²	148	49 Å²	49	56%	0.558	25%	0.251	S	S	*	.	P	Polyproline II helix	trans	-67.2	129.7	170.6	-173.8	174.6	-177.8	171	7.8	109.1	Q442 L444	R440-Q442 PolarHBondContact O-N 3.34Å; R440-L444 HydrophobicContact CG-CD1 4.31Å
441	P	91.6	Very high	91.3	Very high	16 Å²	16	45.9 Å²	45.9	10%	0.104	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-61.5	134.3	178.6	-25.2	35.2	0	0	0	112.6	R171 I443 L444	R171-P441 HydrophobicContact CB-CB 4.13Å; R171-P441 HydrophobicContact CB-CG 4.39Å; R171-P441 VanDerWaalsContact CZ-CG 3.42Å; R171-P441 VanDerWaalsContact NH2-CG 3.31Å; P441-I443 HydrophobicContact CB-CG2 4.09Å; P441-I443 PolarHBondContact O-N 3.36Å; P441-L444 HydrophobicContact CB-CD1 4.48Å; P441-L444 HydrophobicContact CB-CG 4.41Å; P441-L444 HydrophobicContact CG-CD1 4.4Å; P441-L444 PolarHBondContact O-N 2.82Å
442	Q	90.2	Very high	91.2	Very high	60 Å²	60	44.2 Å²	44.2	28%	0.28	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-63.5	-28.6	-175.7	-168.7	180	11.1	0	0	112.5	R171 L173 R440 L444 Q445 A446	R171-Q442 PolarHBondContact O-N 3.45Å; R171-Q442 VanDerWaalsContact O-N 3.09Å; L173-Q442 HydrophobicContact CB-CB 4.39Å; L173-Q442 HydrophobicContact CB-CG 4.24Å; R440-Q442 PolarHBondContact O-N 3.34Å; Q442-L444 PolarHBondContact O-N 3.15Å; Q442-L444 VanDerWaalsContact O-N 3.11Å; Q442-Q445 CarbonylContact O-C 3.12Å; Q442-Q445 WeakPolarHBondContact O-CG 3.5Å; Q442-Q445 PolarHBondContact O-N 2.82Å; Q442-A446 HydrophobicContact CG-CB 4.44Å; Q442-A446 WeakPolarHBondContact O-CB 3.41Å; Q442-A446 PolarHBondContact O-N 2.91Å
443	I	91.9	Very high	91.1	Very high	1 Å²	1	42 Å²	42	1%	0.005	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-58.7	-24	178.9	-163.8	168	0	0	0	113.8	L173 D176 P441 Q445 L448 W468 P472	L173-I443 HydrophobicContact CD1-CB 4.09Å; L173-I443 HydrophobicContact CD1-CG1 4.02Å; D176-I443 HydrophobicContact CB-CB 4.38Å; D176-I443 HydrophobicContact CB-CD1 4.29Å; D176-I443 HydrophobicContact CB-CG2 4.47Å; D176-I443 VanDerWaalsContact OD2-CG2 3.28Å; D176-I443 WeakPolarHBondContact OD2-CG2 3.13Å; P441-I443 HydrophobicContact CB-CG2 4.09Å; P441-I443 PolarHBondContact O-N 3.36Å; I443-Q445 VanDerWaalsContact C-N 3.27Å; I443-Q445 PolarHBondContact O-N 2.87Å; I443-L448 HydrophobicContact CG1-CD2 4.2Å; I443-W468 HydrophobicContact CD1-CE3 3.44Å; I443-W468 VanDerWaalsContact CD1-CE3 3.44Å; I443-W468 HydrophobicContact CD1-CZ3 3.53Å; I443-P472 HydrophobicContact CD1-CG 3.99Å; I443-P472 HydrophobicContact CG1-CB 4.44Å; I443-P472 HydrophobicContact CG1-CG 4.01Å
444	L	90.6	Very high	91	Very high	37 Å²	37	36.7 Å²	36.7	19%	0.194	19%	0.191	C	C	.	.	G	3₁₀ helix	trans	-79.4	-9.5	179.8	-59.2	179.8	0	0	0	113.7	R440 P441 Q442 S471	R440-L444 HydrophobicContact CG-CD1 4.31Å; P441-L444 HydrophobicContact CB-CD1 4.48Å; P441-L444 HydrophobicContact CB-CG 4.41Å; P441-L444 HydrophobicContact CG-CD1 4.4Å; P441-L444 PolarHBondContact O-N 2.82Å; Q442-L444 PolarHBondContact O-N 3.15Å; Q442-L444 VanDerWaalsContact O-N 3.11Å; L444-S471 WeakPolarHBondContact CD2-O 3.38Å
445	Q	86.1	Confident	90.9	Very high	13 Å²	13	30.3 Å²	30.3	6%	0.061	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-144.6	28.6	-170.2	64.4	-172.8	52.3	0	0	112.2	I386 K387 W389 Q442 I443	I386-Q445 VanDerWaalsContact CG2-NE2 3.27Å; K387-Q445 PolarHBondContact O-NE2 2.96Å; W389-Q445 WeakPolarHBondContact CB-O 2.99Å; W389-Q445 PolarHBondContact N-O 2.82Å; Q442-Q445 CarbonylContact O-C 3.12Å; Q442-Q445 WeakPolarHBondContact O-CG 3.5Å; Q442-Q445 PolarHBondContact O-N 2.82Å; I443-Q445 VanDerWaalsContact C-N 3.27Å; I443-Q445 PolarHBondContact O-N 2.87Å
446	A	87	Confident	90.8	Very high	5 Å²	5	30.5 Å²	30.5	4%	0.041	16%	0.158	C	C	.	.	S	Bend	trans	-124.9	150.5	178.6	0	0	0	0	0	110.7	L173 Q442 L448	L173-A446 HydrophobicContact CD1-CB 4.2Å; L173-A446 HydrophobicContact CD2-CB 4.06Å; Q442-A446 HydrophobicContact CG-CB 4.44Å; Q442-A446 WeakPolarHBondContact O-CB 3.41Å; Q442-A446 PolarHBondContact O-N 2.91Å; A446-L448 PolarHBondContact O-N 2.8Å
447	P	88.6	Confident	90.7	Very high	21 Å²	21	28.5 Å²	28.5	14%	0.136	15%	0.146	C	C	.	.			trans	-64	134.1	169.1	27.6	-33.1	0	0	0	110	W389 E396	W389-P447 HydrophobicContact CD2-CB 4.24Å; W389-P447 HydrophobicContact CZ2-CB 4.2Å; E396-P447 VanDerWaalsContact OE1-CD 3.25Å; E396-P447 WeakPolarHBondContact OE1-CD 3.39Å; E396-P447 WeakPolarHBondContact OE1-CG 3.35Å
448	L	91.8	Very high	90.7	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.121	C	C	.	.			trans	-100.9	-3.2	-172.8	-58.8	178.9	0	0	0	113.9	I443 A446 G450 V451 L452 P472 I477	I443-L448 HydrophobicContact CG1-CD2 4.2Å; A446-L448 PolarHBondContact O-N 2.8Å; L448-G450 VanDerWaalsContact C-N 3.32Å; L448-G450 PolarHBondContact O-N 2.88Å; L448-V451 HydrophobicContact CD2-CG2 4.34Å; L448-V451 WeakPolarHBondContact O-CB 3.38Å; L448-V451 PolarHBondContact O-N 3.13Å; L448-L452 HydrophobicContact CB-CD1 4.05Å; L448-L452 HydrophobicContact CB-CG 4.25Å; L448-L452 WeakPolarHBondContact O-CB 3.08Å; L448-L452 VanDerWaalsContact O-CG 3.23Å; L448-L452 WeakPolarHBondContact O-CG 3.48Å; L448-L452 PolarHBondContact O-N 2.98Å; L448-P472 HydrophobicContact CD1-CB 3.35Å; L448-P472 HydrophobicContact CD1-CG 3.86Å; L448-I477 HydrophobicContact CD1-CG1 3.76Å
449	S	92.3	Very high	90.7	Very high	7 Å²	7	26.9 Å²	26.9	5%	0.049	14%	0.139	C	C	.	.	H	α-helix	trans	-56.7	-42.9	-176.4	50.7	0	0	0	0	113	L453	S449-L453 WeakPolarHBondContact O-CB 3.47Å; S449-L453 PolarHBondContact O-N 2.89Å
450	G	92.9	Very high	90.8	Very high	10 Å²	10	27.3 Å²	27.3	10%	0.103	14%	0.14	C	C	.	.	H	α-helix	trans	-65.6	-39.5	176.2	0	0	0	0	0	112.8	L448 N454	L448-G450 VanDerWaalsContact C-N 3.32Å; L448-G450 PolarHBondContact O-N 2.88Å; G450-N454 VanDerWaalsContact O-CG 3.29Å; G450-N454 PolarHBondContact O-N 3.33Å; G450-N454 VanDerWaalsContact O-N 3.15Å; G450-N454 PolarHBondContact O-ND2 3.39Å
451	V	93.2	Very high	90.7	Very high	7 Å²	7	23.4 Å²	23.4	4%	0.042	13%	0.127	C	C	.	.	H	α-helix	trans	-62.5	-51.9	176.6	-177.2	0	0	0	0	110.6	L173 I177 L448 L453 N454 L455 W468	L173-V451 HydrophobicContact CD1-CG2 4.12Å; L173-V451 HydrophobicContact CD2-CG2 4.21Å; L173-V451 HydrophobicContact CG-CG2 4.34Å; I177-V451 HydrophobicContact CD1-CB 4.01Å; I177-V451 HydrophobicContact CD1-CG1 3.56Å; I177-V451 HydrophobicContact CD1-CG2 3.38Å; I177-V451 HydrophobicContact CG1-CG1 3.65Å; I177-V451 HydrophobicContact CG1-CG2 4.28Å; I177-V451 HydrophobicContact CG2-CG1 4.37Å; L448-V451 HydrophobicContact CD2-CG2 4.34Å; L448-V451 WeakPolarHBondContact O-CB 3.38Å; L448-V451 PolarHBondContact O-N 3.13Å; V451-L453 VanDerWaalsContact C-N 3.35Å; V451-L453 PolarHBondContact O-N 3.14Å; V451-N454 WeakPolarHBondContact O-CB 3.27Å; V451-N454 PolarHBondContact O-N 3Å; V451-N454 VanDerWaalsContact O-N 3.12Å; V451-L455 HydrophobicContact CG1-CD1 4.19Å; V451-L455 HydrophobicContact CG1-CG 4.36Å; V451-L455 WeakPolarHBondContact O-CG 3.38Å; V451-L455 PolarHBondContact O-N 3.4Å; V451-W468 HydrophobicContact CG1-CH2 3.99Å; V451-W468 HydrophobicContact CG1-CZ3 4.19Å
452	L	94.3	Very high	90.6	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-61.4	-42.4	-178.6	-67.4	166.4	0	0	0	111.3	L448 N454 L455 V456 P463 I477 I481 L484	L448-L452 HydrophobicContact CB-CD1 4.05Å; L448-L452 HydrophobicContact CB-CG 4.25Å; L448-L452 WeakPolarHBondContact O-CB 3.08Å; L448-L452 VanDerWaalsContact O-CG 3.23Å; L448-L452 WeakPolarHBondContact O-CG 3.48Å; L448-L452 PolarHBondContact O-N 2.98Å; L452-N454 VanDerWaalsContact C-N 3.3Å; L452-N454 PolarHBondContact O-N 2.87Å; L452-L455 PolarHBondContact O-N 3.02Å; L452-V456 WeakPolarHBondContact O-CG2 3.36Å; L452-V456 PolarHBondContact O-N 2.94Å; L452-P463 HydrophobicContact CD2-CB 3.68Å; L452-P463 HydrophobicContact CD2-CG 3.49Å; L452-P463 VanDerWaalsContact CD2-CG 3.49Å; L452-I477 HydrophobicContact CD2-CG2 4.41Å; L452-I481 HydrophobicContact CD1-CG1 3.9Å; L452-L484 HydrophobicContact CB-CD1 3.7Å
453	L	94.2	Very high	90.4	Very high	4 Å²	4	20.8 Å²	20.8	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-58.5	-43.6	174.5	-179	60.5	0	0	0	111.6	S449 V451 S457 L484 A489 L529 M536 P543	S449-L453 WeakPolarHBondContact O-CB 3.47Å; S449-L453 PolarHBondContact O-N 2.89Å; V451-L453 VanDerWaalsContact C-N 3.35Å; V451-L453 PolarHBondContact O-N 3.14Å; L453-S457 WeakPolarHBondContact O-CB 3.41Å; L453-S457 PolarHBondContact O-N 3.28Å; L453-L484 HydrophobicContact CB-CD1 4.26Å; L453-L484 HydrophobicContact CB-CD2 3.98Å; L453-L484 HydrophobicContact CD1-CD2 4.49Å; L453-A489 HydrophobicContact CD1-CB 4.15Å; L453-L529 HydrophobicContact CD1-CD1 3.65Å; L453-M536 HydrophobicContact CD2-CB 4Å; L453-M536 HydrophobicContact CD2-CE 4.48Å; L453-P543 HydrophobicContact CD2-CB 4.34Å; L453-P543 HydrophobicContact CD2-CG 4.1Å
454	N	91.9	Very high	90.1	Very high	34 Å²	34	25.1 Å²	25.1	18%	0.182	14%	0.141	C	C	.	.	H	α-helix	trans	-65.8	-43.1	177.2	-70	-28.1	0	0	0	111.6	I152 G450 V451 L452 S457 M458	I152-N454 HydrophobicContact CD1-CB 3.97Å; I152-N454 WeakPolarHBondContact CD1-OD1 3.44Å; I152-N454 HydrophobicContact CG1-CB 4.37Å; G450-N454 VanDerWaalsContact O-CG 3.29Å; G450-N454 PolarHBondContact O-N 3.33Å; G450-N454 VanDerWaalsContact O-N 3.15Å; G450-N454 PolarHBondContact O-ND2 3.39Å; V451-N454 WeakPolarHBondContact O-CB 3.27Å; V451-N454 PolarHBondContact O-N 3Å; V451-N454 VanDerWaalsContact O-N 3.12Å; L452-N454 VanDerWaalsContact C-N 3.3Å; L452-N454 PolarHBondContact O-N 2.87Å; N454-S457 WeakPolarHBondContact CA-OG 3.22Å; N454-S457 PolarHBondContact O-N 3.07Å; N454-S457 PolarHBondContact O-OG 2.86Å; N454-M458 HydrophobicContact CB-CE 4.48Å; N454-M458 WeakPolarHBondContact O-CE 3.46Å; N454-M458 WeakPolarHBondContact O-CG 3.41Å; N454-M458 PolarHBondContact O-N 3.36Å
455	L	92.8	Very high	89.9	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-59.7	-50	176.8	-68.4	179.7	0	0	0	111.9	V451 L452 S457 M458 N459 I460 F466 W468	V451-L455 HydrophobicContact CG1-CD1 4.19Å; V451-L455 HydrophobicContact CG1-CG 4.36Å; V451-L455 WeakPolarHBondContact O-CG 3.38Å; V451-L455 PolarHBondContact O-N 3.4Å; L452-L455 PolarHBondContact O-N 3.02Å; L455-S457 PolarHBondContact O-N 3.17Å; L455-M458 HydrophobicContact CD2-CE 3.94Å; L455-M458 CarbonylContact O-C 3.53Å; L455-M458 WeakPolarHBondContact O-CA 3.17Å; L455-M458 WeakPolarHBondContact O-CB 3.28Å; L455-M458 PolarHBondContact O-N 2.89Å; L455-N459 PolarHBondContact O-N 2.83Å; L455-I460 CarbonylContact C-O 3.56Å; L455-I460 HydrophobicContact CB-CB 4.21Å; L455-I460 HydrophobicContact CB-CG2 4.44Å; L455-I460 HydrophobicContact CD2-CD1 3.77Å; L455-I460 WeakPolarHBondContact O-CB 3.39Å; L455-I460 PolarHBondContact O-N 3.41Å; L455-F466 HydrophobicContact CD1-CD1 4.18Å; L455-F466 HydrophobicContact CD1-CG 4.19Å; L455-F466 HydrophobicContact CD2-CD1 4.28Å; L455-F466 HydrophobicContact CD2-CD2 3.75Å; L455-F466 HydrophobicContact CD2-CE1 4.05Å; L455-F466 HydrophobicContact CD2-CE2 3.49Å; L455-F466 VanDerWaalsContact CD2-CE2 3.49Å; L455-F466 HydrophobicContact CD2-CG 4.11Å; L455-F466 HydrophobicContact CD2-CZ 3.62Å; L455-W468 HydrophobicContact CD1-CH2 3.49Å; L455-W468 VanDerWaalsContact CD1-CH2 3.49Å; L455-W468 HydrophobicContact CD1-CZ2 3.78Å; L455-W468 HydrophobicContact CD1-CZ3 4.43Å
456	V	92.1	Very high	90.2	Very high	9 Å²	9	30.1 Å²	30.1	6%	0.055	16%	0.163	C	C	.	.	H	α-helix	trans	-61.4	-36.9	177.3	179.7	0	0	0	0	110.4	L452 M458 N459 I460 V490 L527 L529	L452-V456 WeakPolarHBondContact O-CG2 3.36Å; L452-V456 PolarHBondContact O-N 2.94Å; V456-M458 VanDerWaalsContact C-N 3.27Å; V456-M458 PolarHBondContact O-N 2.91Å; V456-N459 WeakPolarHBondContact O-CA 3.4Å; V456-N459 PolarHBondContact O-N 2.93Å; V456-I460 WeakPolarHBondContact CA-O 3.13Å; V456-V490 HydrophobicContact CG1-CG1 4.25Å; V456-L527 HydrophobicContact CG2-CB 4.19Å; V456-L527 HydrophobicContact CG2-CD1 4.24Å; V456-L529 HydrophobicContact CG1-CB 3.99Å; V456-L529 HydrophobicContact CG1-CD1 4.2Å
457	S	90.3	Very high	90.5	Very high	29 Å²	29	31.3 Å²	31.3	20%	0.203	17%	0.17	C	C	.	.	H	α-helix	trans	-65.2	-27.1	174.3	82.3	0	0	0	0	114.4	L453 N454 L455 N459	L453-S457 WeakPolarHBondContact O-CB 3.41Å; L453-S457 PolarHBondContact O-N 3.28Å; N454-S457 WeakPolarHBondContact CA-OG 3.22Å; N454-S457 PolarHBondContact O-N 3.07Å; N454-S457 PolarHBondContact O-OG 2.86Å; L455-S457 PolarHBondContact O-N 3.17Å; S457-N459 PolarHBondContact O-N 3.32Å
458	M	89.1	Confident	90.7	Very high	16 Å²	16	31.6 Å²	31.6	8%	0.079	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	12.8	172.3	-69.3	-178	-71.2	0	0	112.9	L148 A151 I152 V181 N454 L455 V456 I460	L148-M458 HydrophobicContact CD1-CE 4.5Å; A151-M458 HydrophobicContact CB-SD 4.26Å; I152-M458 HydrophobicContact CG1-CE 4.47Å; I152-M458 HydrophobicContact CG1-CG 4.24Å; I152-M458 HydrophobicContact CG1-SD 4.12Å; V181-M458 HydrophobicContact CG1-SD 4.06Å; V181-M458 HydrophobicContact CG2-CE 3.64Å; V181-M458 HydrophobicContact CG2-SD 4.08Å; N454-M458 HydrophobicContact CB-CE 4.48Å; N454-M458 WeakPolarHBondContact O-CE 3.46Å; N454-M458 WeakPolarHBondContact O-CG 3.41Å; N454-M458 PolarHBondContact O-N 3.36Å; L455-M458 HydrophobicContact CD2-CE 3.94Å; L455-M458 CarbonylContact O-C 3.53Å; L455-M458 WeakPolarHBondContact O-CA 3.17Å; L455-M458 WeakPolarHBondContact O-CB 3.28Å; L455-M458 PolarHBondContact O-N 2.89Å; V456-M458 VanDerWaalsContact C-N 3.27Å; V456-M458 PolarHBondContact O-N 2.91Å; M458-I460 VanDerWaalsContact C-N 3.3Å; M458-I460 HydrophobicContact CB-CD1 4.27Å; M458-I460 PolarHBondContact O-N 3.33Å
459	N	87.8	Confident	90.8	Very high	123 Å²	123	32.3 Å²	32.3	66%	0.658	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.1	26.7	-178.4	-163.8	54	0	0	0	114	L455 V456 S457	L455-N459 PolarHBondContact O-N 2.83Å; V456-N459 WeakPolarHBondContact O-CA 3.4Å; V456-N459 PolarHBondContact O-N 2.93Å; S457-N459 PolarHBondContact O-N 3.32Å
460	I	89.4	Confident	90.8	Very high	32 Å²	32	33.3 Å²	33.3	16%	0.164	18%	0.179	C	C	.	.			trans	-94.5	92.4	168.9	-60	156.4	0	0	0	106.7	L455 V456 M458 F466	L455-I460 CarbonylContact C-O 3.56Å; L455-I460 HydrophobicContact CB-CB 4.21Å; L455-I460 HydrophobicContact CB-CG2 4.44Å; L455-I460 HydrophobicContact CD2-CD1 3.77Å; L455-I460 WeakPolarHBondContact O-CB 3.39Å; L455-I460 PolarHBondContact O-N 3.41Å; V456-I460 WeakPolarHBondContact CA-O 3.13Å; M458-I460 VanDerWaalsContact C-N 3.3Å; M458-I460 HydrophobicContact CB-CD1 4.27Å; M458-I460 PolarHBondContact O-N 3.33Å; I460-F466 HydrophobicContact CD1-CD2 3.67Å; I460-F466 HydrophobicContact CD1-CE2 3.8Å; I460-F466 HydrophobicContact CG2-CB 4.1Å; I460-F466 HydrophobicContact CG2-CD2 4.21Å
461	K	87.6	Confident	90.8	Very high	65 Å²	65	37 Å²	37	28%	0.283	20%	0.203	S	C	.	.			trans	-79.6	-26.8	-171.4	-60	-169.3	-176.5	-175.9	0	113.9	E496 P526 L527	K461-E496 IonicContact NZ-OE2 3.54Å; K461-P526 HydrophobicContact CB-CB 3.89Å; K461-P526 HydrophobicContact CD-CB 4Å; K461-L527 VanDerWaalsContact CB-O 3.31Å; K461-L527 WeakPolarHBondContact CB-O 3.24Å; K461-L527 WeakPolarHBondContact CG-O 3.24Å; K461-L527 WeakPolarHBondContact O-CB 3.47Å; K461-L527 PolarHBondContact O-N 3Å; K461-L527 VanDerWaalsContact O-N 3.09Å
462	N	88.2	Confident	90.7	Very high	21 Å²	21	37 Å²	37	11%	0.112	20%	0.204	C	C	.	.			trans	-115.8	108.3	178	-174.7	-1.9	0	0	0	109.3	T464 E465	N462-T464 PolarHBondContact ND2-OG1 3.34Å; N462-T464 PolarHBondContact O-N 3.04Å; N462-T464 PolarHBondContact OD1-N 2.55Å; N462-T464 PolarHBondContact OD1-OG1 3.42Å; N462-E465 HydrophobicContact CB-CB 4.4Å; N462-E465 HydrophobicContact CB-CG 4.08Å; N462-E465 WeakPolarHBondContact CB-OE1 3.4Å; N462-E465 PolarHBondContact ND2-OE1 3Å; N462-E465 PolarHBondContact O-N 3.39Å; N462-E465 VanDerWaalsContact O-N 3.17Å
463	P	86.5	Confident	90.4	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-59.7	-22.8	176.2	-23.5	35.3	0	0	0	114	L452 E465 F466 W468 I477 I481 Y525	L452-P463 HydrophobicContact CD2-CB 3.68Å; L452-P463 HydrophobicContact CD2-CG 3.49Å; L452-P463 VanDerWaalsContact CD2-CG 3.49Å; P463-E465 VanDerWaalsContact C-N 3.3Å; P463-F466 WeakPolarHBondContact O-CB 3.47Å; P463-F466 PolarHBondContact O-N 2.81Å; P463-W468 HydrophobicContact CB-CZ2 4.42Å; P463-W468 PolarHBondContact O-NE1 3.23Å; P463-I477 HydrophobicContact CB-CG2 4.49Å; P463-I481 HydrophobicContact CG-CD1 4.38Å; P463-Y525 HydrophobicContact CG-CE1 4.24Å
464	T	85.3	Confident	90	Very high	92 Å²	92	45.6 Å²	45.6	56%	0.564	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-73.2	-23.9	178.3	71.2	0	0	0	0	112.5	N462 F466 Y525	N462-T464 PolarHBondContact ND2-OG1 3.34Å; N462-T464 PolarHBondContact O-N 3.04Å; N462-T464 PolarHBondContact OD1-N 2.55Å; N462-T464 PolarHBondContact OD1-OG1 3.42Å; T464-F466 VanDerWaalsContact C-N 3.33Å; T464-Y525 HydrophobicContact CG2-CE2 4.12Å
465	E	85.6	Confident	89.7	Confident	150 Å²	150	46.5 Å²	46.5	70%	0.701	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-82.8	-12.5	175.7	-69.9	167.7	-149.9	0	0	112.7	N462 P463	N462-E465 HydrophobicContact CB-CB 4.4Å; N462-E465 HydrophobicContact CB-CG 4.08Å; N462-E465 WeakPolarHBondContact CB-OE1 3.4Å; N462-E465 PolarHBondContact ND2-OE1 3Å; N462-E465 PolarHBondContact O-N 3.39Å; N462-E465 VanDerWaalsContact O-N 3.17Å; P463-E465 VanDerWaalsContact C-N 3.3Å
466	F	92.6	Very high	89.5	Confident	6 Å²	6	46.5 Å²	46.5	3%	0.026	26%	0.26	C	S	.	.	S	Bend	trans	-71	132.4	179.8	-175.3	-109.4	0	0	0	110.5	G180 V181 L455 I460 P463 T464 W468	G180-F466 VanDerWaalsContact C-CZ 3.41Å; V181-F466 HydrophobicContact CG2-CE2 4.15Å; V181-F466 HydrophobicContact CG2-CZ 4Å; L455-F466 HydrophobicContact CD1-CD1 4.18Å; L455-F466 HydrophobicContact CD1-CG 4.19Å; L455-F466 HydrophobicContact CD2-CD1 4.28Å; L455-F466 HydrophobicContact CD2-CD2 3.75Å; L455-F466 HydrophobicContact CD2-CE1 4.05Å; L455-F466 HydrophobicContact CD2-CE2 3.49Å; L455-F466 VanDerWaalsContact CD2-CE2 3.49Å; L455-F466 HydrophobicContact CD2-CG 4.11Å; L455-F466 HydrophobicContact CD2-CZ 3.62Å; I460-F466 HydrophobicContact CD1-CD2 3.67Å; I460-F466 HydrophobicContact CD1-CE2 3.8Å; I460-F466 HydrophobicContact CG2-CB 4.1Å; I460-F466 HydrophobicContact CG2-CD2 4.21Å; P463-F466 WeakPolarHBondContact O-CB 3.47Å; P463-F466 PolarHBondContact O-N 2.81Å; T464-F466 VanDerWaalsContact C-N 3.33Å; F466-W468 HydrophobicContact CB-CZ2 4.31Å; F466-W468 AromaticContact CD1-CD2 3.54Å; F466-W468 HydrophobicContact CD1-CD2 3.54Å; F466-W468 AromaticContact CD1-CE2 3.57Å; F466-W468 AromaticContact CD1-CE3 3.61Å; F466-W468 HydrophobicContact CD1-CE3 3.61Å; F466-W468 HydrophobicContact CD1-CG 4.15Å; F466-W468 AromaticContact CD1-CH2 3.86Å; F466-W468 HydrophobicContact CD1-CH2 3.86Å; F466-W468 AromaticContact CD1-CZ2 3.75Å; F466-W468 HydrophobicContact CD1-CZ2 3.75Å; F466-W468 AromaticContact CD1-CZ3 3.75Å; F466-W468 HydrophobicContact CD1-CZ3 3.75Å; F466-W468 HydrophobicContact CE1-CD2 4.15Å; F466-W468 AromaticContact CE1-CE3 3.75Å; F466-W468 HydrophobicContact CE1-CE3 3.75Å; F466-W468 HydrophobicContact CE1-CH2 4.22Å; F466-W468 AromaticContact CE1-CZ3 3.77Å; F466-W468 HydrophobicContact CE1-CZ3 3.77Å; F466-W468 HydrophobicContact CG-CZ2 4.42Å; F466-W468 PolarHBondContact O-N 3.19Å; F466-W468 PolarHBondContact O-NE1 3.43Å
467	P	93.8	Very high	89.3	Confident	29 Å²	29	47 Å²	47	19%	0.188	26%	0.262	C	S	.	.			trans	-71.3	98.9	176	28.3	-33.6	0	0	0	109.8	G180 L183 S184 F242	G180-P467 WeakPolarHBondContact CA-O 3.48Å; L183-P467 HydrophobicContact CD2-CB 4.09Å; L183-P467 HydrophobicContact CD2-CG 4.42Å; S184-P467 WeakPolarHBondContact OG-CD 3.5Å; S184-P467 WeakPolarHBondContact OG-CG 3.27Å; F242-P467 HydrophobicContact CE2-CB 3.81Å; F242-P467 VanDerWaalsContact CE2-O 3.26Å; F242-P467 WeakPolarHBondContact CE2-O 3.4Å; F242-P467 HydrophobicContact CZ-CB 4.13Å
468	W	94	Very high	89.2	Confident	28 Å²	28	49.1 Å²	49.1	11%	0.106	27%	0.269	C	S	.	.			trans	-83.6	129.1	173.1	-59.6	102.1	0	0	0	111	I443 V451 L455 P463 F466 S470 P472	I443-W468 HydrophobicContact CD1-CE3 3.44Å; I443-W468 VanDerWaalsContact CD1-CE3 3.44Å; I443-W468 HydrophobicContact CD1-CZ3 3.53Å; V451-W468 HydrophobicContact CG1-CH2 3.99Å; V451-W468 HydrophobicContact CG1-CZ3 4.19Å; L455-W468 HydrophobicContact CD1-CH2 3.49Å; L455-W468 VanDerWaalsContact CD1-CH2 3.49Å; L455-W468 HydrophobicContact CD1-CZ2 3.78Å; L455-W468 HydrophobicContact CD1-CZ3 4.43Å; P463-W468 HydrophobicContact CB-CZ2 4.42Å; P463-W468 PolarHBondContact O-NE1 3.23Å; F466-W468 HydrophobicContact CB-CZ2 4.31Å; F466-W468 AromaticContact CD1-CD2 3.54Å; F466-W468 HydrophobicContact CD1-CD2 3.54Å; F466-W468 AromaticContact CD1-CE2 3.57Å; F466-W468 AromaticContact CD1-CE3 3.61Å; F466-W468 HydrophobicContact CD1-CE3 3.61Å; F466-W468 HydrophobicContact CD1-CG 4.15Å; F466-W468 AromaticContact CD1-CH2 3.86Å; F466-W468 HydrophobicContact CD1-CH2 3.86Å; F466-W468 AromaticContact CD1-CZ2 3.75Å; F466-W468 HydrophobicContact CD1-CZ2 3.75Å; F466-W468 AromaticContact CD1-CZ3 3.75Å; F466-W468 HydrophobicContact CD1-CZ3 3.75Å; F466-W468 HydrophobicContact CE1-CD2 4.15Å; F466-W468 AromaticContact CE1-CE3 3.75Å; F466-W468 HydrophobicContact CE1-CE3 3.75Å; F466-W468 HydrophobicContact CE1-CH2 4.22Å; F466-W468 AromaticContact CE1-CZ3 3.77Å; F466-W468 HydrophobicContact CE1-CZ3 3.77Å; F466-W468 HydrophobicContact CG-CZ2 4.42Å; F466-W468 PolarHBondContact O-N 3.19Å; F466-W468 PolarHBondContact O-NE1 3.43Å; W468-S470 VanDerWaalsContact C-N 3.27Å; W468-P472 HydrophobicContact CD2-CG 3.96Å; W468-P472 HydrophobicContact CE3-CG 4Å; W468-P472 HydrophobicContact CH2-CG 4.25Å; W468-P472 HydrophobicContact CZ2-CG 4.25Å; W468-P472 HydrophobicContact CZ3-CG 4.15Å
469	L	93.3	Very high	89	Confident	15 Å²	15	50 Å²	50	8%	0.079	28%	0.279	C	S	.	.	S	Bend	trans	-64.5	-36.8	169.4	176.4	61.5	0	0	0	111.2	F179 P238 F239 F242	F179-L469 HydrophobicContact CB-CB 4.31Å; F179-L469 HydrophobicContact CD2-CD2 3.63Å; F179-L469 HydrophobicContact CE2-CD2 3.86Å; F179-L469 HydrophobicContact CG-CD2 4.01Å; F179-L469 HydrophobicContact CZ-CD2 4.4Å; P238-L469 WeakPolarHBondContact O-CD1 3.44Å; F239-L469 HydrophobicContact CD1-CD1 4.11Å; F239-L469 HydrophobicContact CD1-CD2 4.09Å; F239-L469 HydrophobicContact CE1-CD2 3.83Å; F242-L469 HydrophobicContact CB-CD1 3.56Å; F242-L469 HydrophobicContact CD1-CD1 4.14Å; F242-L469 HydrophobicContact CD2-CB 4.18Å; F242-L469 HydrophobicContact CD2-CD1 4.24Å; F242-L469 HydrophobicContact CE2-CB 4.36Å; F242-L469 HydrophobicContact CG-CB 4.37Å; F242-L469 HydrophobicContact CG-CD1 3.71Å
470	S	92.1	Very high	89.1	Confident	28 Å²	28	44.4 Å²	44.4	20%	0.196	25%	0.25	C	C	.	.	S	Bend	trans	-138.8	118.7	165.9	-65.3	0	0	0	0	108	R171 W468	R171-S470 PolarHBondContact NH2-OG 2.6Å; W468-S470 VanDerWaalsContact C-N 3.27Å
471	S	91.9	Very high	89.2	Confident	87 Å²	87	42.9 Å²	42.9	61%	0.608	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-60.5	126.4	-177	-58.6	0	0	0	0	110.2	L444	L444-S471 WeakPolarHBondContact CD2-O 3.38Å
472	P	91.2	Very high	89.2	Confident	9 Å²	9	47.2 Å²	47.2	6%	0.058	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-64	161.9	173.5	-9.1	20	0	0	0	111.4	I443 L448 W468 I477	I443-P472 HydrophobicContact CD1-CG 3.99Å; I443-P472 HydrophobicContact CG1-CB 4.44Å; I443-P472 HydrophobicContact CG1-CG 4.01Å; L448-P472 HydrophobicContact CD1-CB 3.35Å; L448-P472 HydrophobicContact CD1-CG 3.86Å; W468-P472 HydrophobicContact CD2-CG 3.96Å; W468-P472 HydrophobicContact CE3-CG 4Å; W468-P472 HydrophobicContact CH2-CG 4.25Å; W468-P472 HydrophobicContact CZ2-CG 4.25Å; W468-P472 HydrophobicContact CZ3-CG 4.15Å; P472-I477 HydrophobicContact CB-CD1 4.28Å; P472-I477 HydrophobicContact CB-CG1 4.14Å; P472-I477 HydrophobicContact CG-CD1 4.24Å; P472-I477 HydrophobicContact CG-CG1 4.38Å
473	K	88.3	Confident	89.2	Confident	89 Å²	89	47.3 Å²	47.3	39%	0.387	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-64	137.6	173.7	-60.5	-179.8	-173.7	174	0	109.8	S475 S476 I477	K473-S475 VanDerWaalsContact C-N 3.29Å; K473-S475 PolarHBondContact O-N 3.37Å; K473-S476 WeakPolarHBondContact O-CB 3.38Å; K473-S476 PolarHBondContact O-N 3.18Å; K473-I477 PolarHBondContact O-N 3.48Å
474	P	87.2	Confident	89.5	Confident	94 Å²	94	47.3 Å²	47.3	61%	0.61	26%	0.262	S	S	*	.	H	α-helix	trans	-53.8	-44.5	177.3	-27.8	35.3	0	0	0	113	S476 I477 E478	P474-S476 PolarHBondContact O-N 3.24Å; P474-I477 WeakPolarHBondContact O-CB 3.12Å; P474-I477 PolarHBondContact O-N 2.85Å; P474-E478 WeakPolarHBondContact O-CG 3.23Å; P474-E478 PolarHBondContact O-N 2.93Å
475	S	85	Confident	89.7	Confident	53 Å²	53	46.2 Å²	46.2	37%	0.371	25%	0.252	S	S	.	.	H	α-helix	trans	-57.6	-32.8	176.4	64.4	0	0	0	0	113.6	K473 A479	K473-S475 VanDerWaalsContact C-N 3.29Å; K473-S475 PolarHBondContact O-N 3.37Å; S475-A479 WeakPolarHBondContact O-CB 3.45Å; S475-A479 PolarHBondContact O-N 3.05Å
476	S	87.5	Confident	89.8	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.014	23%	0.234	C	C	.	.	H	α-helix	trans	-74.1	-35.5	176.9	-59.9	0	0	0	0	111.8	K473 P474 G480	K473-S476 WeakPolarHBondContact O-CB 3.38Å; K473-S476 PolarHBondContact O-N 3.18Å; P474-S476 PolarHBondContact O-N 3.24Å; S476-G480 PolarHBondContact O-N 3.35Å; S476-G480 VanDerWaalsContact O-N 3.08Å
477	I	89.5	Confident	89.6	Confident	19 Å²	19	42.3 Å²	42.3	10%	0.097	23%	0.234	C	C	.	.	H	α-helix	trans	-67.7	-46.3	173.9	-63.2	175.4	0	0	0	109.4	L448 L452 P463 P472 K473 P474 G480 I481	L448-I477 HydrophobicContact CD1-CG1 3.76Å; L452-I477 HydrophobicContact CD2-CG2 4.41Å; P463-I477 HydrophobicContact CB-CG2 4.49Å; P472-I477 HydrophobicContact CB-CD1 4.28Å; P472-I477 HydrophobicContact CB-CG1 4.14Å; P472-I477 HydrophobicContact CG-CD1 4.24Å; P472-I477 HydrophobicContact CG-CG1 4.38Å; K473-I477 PolarHBondContact O-N 3.48Å; P474-I477 WeakPolarHBondContact O-CB 3.12Å; P474-I477 PolarHBondContact O-N 2.85Å; I477-G480 PolarHBondContact O-N 3.24Å; I477-I481 HydrophobicContact CG2-CD1 3.76Å; I477-I481 HydrophobicContact CG2-CG1 4.41Å; I477-I481 WeakPolarHBondContact O-CG1 3.28Å; I477-I481 PolarHBondContact O-N 3.14Å
478	E	87.8	Confident	89.4	Confident	73 Å²	73	41.2 Å²	41.2	34%	0.341	23%	0.228	S	C	.	.	H	α-helix	trans	-55.2	-53.1	175.2	-73.9	166.3	-163.3	0	0	112.4	P474 G480 I481 K482 I523	P474-E478 WeakPolarHBondContact O-CG 3.23Å; P474-E478 PolarHBondContact O-N 2.93Å; E478-G480 VanDerWaalsContact C-N 3.28Å; E478-G480 PolarHBondContact O-N 3.16Å; E478-I481 PolarHBondContact O-N 2.79Å; E478-K482 WeakPolarHBondContact O-CB 3.27Å; E478-K482 PolarHBondContact O-N 3.26Å; E478-I523 HydrophobicContact CB-CD1 3.98Å; E478-I523 HydrophobicContact CG-CD1 3.43Å; E478-I523 VanDerWaalsContact CG-CD1 3.43Å; E478-I523 HydrophobicContact CG-CG1 3.71Å
479	A	85.4	Confident	89.4	Confident	35 Å²	35	39.9 Å²	39.9	29%	0.289	22%	0.223	S	C	.	.	H	α-helix	trans	-58.7	-41	176.8	0	0	0	0	0	111.9	W389 S475 L483	W389-A479 HydrophobicContact CH2-CB 4.1Å; S475-A479 WeakPolarHBondContact O-CB 3.45Å; S475-A479 PolarHBondContact O-N 3.05Å; A479-L483 WeakPolarHBondContact O-CB 3.43Å; A479-L483 PolarHBondContact O-N 3.11Å
480	G	90	Very high	89.3	Confident	5 Å²	5	39.3 Å²	39.3	5%	0.052	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-45.5	177.4	0	0	0	0	0	113.2	S476 I477 E478 L483 L484	S476-G480 PolarHBondContact O-N 3.35Å; S476-G480 VanDerWaalsContact O-N 3.08Å; I477-G480 PolarHBondContact O-N 3.24Å; E478-G480 VanDerWaalsContact C-N 3.28Å; E478-G480 PolarHBondContact O-N 3.16Å; G480-L483 PolarHBondContact O-N 2.86Å; G480-L484 WeakPolarHBondContact O-CG 3.22Å; G480-L484 PolarHBondContact O-N 2.92Å; G480-L484 VanDerWaalsContact O-N 3.07Å
481	I	90.9	Very high	89.2	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-67.8	-44.1	178.2	-67	170.6	0	0	0	110.7	L452 P463 I477 E478 L483 L484 L485 I523 Y525 L527	L452-I481 HydrophobicContact CD1-CG1 3.9Å; P463-I481 HydrophobicContact CG-CD1 4.38Å; I477-I481 HydrophobicContact CG2-CD1 3.76Å; I477-I481 HydrophobicContact CG2-CG1 4.41Å; I477-I481 WeakPolarHBondContact O-CG1 3.28Å; I477-I481 PolarHBondContact O-N 3.14Å; E478-I481 PolarHBondContact O-N 2.79Å; I481-L483 VanDerWaalsContact C-N 3.27Å; I481-L483 PolarHBondContact O-N 2.81Å; I481-L484 PolarHBondContact O-N 3.27Å; I481-L485 HydrophobicContact CG2-CD1 3.91Å; I481-L485 HydrophobicContact CG2-CG 4.26Å; I481-L485 WeakPolarHBondContact O-CG 3.37Å; I481-L485 PolarHBondContact O-N 2.98Å; I481-I523 HydrophobicContact CB-CD1 4.28Å; I481-I523 HydrophobicContact CD1-CD1 3.58Å; I481-I523 HydrophobicContact CD1-CG2 4.16Å; I481-I523 HydrophobicContact CG1-CD1 4.42Å; I481-I523 HydrophobicContact CG2-CG2 3.9Å; I481-Y525 HydrophobicContact CD1-CE1 3.96Å; I481-L527 HydrophobicContact CD1-CD1 3.96Å; I481-L527 HydrophobicContact CG1-CD1 4.04Å; I481-L527 HydrophobicContact CG2-CD1 4.33Å; I481-L527 HydrophobicContact CG2-CD2 4.2Å
482	K	87.7	Confident	88.9	Confident	156 Å²	156	37.9 Å²	37.9	68%	0.678	21%	0.206	S	C	*	.	H	α-helix	trans	-55	-44.1	176	-175.2	175.8	-178.7	175.4	0	111.5	E478 L485 Q486	E478-K482 WeakPolarHBondContact O-CB 3.27Å; E478-K482 PolarHBondContact O-N 3.26Å; K482-L485 PolarHBondContact O-N 3.1Å; K482-Q486 WeakPolarHBondContact O-CB 3.17Å; K482-Q486 PolarHBondContact O-N 3.44Å
483	L	88.4	Confident	88.1	Confident	23 Å²	23	39.5 Å²	39.5	12%	0.12	21%	0.214	C	C	.	.	H	α-helix	trans	-64.1	-43.9	174.9	179.6	57.9	0	0	0	112	A479 G480 I481 L485 Q486 L487 R544	A479-L483 WeakPolarHBondContact O-CB 3.43Å; A479-L483 PolarHBondContact O-N 3.11Å; G480-L483 PolarHBondContact O-N 2.86Å; I481-L483 VanDerWaalsContact C-N 3.27Å; I481-L483 PolarHBondContact O-N 2.81Å; L483-L485 VanDerWaalsContact C-N 3.34Å; L483-L485 PolarHBondContact O-N 2.86Å; L483-Q486 PolarHBondContact O-N 2.92Å; L483-L487 HydrophobicContact CD1-CD1 4.05Å; L483-L487 HydrophobicContact CD1-CG 4.03Å; L483-L487 HydrophobicContact CG-CD1 3.96Å; L483-L487 HydrophobicContact CG-CG 4.37Å; L483-L487 WeakPolarHBondContact O-CB 3.43Å; L483-L487 WeakPolarHBondContact O-CG 3.25Å; L483-L487 PolarHBondContact O-N 3Å; L483-R544 HydrophobicContact CD1-CG 4.46Å; L483-R544 HydrophobicContact CD2-CG 4.35Å
484	L	91.8	Very high	86.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64.5	-36.5	178.9	-69	178.2	0	0	0	113.1	L452 L453 G480 I481 L487 G488 A489 V490 P543	L452-L484 HydrophobicContact CB-CD1 3.7Å; L453-L484 HydrophobicContact CB-CD1 4.26Å; L453-L484 HydrophobicContact CB-CD2 3.98Å; L453-L484 HydrophobicContact CD1-CD2 4.49Å; G480-L484 WeakPolarHBondContact O-CG 3.22Å; G480-L484 PolarHBondContact O-N 2.92Å; G480-L484 VanDerWaalsContact O-N 3.07Å; I481-L484 PolarHBondContact O-N 3.27Å; L484-L487 PolarHBondContact O-N 3.24Å; L484-G488 PolarHBondContact O-N 3.29Å; L484-A489 HydrophobicContact CB-CB 4.43Å; L484-A489 HydrophobicContact CD2-CB 4.09Å; L484-A489 PolarHBondContact O-N 2.85Å; L484-V490 HydrophobicContact CB-CG1 4.39Å; L484-V490 HydrophobicContact CB-CG2 3.68Å; L484-V490 HydrophobicContact CD1-CG1 4.37Å; L484-P543 HydrophobicContact CD2-CB 3.95Å; L484-P543 HydrophobicContact CD2-CG 3.93Å
485	L	90.5	Very high	85.3	Confident	68 Å²	68	44.6 Å²	44.6	36%	0.356	24%	0.241	S	C	.	.	H	α-helix	trans	-64.4	-47.3	172.3	-71.4	167.8	0	0	0	110.8	I481 K482 L483 L487 G488 V490 V492	I481-L485 HydrophobicContact CG2-CD1 3.91Å; I481-L485 HydrophobicContact CG2-CG 4.26Å; I481-L485 WeakPolarHBondContact O-CG 3.37Å; I481-L485 PolarHBondContact O-N 2.98Å; K482-L485 PolarHBondContact O-N 3.1Å; L483-L485 VanDerWaalsContact C-N 3.34Å; L483-L485 PolarHBondContact O-N 2.86Å; L485-L487 VanDerWaalsContact C-N 3.25Å; L485-L487 PolarHBondContact O-N 3.06Å; L485-G488 PolarHBondContact O-N 3.44Å; L485-V490 HydrophobicContact CD2-CG2 3.97Å; L485-V490 HydrophobicContact CG-CG2 4.13Å; L485-V492 HydrophobicContact CD2-CG2 4.14Å
486	Q	86.1	Confident	83.7	Confident	69 Å²	69	46.5 Å²	46.5	32%	0.322	24%	0.244	S	C	.	.	H	α-helix	trans	-60.3	-34.7	176.8	-175	-176.7	-6.6	0	0	112.5	K482 L483 G488	K482-Q486 WeakPolarHBondContact O-CB 3.17Å; K482-Q486 PolarHBondContact O-N 3.44Å; L483-Q486 PolarHBondContact O-N 2.92Å; Q486-G488 PolarHBondContact O-N 3.26Å
487	L	89.8	Confident	81.8	Confident	5 Å²	5	48.8 Å²	48.8	3%	0.026	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-7.8	176.1	-67.2	173.9	0	0	0	113.4	L483 L484 L485 A489 L532 M536 P543 R544 R547 S703	L483-L487 HydrophobicContact CD1-CD1 4.05Å; L483-L487 HydrophobicContact CD1-CG 4.03Å; L483-L487 HydrophobicContact CG-CD1 3.96Å; L483-L487 HydrophobicContact CG-CG 4.37Å; L483-L487 WeakPolarHBondContact O-CB 3.43Å; L483-L487 WeakPolarHBondContact O-CG 3.25Å; L483-L487 PolarHBondContact O-N 3Å; L484-L487 PolarHBondContact O-N 3.24Å; L485-L487 VanDerWaalsContact C-N 3.25Å; L485-L487 PolarHBondContact O-N 3.06Å; L487-A489 HydrophobicContact CB-CB 4.46Å; L487-A489 PolarHBondContact O-N 3.21Å; L487-L532 VanDerWaalsContact O-CD2 3.31Å; L487-L532 WeakPolarHBondContact O-CD2 3.3Å; L487-M536 HydrophobicContact CB-CE 4.17Å; L487-M536 HydrophobicContact CD1-CE 4.07Å; L487-P543 HydrophobicContact CD1-CB 3.58Å; L487-R544 HydrophobicContact CD1-CG 4.36Å; L487-R547 HydrophobicContact CD2-CB 4.08Å; L487-R547 HydrophobicContact CD2-CG 4.03Å; L487-S703 WeakPolarHBondContact CD2-O 3.47Å
488	G	89.7	Confident	79.5	Confident	7 Å²	7	56.1 Å²	56.1	7%	0.072	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.6	18.7	-173.1	0	0	0	0	0	113.7	L484 L485 Q486 T530	L484-G488 PolarHBondContact O-N 3.29Å; L485-G488 PolarHBondContact O-N 3.44Å; Q486-G488 PolarHBondContact O-N 3.26Å; G488-T530 WeakPolarHBondContact O-CG2 3.42Å; G488-T530 PolarHBondContact O-OG1 3.3Å
489	A	92.5	Very high	76.9	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.315	C	S	.	.	S	Bend	trans	-79.6	-29.9	-175.8	0	0	0	0	0	112.7	L453 L484 L487 T530 G533 M536	L453-A489 HydrophobicContact CD1-CB 4.15Å; L484-A489 HydrophobicContact CB-CB 4.43Å; L484-A489 HydrophobicContact CD2-CB 4.09Å; L484-A489 PolarHBondContact O-N 2.85Å; L487-A489 HydrophobicContact CB-CB 4.46Å; L487-A489 PolarHBondContact O-N 3.21Å; A489-T530 PolarHBondContact O-N 3.13Å; A489-T530 VanDerWaalsContact O-N 3.15Å; A489-T530 PolarHBondContact O-OG1 3.02Å; A489-G533 VanDerWaalsContact O-CA 3.27Å; A489-G533 WeakPolarHBondContact O-CA 3.34Å; A489-M536 HydrophobicContact CB-CE 3.76Å; A489-M536 HydrophobicContact CB-SD 3.78Å
490	V	92.4	Very high	74.7	Confident	2 Å²	2	64.1 Å²	64.1	1%	0.012	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	159	178.1	-58.9	0	0	0	0	109.9	V456 L484 L485 L527 S528	V456-V490 HydrophobicContact CG1-CG1 4.25Å; L484-V490 HydrophobicContact CB-CG1 4.39Å; L484-V490 HydrophobicContact CB-CG2 3.68Å; L484-V490 HydrophobicContact CD1-CG1 4.37Å; L485-V490 HydrophobicContact CD2-CG2 3.97Å; L485-V490 HydrophobicContact CG-CG2 4.13Å; V490-L527 HydrophobicContact CG2-CD2 4.38Å; V490-S528 CarbonylContact C-O 3.56Å; V490-S528 VanDerWaalsContact CA-O 3.23Å; V490-S528 WeakPolarHBondContact CA-O 3.43Å
491	V	90.5	Very high	72.1	Confident	51 Å²	51	68.3 Å²	68.3	31%	0.309	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	154.6	168.8	-69.9	0	0	0	0	109.1	S528 T530	V491-S528 PolarHBondContact N-O 3.5Å; V491-S528 PolarHBondContact O-N 3.15Å; V491-T530 HydrophobicContact CB-CG2 4.46Å; V491-T530 HydrophobicContact CG1-CG2 3.67Å; V491-T530 HydrophobicContact CG2-CG2 4.3Å
492	V	85.7	Confident	69.4	Low	34 Å²	34	72.9 Å²	72.9	21%	0.206	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	129.1	168.9	-179.5	0	0	0	0	106.8	L485 P524 L527	L485-V492 HydrophobicContact CD2-CG2 4.14Å; V492-P524 HydrophobicContact CB-CG 4.3Å; V492-P524 HydrophobicContact CG1-CB 3.61Å; V492-P524 HydrophobicContact CG1-CG 3.56Å; V492-P524 HydrophobicContact CG2-CG 3.87Å; V492-L527 HydrophobicContact CG2-CD2 4.17Å
493	N	73.3	Confident	67	Low	43 Å²	43	74 Å²	74	23%	0.23	41%	0.408	C	S	.	.			trans	-89.8	105.2	172.2	-76	10.3	0	0	0	109	D495 P526 S528	N493-D495 PolarHBondContact O-N 3.11Å; N493-P526 HydrophobicContact CB-CG 4.37Å; N493-P526 PolarHBondContact N-O 3.02Å; N493-P526 VanDerWaalsContact N-O 3.14Å; N493-S528 PolarHBondContact ND2-OG 3.2Å; N493-S528 WeakPolarHBondContact OD1-CB 3.19Å; N493-S528 PolarHBondContact OD1-OG 2.73Å
494	D	62	Low	64.2	Low	125 Å²	125	78.3 Å²	78.3	67%	0.668	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-69.5	-25.7	175.6	-60.6	-31.5	0	0	0	111.7	E496 A497	D494-E496 VanDerWaalsContact C-N 3.31Å; D494-E496 PolarHBondContact O-N 3.48Å; D494-A497 PolarHBondContact O-N 2.77Å
495	D	55.5	Low	61.3	Low	165 Å²	165	81.8 Å²	81.8	88%	0.882	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-73	-11.3	-176.5	-57	-37.4	0	0	0	115.4	N493	N493-D495 PolarHBondContact O-N 3.11Å
496	E	51.7	Low	58.5	Low	93 Å²	93	86.1 Å²	86.1	44%	0.435	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-117.1	9.7	176.4	-72.9	-154.1	137.9	0	0	112.9	K207 K461 D494 P526	K207-E496 IonicContact NZ-OE1 2.76Å; K207-E496 PolarHBondContact NZ-OE1 3.44Å; K207-E496 IonicContact NZ-OE2 3.99Å; K461-E496 IonicContact NZ-OE2 3.54Å; D494-E496 VanDerWaalsContact C-N 3.31Å; D494-E496 PolarHBondContact O-N 3.48Å; E496-P526 HydrophobicContact CB-CG 3.84Å
497	A	46.1	Very low	55.9	Low	50 Å²	50	90.8 Å²	90.8	41%	0.413	51%	0.507	S	S	.	.			trans	-80.5	118.2	173.3	0	0	0	0	0	109.8	D494	D494-A497 PolarHBondContact O-N 2.77Å
498	E	41.7	Very low	53.2	Low	173 Å²	173	94.5 Å²	94.5	81%	0.808	54%	0.538	S	S	*	.			trans	-51.7	131.6	165.6	-84.4	-82	160.1	0	0	108.9	L500	E498-L500 PolarHBondContact O-N 2.77Å
499	P	33.9	Very low	50.5	Low	111 Å²	111	101.1 Å²	101.1	72%	0.721	57%	0.571	S	S	*	*			trans	-61	115.1	179.8	25.5	-31.6	0	0	0	108	S501	P499-S501 PolarHBondContact O-N 2.96Å
500	L	39	Very low	47.6	Very low	166 Å²	166	107.1 Å²	107.1	87%	0.869	61%	0.607	S	S	*	*			trans	-51.2	117	166.4	-82.3	161	0	0	0	106.9	E498 S502	E498-L500 PolarHBondContact O-N 2.77Å; L500-S502 PolarHBondContact O-N 3.25Å
501	S	34.9	Very low	44.7	Very low	92 Å²	92	111.7 Å²	111.7	64%	0.643	64%	0.639	S	S	*	*			trans	-43.2	131.1	178	56.6	0	0	0	0	110	P499 K503	P499-S501 PolarHBondContact O-N 2.96Å; S501-K503 PolarHBondContact O-N 2.93Å
502	S	34.2	Very low	41.9	Very low	98 Å²	98	116 Å²	116	69%	0.685	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	26.6	-173.8	47.4	0	0	0	0	116.6	L500	L500-S502 PolarHBondContact O-N 3.25Å
503	K	36.5	Very low	39.4	Very low	180 Å²	180	121.4 Å²	121.4	78%	0.783	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	-13.2	178.1	-75.8	-171.6	173.5	-175.5	0	115.2	S501	S501-K503 PolarHBondContact O-N 2.93Å
504	C	30.5	Very low	37.3	Very low	112 Å²	112	124.1 Å²	124.1	76%	0.757	72%	0.716	S	S	*	*	S	Bend	trans	-110.5	0.6	-179.3	-66.9	0	0	0	0	114.9
505	A	30.7	Very low	35.9	Very low	73 Å²	73	125.6 Å²	125.6	60%	0.603	72%	0.724	S	S	*	*	S	Bend	trans	-96	-5.9	-176.3	0	0	0	0	0	114.2
506	Q	32.4	Very low	34.7	Very low	160 Å²	160	126.9 Å²	126.9	75%	0.748	73%	0.725	S	S	*	*	S	Bend	trans	-103.4	-3.1	-174.9	-82.5	160.5	-29.8	0	0	114.5
507	E	32	Very low	33.8	Very low	167 Å²	167	130.7 Å²	130.7	78%	0.78	75%	0.747	S	S	*	*	S	Bend	trans	-103.3	0.6	179.6	-71.1	177.9	166.6	0	0	114
508	A	31.5	Very low	33.3	Very low	82 Å²	82	136.3 Å²	136.3	68%	0.678	77%	0.77	S	S	*	*	S	Bend	trans	-105.9	8.1	-172.5	0	0	0	0	0	115.2
509	I	34.1	Very low	33.2	Very low	147 Å²	147	135.4 Å²	135.4	75%	0.754	77%	0.771	S	S	*	*	S	Bend	trans	-111.4	-0.1	-172.9	-64.1	171	0	0	0	112.7
510	T	32	Very low	33.6	Very low	125 Å²	125	134.2 Å²	134.2	77%	0.767	77%	0.765	S	S	*	*	S	Bend	trans	-139.2	68.3	-179.2	54.8	0	0	0	0	112.3
511	S	31.6	Very low	34.1	Very low	98 Å²	98	132.2 Å²	132.2	69%	0.685	76%	0.76	S	S	*	*			trans	-151.9	87.1	159.8	51.4	0	0	0	0	110.2	D513	S511-D513 PolarHBondContact O-N 2.81Å
512	T	30.4	Very low	35.5	Very low	142 Å²	142	136.6 Å²	136.6	87%	0.871	77%	0.767	S	S	*	*			trans	-71.5	77	158.7	43.3	0	0	0	0	108.4
513	D	32.8	Very low	36.8	Very low	148 Å²	148	133.6 Å²	133.6	79%	0.791	74%	0.743	S	S	*	*			trans	-141.5	109.7	163.3	-88.7	-38.3	0	0	0	109.7	S511 N515	S511-D513 PolarHBondContact O-N 2.81Å; D513-N515 PolarHBondContact O-N 3.45Å
514	S	30.7	Very low	38.2	Very low	100 Å²	100	128.2 Å²	128.2	70%	0.699	73%	0.726	S	S	*	*			trans	-59.8	119.5	168.5	45.3	0	0	0	0	110.5
515	N	31.3	Very low	40.1	Very low	155 Å²	155	125.5 Å²	125.5	83%	0.829	70%	0.701	S	S	*	*			trans	145.4	23.8	146.1	-70.8	-28.4	0	0	0	117.3	D513	D513-N515 PolarHBondContact O-N 3.45Å
516	E	31.5	Very low	42.6	Very low	193 Å²	193	123 Å²	123	90%	0.902	68%	0.678	S	S	*	*			trans	-135	93.3	167.1	-70.5	-168.1	159.4	0	0	112.2
517	L	33	Very low	45.3	Very low	172 Å²	172	115.4 Å²	115.4	90%	0.901	64%	0.643	S	S	*	*			trans	-110.1	79.5	175.6	-82.1	151.6	0	0	0	109.5
518	N	34.2	Very low	48.1	Very low	168 Å²	168	108.5 Å²	108.5	90%	0.898	61%	0.613	S	S	*	*			trans	-140.6	27.4	170.2	-91.8	-27.4	0	0	0	113	S520	N518-S520 PolarHBondContact O-N 3.29Å
519	D	39	Very low	50.9	Low	155 Å²	155	106.3 Å²	106.3	83%	0.829	59%	0.59	S	S	*	*			trans	-83	117.1	176.9	-99	-21.1	0	0	0	112.3	V521	D519-V521 PolarHBondContact O-N 3.49Å
520	S	44.1	Very low	53.7	Low	86 Å²	86	100.4 Å²	100.4	60%	0.601	56%	0.561	S	S	*	*			trans	-59.4	97.8	171.9	49.7	0	0	0	0	110.7	N518 K522	N518-S520 PolarHBondContact O-N 3.29Å; S520-K522 PolarHBondContact O-N 3.15Å
521	V	49	Very low	56.5	Low	124 Å²	124	97.8 Å²	97.8	75%	0.752	54%	0.544	S	S	*	.			trans	-60.4	103.1	169.4	179.2	0	0	0	0	108.1	D519 I523	D519-V521 PolarHBondContact O-N 3.49Å; V521-I523 PolarHBondContact O-N 3.47Å
522	K	63.1	Low	59.4	Low	183 Å²	183	94.1 Å²	94.1	80%	0.796	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-59.5	121.7	173.7	-74.7	-179	179.7	172.9	0	108.7	S520	S520-K522 PolarHBondContact O-N 3.15Å
523	I	62.4	Low	62.3	Low	35 Å²	35	87.3 Å²	87.3	18%	0.179	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-70.3	130.3	179.4	-45	172.2	0	0	0	109.2	E478 I481 V521	E478-I523 HydrophobicContact CB-CD1 3.98Å; E478-I523 HydrophobicContact CG-CD1 3.43Å; E478-I523 VanDerWaalsContact CG-CD1 3.43Å; E478-I523 HydrophobicContact CG-CG1 3.71Å; I481-I523 HydrophobicContact CB-CD1 4.28Å; I481-I523 HydrophobicContact CD1-CD1 3.58Å; I481-I523 HydrophobicContact CD1-CG2 4.16Å; I481-I523 HydrophobicContact CG1-CD1 4.42Å; I481-I523 HydrophobicContact CG2-CG2 3.9Å; V521-I523 PolarHBondContact O-N 3.47Å
524	P	66.2	Low	65.2	Low	67 Å²	67	87.4 Å²	87.4	44%	0.435	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-73.8	143	175.3	30.4	-35.2	0	0	0	111.9	V492	V492-P524 HydrophobicContact CB-CG 4.3Å; V492-P524 HydrophobicContact CG1-CB 3.61Å; V492-P524 HydrophobicContact CG1-CG 3.56Å; V492-P524 HydrophobicContact CG2-CG 3.87Å
525	Y	70.6	Confident	68.1	Low	55 Å²	55	84.3 Å²	84.3	22%	0.216	44%	0.44	C	S	.	.	S	Bend	trans	-126.2	158.1	174.8	-63.9	-67.1	0	0	0	108.3	P463 T464 I481 L527	P463-Y525 HydrophobicContact CG-CE1 4.24Å; T464-Y525 HydrophobicContact CG2-CE2 4.12Å; I481-Y525 HydrophobicContact CD1-CE1 3.96Å; Y525-L527 HydrophobicContact CD1-CG 4.24Å; Y525-L527 HydrophobicContact CE1-CD1 4.45Å
526	P	83	Confident	71	Confident	21 Å²	21	77 Å²	77	14%	0.136	40%	0.401	C	S	.	.			cis	-85.5	149.5	4.1	32	-33.1	0	0	0	114.5	K461 N493 E496	K461-P526 HydrophobicContact CB-CB 3.89Å; K461-P526 HydrophobicContact CD-CB 4Å; N493-P526 HydrophobicContact CB-CG 4.37Å; N493-P526 PolarHBondContact N-O 3.02Å; N493-P526 VanDerWaalsContact N-O 3.14Å; E496-P526 HydrophobicContact CB-CG 3.84Å
527	L	88.4	Confident	73.9	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	141.3	172.8	-61.5	173.2	0	0	0	111.5	V456 K461 I481 V490 V492 Y525	V456-L527 HydrophobicContact CG2-CB 4.19Å; V456-L527 HydrophobicContact CG2-CD1 4.24Å; K461-L527 VanDerWaalsContact CB-O 3.31Å; K461-L527 WeakPolarHBondContact CB-O 3.24Å; K461-L527 WeakPolarHBondContact CG-O 3.24Å; K461-L527 WeakPolarHBondContact O-CB 3.47Å; K461-L527 PolarHBondContact O-N 3Å; K461-L527 VanDerWaalsContact O-N 3.09Å; I481-L527 HydrophobicContact CD1-CD1 3.96Å; I481-L527 HydrophobicContact CG1-CD1 4.04Å; I481-L527 HydrophobicContact CG2-CD1 4.33Å; I481-L527 HydrophobicContact CG2-CD2 4.2Å; V490-L527 HydrophobicContact CG2-CD2 4.38Å; V492-L527 HydrophobicContact CG2-CD2 4.17Å; Y525-L527 HydrophobicContact CD1-CG 4.24Å; Y525-L527 HydrophobicContact CE1-CD1 4.45Å
528	S	90.6	Very high	76.7	Confident	23 Å²	23	60.6 Å²	60.6	16%	0.161	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	140.7	172.8	-75.1	0	0	0	0	112	V490 V491 N493	V490-S528 CarbonylContact C-O 3.56Å; V490-S528 VanDerWaalsContact CA-O 3.23Å; V490-S528 WeakPolarHBondContact CA-O 3.43Å; V491-S528 PolarHBondContact N-O 3.5Å; V491-S528 PolarHBondContact O-N 3.15Å; N493-S528 PolarHBondContact ND2-OG 3.2Å; N493-S528 WeakPolarHBondContact OD1-CB 3.19Å; N493-S528 PolarHBondContact OD1-OG 2.73Å
529	L	91.2	Very high	79.4	Confident	35 Å²	35	52.8 Å²	52.8	18%	0.183	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	126.6	177.3	-162.9	70.2	0	0	0	110.6	L453 V456 R534	L453-L529 HydrophobicContact CD1-CD1 3.65Å; V456-L529 HydrophobicContact CG1-CB 3.99Å; V456-L529 HydrophobicContact CG1-CD1 4.2Å; L529-R534 HydrophobicContact CD2-CB 3.77Å; L529-R534 HydrophobicContact CD2-CG 4.26Å; L529-R534 HydrophobicContact CG-CB 4.37Å
530	T	93.2	Very high	81.8	Confident	23 Å²	23	47.5 Å²	47.5	14%	0.141	26%	0.255	C	S	.	.			trans	-76	169.4	172.6	68.1	0	0	0	0	111.2	G488 A489 V491 L532 G533 R534	G488-T530 WeakPolarHBondContact O-CG2 3.42Å; G488-T530 PolarHBondContact O-OG1 3.3Å; A489-T530 PolarHBondContact O-N 3.13Å; A489-T530 VanDerWaalsContact O-N 3.15Å; A489-T530 PolarHBondContact O-OG1 3.02Å; V491-T530 HydrophobicContact CB-CG2 4.46Å; V491-T530 HydrophobicContact CG1-CG2 3.67Å; V491-T530 HydrophobicContact CG2-CG2 4.3Å; T530-L532 PolarHBondContact O-N 3.14Å; T530-L532 PolarHBondContact OG1-N 3.44Å; T530-G533 PolarHBondContact O-N 3.16Å; T530-G533 PolarHBondContact OG1-N 3.26Å; T530-R534 PolarHBondContact O-N 2.93Å
531	V	90.9	Very high	84	Confident	70 Å²	70	44.9 Å²	44.9	42%	0.424	23%	0.234	S	C	.	.	H	α-helix	trans	-58.2	-43.2	170.6	178.2	0	0	0	0	110.3	R534 L535	V531-R534 WeakPolarHBondContact O-CB 3.32Å; V531-R534 PolarHBondContact O-N 2.86Å; V531-L535 PolarHBondContact O-N 3.42Å; V531-L535 VanDerWaalsContact O-N 3.12Å
532	L	91.1	Very high	85.9	Confident	21 Å²	21	43 Å²	43	11%	0.11	22%	0.217	C	C	.	.	H	α-helix	trans	-60	-47.8	174.7	174.4	62.3	0	0	0	111.5	L487 T530 R534 L535 M536 R547 I550	L487-L532 VanDerWaalsContact O-CD2 3.31Å; L487-L532 WeakPolarHBondContact O-CD2 3.3Å; T530-L532 PolarHBondContact O-N 3.14Å; T530-L532 PolarHBondContact OG1-N 3.44Å; L532-R534 VanDerWaalsContact C-N 3.26Å; L532-R534 PolarHBondContact O-N 2.81Å; L532-L535 WeakPolarHBondContact O-CB 3.31Å; L532-L535 PolarHBondContact O-N 2.83Å; L532-L535 VanDerWaalsContact O-N 3.09Å; L532-M536 HydrophobicContact CD1-CG 4.3Å; L532-M536 HydrophobicContact CD1-SD 4.17Å; L532-M536 HydrophobicContact CD2-SD 4.44Å; L532-M536 HydrophobicContact CG-CG 4.46Å; L532-M536 HydrophobicContact CG-SD 3.84Å; L532-M536 VanDerWaalsContact O-CG 3.3Å; L532-M536 WeakPolarHBondContact O-CG 3.31Å; L532-M536 PolarHBondContact O-N 2.97Å; L532-R547 VanDerWaalsContact CD1-NH1 3.26Å; L532-I550 HydrophobicContact CD1-CB 4.28Å; L532-I550 HydrophobicContact CD1-CD1 3.61Å; L532-I550 HydrophobicContact CD1-CG2 3.75Å
533	G	93	Very high	87.4	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.5	-37	176.3	0	0	0	0	0	113.2	A489 T530 M536 S537	A489-G533 VanDerWaalsContact O-CA 3.27Å; A489-G533 WeakPolarHBondContact O-CA 3.34Å; T530-G533 PolarHBondContact O-N 3.16Å; T530-G533 PolarHBondContact OG1-N 3.26Å; G533-M536 PolarHBondContact O-N 2.93Å; G533-S537 WeakPolarHBondContact O-CB 3.45Å; G533-S537 PolarHBondContact O-N 3.31Å; G533-S537 PolarHBondContact O-OG 2.98Å
534	R	91.8	Very high	88.9	Confident	150 Å²	150	34.1 Å²	34.1	57%	0.566	18%	0.177	S	C	*	.	H	α-helix	trans	-66.4	-37.4	174.9	-170.5	177.7	-64.8	158.6	4.1	112.8	L529 T530 V531 L532 S537 A538	L529-R534 HydrophobicContact CD2-CB 3.77Å; L529-R534 HydrophobicContact CD2-CG 4.26Å; L529-R534 HydrophobicContact CG-CB 4.37Å; T530-R534 PolarHBondContact O-N 2.93Å; V531-R534 WeakPolarHBondContact O-CB 3.32Å; V531-R534 PolarHBondContact O-N 2.86Å; L532-R534 VanDerWaalsContact C-N 3.26Å; L532-R534 PolarHBondContact O-N 2.81Å; R534-S537 PolarHBondContact O-OG 2.97Å; R534-S537 VanDerWaalsContact O-OG 3.11Å; R534-A538 PolarHBondContact O-N 3.49Å
535	L	92.1	Very high	90.2	Very high	35 Å²	35	33.1 Å²	33.1	18%	0.183	17%	0.165	C	C	.	.	H	α-helix	trans	-68.8	-40.5	172.4	-65.2	173.2	0	0	0	110.8	V531 L532 A538 F539 I550 I680	V531-L535 PolarHBondContact O-N 3.42Å; V531-L535 VanDerWaalsContact O-N 3.12Å; L532-L535 WeakPolarHBondContact O-CB 3.31Å; L532-L535 PolarHBondContact O-N 2.83Å; L532-L535 VanDerWaalsContact O-N 3.09Å; L535-A538 VanDerWaalsContact O-CB 3.31Å; L535-A538 WeakPolarHBondContact O-CB 3.32Å; L535-A538 PolarHBondContact O-N 2.91Å; L535-F539 WeakPolarHBondContact O-CD2 3.27Å; L535-I550 HydrophobicContact CB-CD1 3.65Å; L535-I680 HydrophobicContact CD2-CB 4.03Å; L535-I680 HydrophobicContact CD2-CD1 4.09Å; L535-I680 HydrophobicContact CD2-CG1 4.34Å
536	M	93.7	Very high	91.4	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.8	-43.5	178.5	-69.4	169.5	58.8	0	0	112.2	L453 L487 A489 L532 G533 A538 F539 P543 S546 R547 I550	L453-M536 HydrophobicContact CD2-CB 4Å; L453-M536 HydrophobicContact CD2-CE 4.48Å; L487-M536 HydrophobicContact CB-CE 4.17Å; L487-M536 HydrophobicContact CD1-CE 4.07Å; A489-M536 HydrophobicContact CB-CE 3.76Å; A489-M536 HydrophobicContact CB-SD 3.78Å; L532-M536 HydrophobicContact CD1-CG 4.3Å; L532-M536 HydrophobicContact CD1-SD 4.17Å; L532-M536 HydrophobicContact CD2-SD 4.44Å; L532-M536 HydrophobicContact CG-CG 4.46Å; L532-M536 HydrophobicContact CG-SD 3.84Å; L532-M536 VanDerWaalsContact O-CG 3.3Å; L532-M536 WeakPolarHBondContact O-CG 3.31Å; L532-M536 PolarHBondContact O-N 2.97Å; G533-M536 PolarHBondContact O-N 2.93Å; M536-A538 PolarHBondContact O-N 2.75Å; M536-F539 PolarHBondContact O-N 2.79Å; M536-F539 VanDerWaalsContact O-N 3.11Å; M536-P543 HydrophobicContact CE-CB 3.92Å; M536-P543 VanDerWaalsContact CE-O 3.3Å; M536-P543 WeakPolarHBondContact CE-O 3.13Å; M536-S546 PolarHBondContact O-OG 3.05Å; M536-R547 HydrophobicContact CE-CB 4.03Å; M536-R547 HydrophobicContact SD-CB 4.23Å; M536-I550 HydrophobicContact CG-CD1 3.58Å
537	S	92.2	Very high	91.9	Very high	10 Å²	10	31.1 Å²	31.1	7%	0.07	16%	0.155	C	C	.	.	H	α-helix	trans	-67	-16.4	178.4	72	0	0	0	0	113.1	R149 G533 R534 F539	R149-S537 PolarHBondContact NH1-O 3.2Å; G533-S537 WeakPolarHBondContact O-CB 3.45Å; G533-S537 PolarHBondContact O-N 3.31Å; G533-S537 PolarHBondContact O-OG 2.98Å; R534-S537 PolarHBondContact O-OG 2.97Å; R534-S537 VanDerWaalsContact O-OG 3.11Å; S537-F539 VanDerWaalsContact C-N 3.29Å; S537-F539 PolarHBondContact O-N 3.25Å
538	A	90.4	Very high	92.3	Very high	12 Å²	12	31.1 Å²	31.1	10%	0.099	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-22.4	173.5	0	0	0	0	0	112.7	R149 R534 L535 M536 I676 I680	R149-A538 PolarHBondContact NH2-O 3.44Å; R534-A538 PolarHBondContact O-N 3.49Å; L535-A538 VanDerWaalsContact O-CB 3.31Å; L535-A538 WeakPolarHBondContact O-CB 3.32Å; L535-A538 PolarHBondContact O-N 2.91Å; M536-A538 PolarHBondContact O-N 2.75Å; A538-I676 HydrophobicContact CB-CG2 4.48Å; A538-I676 WeakPolarHBondContact O-CG2 3.37Å; A538-I680 HydrophobicContact CB-CG2 3.71Å
539	F	91.3	Very high	92.5	Very high	4 Å²	4	30 Å²	30	2%	0.018	15%	0.147	C	C	.	.	S	Bend	trans	-91.1	135.7	177.6	-65.7	-76.5	0	0	0	111.7	L535 M536 S537 L541 L549 I550 L673 I676 A677 I680 L682	L535-F539 WeakPolarHBondContact O-CD2 3.27Å; M536-F539 PolarHBondContact O-N 2.79Å; M536-F539 VanDerWaalsContact O-N 3.11Å; S537-F539 VanDerWaalsContact C-N 3.29Å; S537-F539 PolarHBondContact O-N 3.25Å; F539-L541 HydrophobicContact CB-CB 4.38Å; F539-L541 HydrophobicContact CB-CD1 4.19Å; F539-L541 HydrophobicContact CB-CG 4.27Å; F539-L541 PolarHBondContact O-N 3.07Å; F539-L549 HydrophobicContact CD1-CD1 3.69Å; F539-L549 HydrophobicContact CD2-CD1 4.37Å; F539-L549 HydrophobicContact CE1-CD1 3.71Å; F539-L549 HydrophobicContact CE2-CD1 4.37Å; F539-L549 HydrophobicContact CG-CD1 4.03Å; F539-L549 HydrophobicContact CZ-CB 4.45Å; F539-L549 HydrophobicContact CZ-CD1 4.05Å; F539-I550 HydrophobicContact CE2-CG1 4.44Å; F539-L673 HydrophobicContact CD1-CD2 4.09Å; F539-I676 HydrophobicContact CD1-CB 4.16Å; F539-I676 HydrophobicContact CD1-CG2 3.59Å; F539-I676 HydrophobicContact CE1-CB 4.07Å; F539-I676 HydrophobicContact CE1-CG2 3.62Å; F539-I676 HydrophobicContact CG-CG2 4.28Å; F539-I676 HydrophobicContact CZ-CG2 4.34Å; F539-A677 HydrophobicContact CE1-CB 4.09Å; F539-A677 HydrophobicContact CZ-CB 4.07Å; F539-I680 HydrophobicContact CD2-CD1 4.42Å; F539-I680 HydrophobicContact CE1-CD1 4.43Å; F539-I680 HydrophobicContact CE2-CD1 3.41Å; F539-I680 VanDerWaalsContact CE2-CD1 3.41Å; F539-I680 HydrophobicContact CZ-CD1 3.42Å; F539-I680 VanDerWaalsContact CZ-CD1 3.42Å; F539-L682 HydrophobicContact CZ-CD1 4.22Å
540	P	88.8	Confident	92.6	Very high	44 Å²	44	29.4 Å²	29.4	29%	0.286	14%	0.144	S	C	.	.	S	Bend	trans	-81.5	60.7	173.8	35.2	-36.9	0	0	0	110.4	R127 I676	R127-P540 PolarHBondContact NH2-O 3.17Å; P540-I676 VanDerWaalsContact CD-CD1 3.49Å; P540-I676 HydrophobicContact CG-CD1 4.07Å
541	L	90.9	Very high	92.5	Very high	31 Å²	31	28.7 Å²	28.7	16%	0.162	14%	0.139	C	C	.	.	S	Bend	trans	-138.9	160.6	-175.4	-63.1	175.4	0	0	0	110.1	F539 F545 L549 I565 L673	F539-L541 HydrophobicContact CB-CB 4.38Å; F539-L541 HydrophobicContact CB-CD1 4.19Å; F539-L541 HydrophobicContact CB-CG 4.27Å; F539-L541 PolarHBondContact O-N 3.07Å; L541-F545 HydrophobicContact CB-CB 4.11Å; L541-F545 HydrophobicContact CD1-CB 4.18Å; L541-L549 HydrophobicContact CD1-CD1 3.53Å; L541-I565 HydrophobicContact CD1-CG2 3.92Å; L541-I565 HydrophobicContact CD2-CG2 3.98Å; L541-L673 HydrophobicContact CD1-CD1 4.2Å; L541-L673 HydrophobicContact CD1-CD2 3.74Å; L541-L673 HydrophobicContact CD2-CD1 4.5Å; L541-L673 HydrophobicContact CD2-CD2 4.25Å; L541-L673 HydrophobicContact CG-CD2 3.98Å
542	E	90.2	Very high	92.7	Very high	85 Å²	85	25.3 Å²	25.3	40%	0.397	12%	0.119	S	C	.	.			trans	-59.1	146.1	167.5	-76.1	-55.4	131.1	0	0	111	R544 F545 S546	E542-R544 PolarHBondContact O-N 3.21Å; E542-R544 VanDerWaalsContact O-N 3.07Å; E542-F545 HydrophobicContact CB-CD2 4.14Å; E542-F545 PolarHBondContact O-N 3.25Å; E542-S546 PolarHBondContact O-N 3.16Å; E542-S546 PolarHBondContact O-OG 3.12Å
543	P	93.4	Very high	92.7	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-51.5	-38.7	-175	-30.9	37.5	0	0	0	114.1	L453 L484 L487 M536 F545 S546 R547	L453-P543 HydrophobicContact CD2-CB 4.34Å; L453-P543 HydrophobicContact CD2-CG 4.1Å; L484-P543 HydrophobicContact CD2-CB 3.95Å; L484-P543 HydrophobicContact CD2-CG 3.93Å; L487-P543 HydrophobicContact CD1-CB 3.58Å; M536-P543 HydrophobicContact CE-CB 3.92Å; M536-P543 VanDerWaalsContact CE-O 3.3Å; M536-P543 WeakPolarHBondContact CE-O 3.13Å; P543-F545 PolarHBondContact O-N 2.96Å; P543-S546 PolarHBondContact O-N 3.29Å; P543-R547 WeakPolarHBondContact O-CB 3.31Å; P543-R547 PolarHBondContact O-N 2.96Å
544	R	93.1	Very high	92.6	Very high	30 Å²	30	31.9 Å²	31.9	11%	0.113	15%	0.145	C	C	.	.	H	α-helix	trans	-61.1	-44	177.3	-65.6	-177.9	174.9	-127.9	-6.8	112.7	L483 L487 E542 R547 T548 G704 F705 D707	L483-R544 HydrophobicContact CD1-CG 4.46Å; L483-R544 HydrophobicContact CD2-CG 4.35Å; L487-R544 HydrophobicContact CD1-CG 4.36Å; E542-R544 PolarHBondContact O-N 3.21Å; E542-R544 VanDerWaalsContact O-N 3.07Å; R544-R547 PolarHBondContact O-N 3.47Å; R544-T548 WeakPolarHBondContact O-CB 3.41Å; R544-T548 PolarHBondContact O-N 3.27Å; R544-T548 PolarHBondContact O-OG1 3.4Å; R544-G704 PolarHBondContact NH1-O 3.4Å; R544-G704 PolarHBondContact NH2-O 3.39Å; R544-F705 HydrophobicContact CB-CD2 4.29Å; R544-F705 HydrophobicContact CB-CE2 3.54Å; R544-F705 HydrophobicContact CB-CZ 3.66Å; R544-F705 HydrophobicContact CG-CE2 4.41Å; R544-F705 HydrophobicContact CG-CZ 4.43Å; R544-D707 IonicContact CZ-OD1 3.67Å; R544-D707 IonicContact CZ-OD2 3.33Å; R544-D707 IonicContact NH1-OD1 3.85Å; R544-D707 PolarHBondContact NH1-OD1 3.47Å; R544-D707 IonicContact NH1-OD2 2.72Å; R544-D707 IonicContact NH2-OD1 2.88Å; R544-D707 PolarHBondContact NH2-OD1 3.4Å; R544-D707 IonicContact NH2-OD2 3.04Å; R544-D707 PolarHBondContact NH2-OD2 3.35Å
545	F	95.2	Very high	92.6	Very high	46 Å²	46	26.3 Å²	26.3	20%	0.202	13%	0.126	C	C	.	.	H	α-helix	trans	-71.3	-36.9	176.9	-65	-41	0	0	0	112.2	L541 E542 P543 R547 T548 L549 I565 L568 F700 F705 I775	L541-F545 HydrophobicContact CB-CB 4.11Å; L541-F545 HydrophobicContact CD1-CB 4.18Å; E542-F545 HydrophobicContact CB-CD2 4.14Å; E542-F545 PolarHBondContact O-N 3.25Å; P543-F545 PolarHBondContact O-N 2.96Å; F545-R547 VanDerWaalsContact C-N 3.35Å; F545-T548 WeakPolarHBondContact O-CB 3.28Å; F545-T548 PolarHBondContact O-N 3.46Å; F545-L549 PolarHBondContact O-N 2.92Å; F545-I565 HydrophobicContact CB-CD1 4.16Å; F545-I565 HydrophobicContact CB-CG2 4.45Å; F545-I565 HydrophobicContact CD1-CG1 4.37Å; F545-L568 HydrophobicContact CE1-CD1 4.01Å; F545-L568 HydrophobicContact CZ-CD1 4.32Å; F545-F700 HydrophobicContact CD1-CE1 4.14Å; F545-F700 HydrophobicContact CE1-CE1 4.02Å; F545-F705 HydrophobicContact CD1-CE2 4.34Å; F545-F705 HydrophobicContact CD1-CZ 4.03Å; F545-F705 HydrophobicContact CE1-CE2 4.36Å; F545-F705 AromaticContact CE1-CZ 3.68Å; F545-F705 HydrophobicContact CE1-CZ 3.68Å; F545-F705 HydrophobicContact CZ-CZ 4.42Å; F545-I775 HydrophobicContact CE1-CG2 3.8Å; F545-I775 HydrophobicContact CZ-CG2 3.76Å
546	S	94.8	Very high	92.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-60.3	-44.7	172	-61.8	0	0	0	0	111.5	M536 E542 P543 T548 L549 I550	M536-S546 PolarHBondContact O-OG 3.05Å; E542-S546 PolarHBondContact O-N 3.16Å; E542-S546 PolarHBondContact O-OG 3.12Å; P543-S546 PolarHBondContact O-N 3.29Å; S546-T548 VanDerWaalsContact C-N 3.34Å; S546-L549 PolarHBondContact O-N 2.63Å; S546-I550 WeakPolarHBondContact O-CG1 3.41Å; S546-I550 PolarHBondContact O-N 3.31Å
547	R	94.4	Very high	92.8	Very high	34 Å²	34	25.2 Å²	25.2	13%	0.128	12%	0.123	C	C	.	.	H	α-helix	trans	-63.2	-40.2	173.6	179.8	62.3	178.8	163.9	-1.1	111.2	L487 L532 M536 P543 R544 F545 L549 I550 S551 S703	L487-R547 HydrophobicContact CD2-CB 4.08Å; L487-R547 HydrophobicContact CD2-CG 4.03Å; L532-R547 VanDerWaalsContact CD1-NH1 3.26Å; M536-R547 HydrophobicContact CE-CB 4.03Å; M536-R547 HydrophobicContact SD-CB 4.23Å; P543-R547 WeakPolarHBondContact O-CB 3.31Å; P543-R547 PolarHBondContact O-N 2.96Å; R544-R547 PolarHBondContact O-N 3.47Å; F545-R547 VanDerWaalsContact C-N 3.35Å; R547-L549 VanDerWaalsContact C-N 3.33Å; R547-L549 PolarHBondContact O-N 2.74Å; R547-I550 PolarHBondContact O-N 2.88Å; R547-S551 PolarHBondContact O-N 3.24Å; R547-S551 PolarHBondContact O-OG 2.93Å; R547-S551 VanDerWaalsContact O-OG 3.09Å; R547-S703 PolarHBondContact O-OG 3.24Å
548	T	95.2	Very high	93	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-58.3	-42.2	177.4	-53.4	0	0	0	0	112.2	R544 F545 S546 I550 S551 A552 I561 I565 A699 F700 S703	R544-T548 WeakPolarHBondContact O-CB 3.41Å; R544-T548 PolarHBondContact O-N 3.27Å; R544-T548 PolarHBondContact O-OG1 3.4Å; F545-T548 WeakPolarHBondContact O-CB 3.28Å; F545-T548 PolarHBondContact O-N 3.46Å; S546-T548 VanDerWaalsContact C-N 3.34Å; T548-I550 VanDerWaalsContact C-N 3.33Å; T548-I550 PolarHBondContact O-N 2.89Å; T548-S551 PolarHBondContact O-N 3.35Å; T548-A552 WeakPolarHBondContact O-CB 3.46Å; T548-A552 PolarHBondContact O-N 2.58Å; T548-I561 HydrophobicContact CG2-CD1 4.22Å; T548-I561 HydrophobicContact CG2-CG2 3.83Å; T548-I565 HydrophobicContact CG2-CD1 4.37Å; T548-A699 HydrophobicContact CG2-CB 4.37Å; T548-F700 HydrophobicContact CG2-CD1 3.93Å; T548-F700 HydrophobicContact CG2-CD2 4Å; T548-F700 HydrophobicContact CG2-CE1 4Å; T548-F700 HydrophobicContact CG2-CE2 4.06Å; T548-F700 HydrophobicContact CG2-CG 3.93Å; T548-F700 HydrophobicContact CG2-CZ 4.06Å; T548-S703 WeakPolarHBondContact CA-OG 3.16Å; T548-S703 PolarHBondContact N-OG 3.48Å; T548-S703 WeakPolarHBondContact OG1-CB 3.42Å
549	L	95	Very high	93.3	Very high	0 Å²	0	26 Å²	26	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.4	-41.4	174	-72.4	170.3	0	0	0	112.2	F539 L541 F545 S546 R547 A552 A553 L558 I561 L562 I565	F539-L549 HydrophobicContact CD1-CD1 3.69Å; F539-L549 HydrophobicContact CD2-CD1 4.37Å; F539-L549 HydrophobicContact CE1-CD1 3.71Å; F539-L549 HydrophobicContact CE2-CD1 4.37Å; F539-L549 HydrophobicContact CG-CD1 4.03Å; F539-L549 HydrophobicContact CZ-CB 4.45Å; F539-L549 HydrophobicContact CZ-CD1 4.05Å; L541-L549 HydrophobicContact CD1-CD1 3.53Å; F545-L549 PolarHBondContact O-N 2.92Å; S546-L549 PolarHBondContact O-N 2.63Å; R547-L549 VanDerWaalsContact C-N 3.33Å; R547-L549 PolarHBondContact O-N 2.74Å; L549-A552 PolarHBondContact O-N 2.86Å; L549-A553 PolarHBondContact O-N 3.06Å; L549-A553 VanDerWaalsContact O-N 3.09Å; L549-L558 HydrophobicContact CB-CD1 4.32Å; L549-L558 HydrophobicContact CD2-CD1 3.8Å; L549-L558 WeakPolarHBondContact O-CD1 3.4Å; L549-I561 HydrophobicContact CD2-CG2 3.93Å; L549-L562 HydrophobicContact CD2-CD2 3.57Å; L549-L562 HydrophobicContact CD2-CG 3.89Å; L549-I565 HydrophobicContact CD1-CD1 4.46Å; L549-I565 HydrophobicContact CD2-CD1 3.91Å; L549-I565 HydrophobicContact CG-CD1 3.73Å
550	I	93.1	Very high	93.6	Very high	22 Å²	22	25.9 Å²	25.9	11%	0.113	12%	0.124	C	C	.	.	H	α-helix	trans	-71.9	-42.5	-178.5	-60.3	170.5	0	0	0	110.6	L532 L535 M536 F539 S546 R547 T548 A552 A553 Y554	L532-I550 HydrophobicContact CD1-CB 4.28Å; L532-I550 HydrophobicContact CD1-CD1 3.61Å; L532-I550 HydrophobicContact CD1-CG2 3.75Å; L535-I550 HydrophobicContact CB-CD1 3.65Å; M536-I550 HydrophobicContact CG-CD1 3.58Å; F539-I550 HydrophobicContact CE2-CG1 4.44Å; S546-I550 WeakPolarHBondContact O-CG1 3.41Å; S546-I550 PolarHBondContact O-N 3.31Å; R547-I550 PolarHBondContact O-N 2.88Å; T548-I550 VanDerWaalsContact C-N 3.33Å; T548-I550 PolarHBondContact O-N 2.89Å; I550-A552 VanDerWaalsContact C-N 3.29Å; I550-A552 PolarHBondContact O-N 2.88Å; I550-A553 VanDerWaalsContact O-CB 3.24Å; I550-A553 WeakPolarHBondContact O-CB 3.45Å; I550-A553 PolarHBondContact O-N 2.95Å; I550-Y554 PolarHBondContact O-N 2.53Å
551	S	92	Very high	94	Very high	7 Å²	7	23.8 Å²	23.8	5%	0.049	11%	0.11	C	C	.	.	H	α-helix	trans	-61.3	-38.5	173.2	-56.9	0	0	0	0	111.8	R547 T548 A553 Y554 L555 S703	R547-S551 PolarHBondContact O-N 3.24Å; R547-S551 PolarHBondContact O-OG 2.93Å; R547-S551 VanDerWaalsContact O-OG 3.09Å; T548-S551 PolarHBondContact O-N 3.35Å; S551-A553 VanDerWaalsContact C-N 3.31Å; S551-A553 PolarHBondContact O-N 3.02Å; S551-Y554 WeakPolarHBondContact O-CB 3.34Å; S551-Y554 PolarHBondContact O-N 3.01Å; S551-L555 PolarHBondContact O-N 2.79Å; S551-S703 WeakPolarHBondContact CB-OG 3.46Å; S551-S703 PolarHBondContact OG-OG 3.19Å
552	A	94.4	Very high	94.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-66.1	-33	176.7	0	0	0	0	0	113.2	T548 L549 I550 Y554 G556 C557 L558 I561 A699	T548-A552 WeakPolarHBondContact O-CB 3.46Å; T548-A552 PolarHBondContact O-N 2.58Å; L549-A552 PolarHBondContact O-N 2.86Å; I550-A552 VanDerWaalsContact C-N 3.29Å; I550-A552 PolarHBondContact O-N 2.88Å; A552-Y554 VanDerWaalsContact C-N 3.3Å; A552-G556 PolarHBondContact O-N 3.43Å; A552-C557 VanDerWaalsContact CA-SG 3.57Å; A552-C557 PolarHBondContact O-N 3.46Å; A552-L558 HydrophobicContact CB-CB 4.41Å; A552-L558 HydrophobicContact CB-CD1 4.26Å; A552-L558 PolarHBondContact O-N 3.42Å; A552-I561 HydrophobicContact CB-CB 3.69Å; A552-I561 HydrophobicContact CB-CG1 3.56Å; A552-I561 HydrophobicContact CB-CG2 3.89Å; A552-A699 HydrophobicContact CB-CB 4.23Å
553	A	92.7	Very high	94.7	Very high	5 Å²	5	18.5 Å²	18.5	4%	0.041	9%	0.085	C	C	.	.	H	α-helix	trans	-60.3	-42.9	172.3	0	0	0	0	0	110.8	L549 I550 S551 L558 L682 Y685	L549-A553 PolarHBondContact O-N 3.06Å; L549-A553 VanDerWaalsContact O-N 3.09Å; I550-A553 VanDerWaalsContact O-CB 3.24Å; I550-A553 WeakPolarHBondContact O-CB 3.45Å; I550-A553 PolarHBondContact O-N 2.95Å; S551-A553 VanDerWaalsContact C-N 3.31Å; S551-A553 PolarHBondContact O-N 3.02Å; A553-L558 HydrophobicContact CB-CD2 3.87Å; A553-L682 HydrophobicContact CB-CD2 4.14Å; A553-Y685 HydrophobicContact CB-CG 4.36Å
554	Y	89.5	Confident	94.9	Very high	154 Å²	154	18.5 Å²	18.5	60%	0.604	9%	0.085	S	C	*	.	H	α-helix	trans	-69.7	-43.8	178.1	-177.1	-98.4	0	0	0	112.9	I550 S551 A552 G556	I550-Y554 PolarHBondContact O-N 2.53Å; S551-Y554 WeakPolarHBondContact O-CB 3.34Å; S551-Y554 PolarHBondContact O-N 3.01Å; A552-Y554 VanDerWaalsContact C-N 3.3Å; Y554-G556 VanDerWaalsContact C-N 3.26Å; Y554-G556 PolarHBondContact O-N 2.87Å
555	L	91.9	Very high	95.1	Very high	32 Å²	32	17.2 Å²	17.2	17%	0.168	8%	0.081	C	C	.	.	H	α-helix	trans	-75.1	-13.8	179.8	-67.6	174.6	0	0	0	113.8	S551 K695 Q698 A699 L702	S551-L555 PolarHBondContact O-N 2.79Å; L555-K695 WeakPolarHBondContact O-CD 3.36Å; L555-K695 PolarHBondContact O-NZ 2.75Å; L555-Q698 HydrophobicContact CD1-CB 4.02Å; L555-A699 HydrophobicContact CD1-CB 3.88Å; L555-L702 HydrophobicContact CD1-CD1 3.98Å; L555-L702 HydrophobicContact CD2-CD1 4.33Å; L555-L702 HydrophobicContact CG-CD1 4.42Å
556	G	93.9	Very high	95.1	Very high	12 Å²	12	15 Å²	15	12%	0.124	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	77	36.6	-177.8	0	0	0	0	0	113.7	A552 Y554 S688 C689	A552-G556 PolarHBondContact O-N 3.43Å; Y554-G556 VanDerWaalsContact C-N 3.26Å; Y554-G556 PolarHBondContact O-N 2.87Å; G556-S688 CarbonylContact O-C 3.55Å; G556-C689 WeakPolarHBondContact O-CA 3.44Å; G556-C689 PolarHBondContact O-N 3.36Å; G556-C689 VanDerWaalsContact O-N 3.15Å
557	C	96.1	Very high	95.1	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.071	C	C	.	.			trans	-126.2	19.1	178.7	65.9	0	0	0	0	113.1	A552 I559 E560 I561 C689 K695	A552-C557 VanDerWaalsContact CA-SG 3.57Å; A552-C557 PolarHBondContact O-N 3.46Å; C557-I559 VanDerWaalsContact C-N 3.31Å; C557-I559 PolarHBondContact O-N 2.89Å; C557-E560 PolarHBondContact O-N 3.24Å; C557-I561 WeakPolarHBondContact O-CG1 3.26Å; C557-I561 PolarHBondContact O-N 2.75Å; C557-C689 HydrophobicContact CB-CB 3.64Å; C557-K695 HydrophobicContact CB-CB 4.11Å; C557-K695 PolarHBondContact SG-O 2.92Å; C557-K695 VanDerWaalsContact SG-O 3.41Å
558	L	96.2	Very high	95.1	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-61.3	-35.2	-173.1	-175.8	51.9	0	0	0	113.3	L549 A552 A553 E560 I561 L562 L682 M686 H687	L549-L558 HydrophobicContact CB-CD1 4.32Å; L549-L558 HydrophobicContact CD2-CD1 3.8Å; L549-L558 WeakPolarHBondContact O-CD1 3.4Å; A552-L558 HydrophobicContact CB-CB 4.41Å; A552-L558 HydrophobicContact CB-CD1 4.26Å; A552-L558 PolarHBondContact O-N 3.42Å; A553-L558 HydrophobicContact CB-CD2 3.87Å; L558-E560 VanDerWaalsContact C-N 3.35Å; L558-E560 PolarHBondContact O-N 2.97Å; L558-I561 PolarHBondContact O-N 3.11Å; L558-L562 HydrophobicContact CD1-CD1 4.36Å; L558-L562 HydrophobicContact CD1-CG 4.06Å; L558-L562 HydrophobicContact CG-CD1 4.2Å; L558-L562 HydrophobicContact CG-CG 4.41Å; L558-L562 WeakPolarHBondContact O-CB 3.47Å; L558-L562 VanDerWaalsContact O-CG 3.25Å; L558-L562 WeakPolarHBondContact O-CG 3.44Å; L558-L562 PolarHBondContact O-N 3.18Å; L558-L682 HydrophobicContact CD2-CB 4.29Å; L558-M686 HydrophobicContact CD2-CE 3.21Å; L558-M686 HydrophobicContact CD2-SD 3.99Å; L558-M686 HydrophobicContact CG-CE 3.76Å; L558-M686 HydrophobicContact CG-SD 4.12Å; L558-H687 PolarHBondContact N-O 3.18Å
559	I	97.2	Very high	94.8	Very high	39 Å²	39	20 Å²	20	20%	0.2	9%	0.092	C	C	.	.	H	α-helix	trans	-61.7	-43.5	178	-70.5	178.8	0	0	0	111.4	C557 S563 M686 H687	C557-I559 VanDerWaalsContact C-N 3.31Å; C557-I559 PolarHBondContact O-N 2.89Å; I559-S563 PolarHBondContact O-OG 3.29Å; I559-M686 WeakPolarHBondContact CD1-O 3.39Å; I559-H687 WeakPolarHBondContact CG1-O 3.24Å; I559-H687 PolarHBondContact N-O 3.44Å; I559-H687 VanDerWaalsContact N-O 3.16Å
560	E	97.9	Very high	94.4	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.009	10%	0.096	C	C	.	.	H	α-helix	trans	-69	-48.6	177.4	-72.5	70.2	-146.2	0	0	111	C557 L558 L562 S563 I564 L602 R606 S688 C689 I696	C557-E560 PolarHBondContact O-N 3.24Å; L558-E560 VanDerWaalsContact C-N 3.35Å; L558-E560 PolarHBondContact O-N 2.97Å; E560-L562 PolarHBondContact O-N 3.17Å; E560-S563 CarbonylContact O-C 3.58Å; E560-S563 WeakPolarHBondContact O-CA 3.42Å; E560-S563 VanDerWaalsContact O-CB 3.25Å; E560-S563 WeakPolarHBondContact O-CB 3.37Å; E560-S563 PolarHBondContact O-N 3.02Å; E560-I564 WeakPolarHBondContact O-CG1 3.48Å; E560-I564 PolarHBondContact O-N 3.45Å; E560-L602 HydrophobicContact CB-CD1 4.25Å; E560-L602 HydrophobicContact CB-CD2 3.92Å; E560-L602 HydrophobicContact CG-CD1 4.2Å; E560-L602 HydrophobicContact CG-CD2 3.53Å; E560-R606 IonicContact OE1-NH2 2.7Å; E560-R606 PolarHBondContact OE1-NH2 3.44Å; E560-S688 WeakPolarHBondContact OE1-CB 3.25Å; E560-S688 PolarHBondContact OE1-OG 2.84Å; E560-S688 VanDerWaalsContact OE2-CA 3.26Å; E560-S688 WeakPolarHBondContact OE2-CA 3.08Å; E560-C689 PolarHBondContact OE2-N 3.09Å; E560-C689 VanDerWaalsContact OE2-N 3.08Å; E560-I696 HydrophobicContact CB-CD1 3.98Å; E560-I696 HydrophobicContact CB-CG1 4.16Å; E560-I696 HydrophobicContact CG-CD1 4.18Å
561	I	97.6	Very high	94.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64	-38.9	-177.1	-68	-71.5	0	0	0	111.9	T548 L549 A552 C557 L558 S563 I564 I565 I696 A699 F700	T548-I561 HydrophobicContact CG2-CD1 4.22Å; T548-I561 HydrophobicContact CG2-CG2 3.83Å; L549-I561 HydrophobicContact CD2-CG2 3.93Å; A552-I561 HydrophobicContact CB-CB 3.69Å; A552-I561 HydrophobicContact CB-CG1 3.56Å; A552-I561 HydrophobicContact CB-CG2 3.89Å; C557-I561 WeakPolarHBondContact O-CG1 3.26Å; C557-I561 PolarHBondContact O-N 2.75Å; L558-I561 PolarHBondContact O-N 3.11Å; I561-S563 PolarHBondContact O-N 2.89Å; I561-I564 HydrophobicContact CD1-CD1 4.46Å; I561-I564 PolarHBondContact O-N 3.3Å; I561-I565 HydrophobicContact CG2-CD1 3.62Å; I561-I565 HydrophobicContact CG2-CG1 4.21Å; I561-I565 WeakPolarHBondContact O-CB 3.45Å; I561-I565 WeakPolarHBondContact O-CG1 3.46Å; I561-I565 PolarHBondContact O-N 3.37Å; I561-I696 HydrophobicContact CD1-CB 4.4Å; I561-I696 HydrophobicContact CD1-CG2 3.77Å; I561-A699 HydrophobicContact CD1-CB 4.08Å; I561-A699 HydrophobicContact CG1-CB 4.29Å; I561-F700 HydrophobicContact CD1-CD2 3.91Å; I561-F700 HydrophobicContact CD1-CE2 3.45Å; I561-F700 VanDerWaalsContact CD1-CE2 3.45Å; I561-F700 HydrophobicContact CD1-CZ 4.37Å
562	L	97.4	Very high	93.7	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-55.3	-39.5	170.5	-80.1	169.4	0	0	0	111.7	L549 L558 E560 S566 R670 L673 K674 M686	L549-L562 HydrophobicContact CD2-CD2 3.57Å; L549-L562 HydrophobicContact CD2-CG 3.89Å; L558-L562 HydrophobicContact CD1-CD1 4.36Å; L558-L562 HydrophobicContact CD1-CG 4.06Å; L558-L562 HydrophobicContact CG-CD1 4.2Å; L558-L562 HydrophobicContact CG-CG 4.41Å; L558-L562 WeakPolarHBondContact O-CB 3.47Å; L558-L562 VanDerWaalsContact O-CG 3.25Å; L558-L562 WeakPolarHBondContact O-CG 3.44Å; L558-L562 PolarHBondContact O-N 3.18Å; E560-L562 PolarHBondContact O-N 3.17Å; L562-S566 VanDerWaalsContact O-CB 3.32Å; L562-S566 WeakPolarHBondContact O-CB 3.39Å; L562-S566 PolarHBondContact O-N 2.95Å; L562-S566 PolarHBondContact O-OG 3.42Å; L562-R670 HydrophobicContact CB-CG 4.17Å; L562-L673 HydrophobicContact CD2-CB 3.46Å; L562-L673 VanDerWaalsContact CD2-CB 3.46Å; L562-K674 HydrophobicContact CD1-CB 4.3Å; L562-M686 HydrophobicContact CD1-CE 4.04Å; L562-M686 HydrophobicContact CD1-SD 3.82Å
563	S	97.9	Very high	93.4	Very high	4 Å²	4	24 Å²	24	3%	0.028	12%	0.119	C	C	.	.	H	α-helix	trans	-72.5	-44.1	179.3	-47.1	0	0	0	0	111.1	I559 E560 I561 S566 M567 R670	I559-S563 PolarHBondContact O-OG 3.29Å; E560-S563 CarbonylContact O-C 3.58Å; E560-S563 WeakPolarHBondContact O-CA 3.42Å; E560-S563 VanDerWaalsContact O-CB 3.25Å; E560-S563 WeakPolarHBondContact O-CB 3.37Å; E560-S563 PolarHBondContact O-N 3.02Å; I561-S563 PolarHBondContact O-N 2.89Å; S563-S566 WeakPolarHBondContact O-CB 3.44Å; S563-S566 PolarHBondContact O-N 3.25Å; S563-M567 VanDerWaalsContact O-CG 3.31Å; S563-M567 WeakPolarHBondContact O-CG 3.25Å; S563-M567 PolarHBondContact O-N 3.05Å; S563-R670 PolarHBondContact OG-NE 3.25Å
564	I	97.5	Very high	93.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.9	-50.4	-179.4	-67.9	168.2	0	0	0	111.3	E560 I561 S566 M567 L568 L598 L602 I696 F700	E560-I564 WeakPolarHBondContact O-CG1 3.48Å; E560-I564 PolarHBondContact O-N 3.45Å; I561-I564 HydrophobicContact CD1-CD1 4.46Å; I561-I564 PolarHBondContact O-N 3.3Å; I564-S566 PolarHBondContact O-N 3.38Å; I564-M567 CarbonylContact O-C 3.49Å; I564-M567 WeakPolarHBondContact O-CA 3.47Å; I564-M567 WeakPolarHBondContact O-CB 3.22Å; I564-M567 PolarHBondContact O-N 2.85Å; I564-L568 HydrophobicContact CG2-CD1 4.13Å; I564-L568 HydrophobicContact CG2-CG 4.35Å; I564-L568 WeakPolarHBondContact O-CG 3.33Å; I564-L568 PolarHBondContact O-N 2.84Å; I564-L598 HydrophobicContact CG2-CB 4.37Å; I564-L598 HydrophobicContact CG2-CD2 3.79Å; I564-L602 HydrophobicContact CD1-CB 4.2Å; I564-L602 HydrophobicContact CG1-CB 3.91Å; I564-I696 HydrophobicContact CD1-CD1 4.14Å; I564-I696 HydrophobicContact CD1-CG1 4.46Å; I564-I696 HydrophobicContact CD1-CG2 3.32Å; I564-F700 HydrophobicContact CG2-CE2 4.08Å; I564-F700 HydrophobicContact CG2-CZ 3.91Å
565	I	96.4	Very high	92.6	Very high	4 Å²	4	22.7 Å²	22.7	2%	0.021	11%	0.114	C	C	.	.	H	α-helix	trans	-59.9	-36.2	177.6	-70	172.6	0	0	0	110.9	L541 F545 T548 L549 I561 M567 L568 Y569 L673 F700	L541-I565 HydrophobicContact CD1-CG2 3.92Å; L541-I565 HydrophobicContact CD2-CG2 3.98Å; F545-I565 HydrophobicContact CB-CD1 4.16Å; F545-I565 HydrophobicContact CB-CG2 4.45Å; F545-I565 HydrophobicContact CD1-CG1 4.37Å; T548-I565 HydrophobicContact CG2-CD1 4.37Å; L549-I565 HydrophobicContact CD1-CD1 4.46Å; L549-I565 HydrophobicContact CD2-CD1 3.91Å; L549-I565 HydrophobicContact CG-CD1 3.73Å; I561-I565 HydrophobicContact CG2-CD1 3.62Å; I561-I565 HydrophobicContact CG2-CG1 4.21Å; I561-I565 WeakPolarHBondContact O-CB 3.45Å; I561-I565 WeakPolarHBondContact O-CG1 3.46Å; I561-I565 PolarHBondContact O-N 3.37Å; I565-M567 VanDerWaalsContact C-N 3.31Å; I565-M567 PolarHBondContact O-N 3.27Å; I565-L568 PolarHBondContact O-N 2.93Å; I565-Y569 PolarHBondContact O-N 3.31Å; I565-Y569 VanDerWaalsContact O-N 3.11Å; I565-L673 HydrophobicContact CG2-CD1 4Å; I565-F700 HydrophobicContact CG1-CZ 4.4Å
566	S	96.4	Very high	91.9	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-68.1	-30.6	175.4	-59.2	0	0	0	0	113.4	L562 S563 I564 A666 R670	L562-S566 VanDerWaalsContact O-CB 3.32Å; L562-S566 WeakPolarHBondContact O-CB 3.39Å; L562-S566 PolarHBondContact O-N 2.95Å; L562-S566 PolarHBondContact O-OG 3.42Å; S563-S566 WeakPolarHBondContact O-CB 3.44Å; S563-S566 PolarHBondContact O-N 3.25Å; I564-S566 PolarHBondContact O-N 3.38Å; S566-A666 WeakPolarHBondContact CB-O 3.34Å; S566-A666 WeakPolarHBondContact O-CB 3.5Å; S566-R670 WeakPolarHBondContact OG-CA 3.34Å; S566-R670 VanDerWaalsContact OG-CB 3.26Å; S566-R670 WeakPolarHBondContact OG-CB 3.29Å; S566-R670 PolarHBondContact OG-N 2.87Å
567	M	95.5	Very high	90.7	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-76	-43.5	174.3	-71.6	-65.9	-76.8	0	0	111.7	S563 I564 I565 Y569 V570 C571 V573 L601 V604 Y605 L663 A666	S563-M567 VanDerWaalsContact O-CG 3.31Å; S563-M567 WeakPolarHBondContact O-CG 3.25Å; S563-M567 PolarHBondContact O-N 3.05Å; I564-M567 CarbonylContact O-C 3.49Å; I564-M567 WeakPolarHBondContact O-CA 3.47Å; I564-M567 WeakPolarHBondContact O-CB 3.22Å; I564-M567 PolarHBondContact O-N 2.85Å; I565-M567 VanDerWaalsContact C-N 3.31Å; I565-M567 PolarHBondContact O-N 3.27Å; M567-Y569 PolarHBondContact O-N 2.78Å; M567-V570 VanDerWaalsContact O-CG2 3.28Å; M567-V570 WeakPolarHBondContact O-CG2 3.43Å; M567-V570 PolarHBondContact O-N 3.48Å; M567-V570 HydrophobicContact SD-CG2 4.5Å; M567-C571 PolarHBondContact O-N 2.92Å; M567-C571 VanDerWaalsContact O-N 3.16Å; M567-C571 PolarHBondContact O-SG 3.07Å; M567-V573 HydrophobicContact CE-CB 4.29Å; M567-V573 HydrophobicContact CE-CG1 3.7Å; M567-V573 HydrophobicContact CE-CG2 4.21Å; M567-V573 HydrophobicContact SD-CG1 4.5Å; M567-L601 HydrophobicContact CB-CB 4.13Å; M567-L601 HydrophobicContact CB-CD1 4.47Å; M567-L601 HydrophobicContact CB-CD2 4.43Å; M567-L601 HydrophobicContact CE-CD2 4.26Å; M567-V604 HydrophobicContact CE-CB 3.94Å; M567-V604 HydrophobicContact CE-CG1 3.69Å; M567-Y605 HydrophobicContact CG-CD2 4.08Å; M567-Y605 HydrophobicContact CG-CG 4.33Å; M567-Y605 HydrophobicContact SD-CD2 3.82Å; M567-Y605 HydrophobicContact SD-CG 4.38Å; M567-L663 HydrophobicContact CE-CD1 3.8Å; M567-L663 HydrophobicContact SD-CD1 3.69Å; M567-A666 HydrophobicContact SD-CB 3.78Å
568	L	93.1	Very high	89.3	Confident	24 Å²	24	30.6 Å²	30.6	13%	0.126	16%	0.161	C	C	.	.	H	α-helix	trans	-55.1	-39.4	174	-69.7	172.9	0	0	0	111.1	F545 I564 I565 V570 C571 L598 L601 F700 I775 H801	F545-L568 HydrophobicContact CE1-CD1 4.01Å; F545-L568 HydrophobicContact CZ-CD1 4.32Å; I564-L568 HydrophobicContact CG2-CD1 4.13Å; I564-L568 HydrophobicContact CG2-CG 4.35Å; I564-L568 WeakPolarHBondContact O-CG 3.33Å; I564-L568 PolarHBondContact O-N 2.84Å; I565-L568 PolarHBondContact O-N 2.93Å; L568-V570 PolarHBondContact O-N 2.95Å; L568-V570 VanDerWaalsContact O-N 3.16Å; L568-C571 PolarHBondContact O-N 3.22Å; L568-L598 HydrophobicContact CD1-CD2 4.24Å; L568-L598 HydrophobicContact CD2-CD2 4.32Å; L568-L601 HydrophobicContact CD2-CD1 3.78Å; L568-L601 HydrophobicContact CG-CD1 4.35Å; L568-F700 HydrophobicContact CD1-CE1 4.18Å; L568-F700 HydrophobicContact CD1-CZ 4.07Å; L568-I775 HydrophobicContact CD1-CG2 4.42Å; L568-H801 HydrophobicContact CD2-CB 4.05Å; L568-H801 VanDerWaalsContact CD2-CG 3.46Å
569	Y	89.7	Confident	88.3	Confident	114 Å²	114	39.6 Å²	39.6	45%	0.447	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-24.2	176.2	-174.7	-94.8	0	0	0	114.6	R127 I565 M567 T665 V669	R127-Y569 VanDerWaalsContact NH1-CZ 3.33Å; R127-Y569 PolarHBondContact NH1-OH 2.93Å; R127-Y569 VanDerWaalsContact NH1-OH 3.16Å; I565-Y569 PolarHBondContact O-N 3.31Å; I565-Y569 VanDerWaalsContact O-N 3.11Å; M567-Y569 PolarHBondContact O-N 2.78Å; Y569-T665 HydrophobicContact CE1-CG2 4.49Å; Y569-V669 HydrophobicContact CD1-CG2 3.48Å; Y569-V669 VanDerWaalsContact CD1-CG2 3.48Å; Y569-V669 HydrophobicContact CE1-CG2 3.87Å; Y569-V669 HydrophobicContact CG-CG1 4.48Å; Y569-V669 HydrophobicContact CG-CG2 4.17Å
570	V	87	Confident	87.3	Confident	13 Å²	13	41.5 Å²	41.5	8%	0.079	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.9	5.4	-175.8	-56.6	0	0	0	0	113.8	M567 L568 V573 R662 T665 A666	M567-V570 VanDerWaalsContact O-CG2 3.28Å; M567-V570 WeakPolarHBondContact O-CG2 3.43Å; M567-V570 PolarHBondContact O-N 3.48Å; M567-V570 HydrophobicContact SD-CG2 4.5Å; L568-V570 PolarHBondContact O-N 2.95Å; L568-V570 VanDerWaalsContact O-N 3.16Å; V570-V573 HydrophobicContact CG2-CG1 3.94Å; V570-R662 HydrophobicContact CB-CB 4.1Å; V570-R662 HydrophobicContact CG2-CB 4.29Å; V570-R662 WeakPolarHBondContact O-CD 3.41Å; V570-T665 HydrophobicContact CG1-CG2 3.88Å; V570-A666 HydrophobicContact CG1-CB 4.29Å; V570-A666 HydrophobicContact CG2-CB 3.82Å
571	C	85.2	Confident	86.2	Confident	34 Å²	34	49 Å²	49	23%	0.23	24%	0.239	C	C	.	.			trans	-64.9	153.1	-179.4	-76.9	0	0	0	0	112.4	M567 L568 H801	M567-C571 PolarHBondContact O-N 2.92Å; M567-C571 VanDerWaalsContact O-N 3.16Å; M567-C571 PolarHBondContact O-SG 3.07Å; L568-C571 PolarHBondContact O-N 3.22Å; C571-H801 VanDerWaalsContact SG-CE1 3.6Å
572	P	84.8	Confident	85.3	Confident	61 Å²	61	55.8 Å²	55.8	40%	0.396	28%	0.275	S	S	.	.			cis	-68.2	147.7	-8.5	25.5	-34.6	0	0	0	113.4	R662	P572-R662 WeakPolarHBondContact O-CD 3.37Å; P572-R662 VanDerWaalsContact O-CZ 3.3Å; P572-R662 PolarHBondContact O-NE 3.01Å; P572-R662 PolarHBondContact O-NH1 2.9Å
573	V	87	Confident	84.5	Confident	4 Å²	4	60 Å²	60	2%	0.024	29%	0.294	C	S	.	.			trans	-98.4	-22.9	-176.7	-66.1	0	0	0	0	114.2	M567 V570 L601 V604 N659 L663	M567-V573 HydrophobicContact CE-CB 4.29Å; M567-V573 HydrophobicContact CE-CG1 3.7Å; M567-V573 HydrophobicContact CE-CG2 4.21Å; M567-V573 HydrophobicContact SD-CG1 4.5Å; V570-V573 HydrophobicContact CG2-CG1 3.94Å; V573-L601 HydrophobicContact CG2-CD2 4.13Å; V573-V604 HydrophobicContact CG2-CG1 4.23Å; V573-N659 PolarHBondContact O-N 3.28Å; V573-L663 HydrophobicContact CB-CD2 3.95Å; V573-L663 HydrophobicContact CG1-CD2 4.1Å
574	F	86.3	Confident	83.7	Confident	37 Å²	37	60.7 Å²	60.7	16%	0.162	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-86.7	152.7	175.7	-67.5	-74.9	0	0	0	110.8	F584 F591 V604 F657 I658	F574-F584 HydrophobicContact CB-CE2 3.74Å; F574-F584 HydrophobicContact CB-CZ 3.84Å; F574-F584 AromaticContact CD1-CE2 3.97Å; F574-F584 HydrophobicContact CD1-CE2 3.97Å; F574-F584 HydrophobicContact CD1-CZ 4.47Å; F574-F584 HydrophobicContact CG-CE2 4.04Å; F574-F584 HydrophobicContact CG-CZ 4.16Å; F574-F591 HydrophobicContact CE1-CD2 4.11Å; F574-F591 HydrophobicContact CE1-CE2 4.44Å; F574-F591 HydrophobicContact CZ-CB 4.38Å; F574-F591 AromaticContact CZ-CD2 3.96Å; F574-F591 HydrophobicContact CZ-CD2 3.96Å; F574-F591 HydrophobicContact CZ-CG 4.36Å; F574-V604 HydrophobicContact CE2-CG2 4.03Å; F574-V604 HydrophobicContact CZ-CG2 3.65Å; F574-F657 CarbonylContact C-O 3.59Å; F574-F657 WeakPolarHBondContact CA-O 3.42Å; F574-I658 HydrophobicContact CD1-CG1 3.76Å; F574-I658 HydrophobicContact CE1-CD1 4.04Å; F574-I658 HydrophobicContact CE1-CG1 3.62Å; F574-I658 HydrophobicContact CZ-CG1 4.47Å
575	Y	80.7	Confident	82.8	Confident	95 Å²	95	64.2 Å²	64.2	37%	0.373	32%	0.322	S	S	.	.			trans	-121.3	139.7	163.9	68.6	-83.9	0	0	0	108	P577 F657	Y575-P577 HydrophobicContact CD2-CG 4.09Å; Y575-P577 HydrophobicContact CE2-CG 3.8Å; Y575-P577 WeakPolarHBondContact O-CD 3.44Å; Y575-F657 WeakPolarHBondContact CD1-O 3.49Å; Y575-F657 VanDerWaalsContact CE1-CA 3.46Å; Y575-F657 HydrophobicContact CE1-CB 4.32Å; Y575-F657 WeakPolarHBondContact CE1-O 3.26Å; Y575-F657 HydrophobicContact CE2-CD1 4.31Å; Y575-F657 PolarHBondContact N-O 3.37Å; Y575-F657 WeakPolarHBondContact O-CB 3.46Å
576	V	75.4	Confident	82.3	Confident	68 Å²	68	69 Å²	69	41%	0.412	35%	0.347	S	S	.	.			trans	-105.7	105.1	-179.8	-173.1	0	0	0	0	108.9	V578 R581 F584	V576-V578 PolarHBondContact O-N 3.42Å; V576-R581 HydrophobicContact CG1-CG 3.83Å; V576-F584 HydrophobicContact CG1-CB 4.38Å; V576-F584 HydrophobicContact CG1-CD1 4.09Å; V576-F584 HydrophobicContact CG1-CG 4.11Å; V576-F584 HydrophobicContact CG2-CD1 3.79Å; V576-F584 HydrophobicContact CG2-CD2 4.16Å; V576-F584 HydrophobicContact CG2-CE1 3.54Å; V576-F584 HydrophobicContact CG2-CE2 3.96Å; V576-F584 HydrophobicContact CG2-CG 4.09Å; V576-F584 HydrophobicContact CG2-CZ 3.64Å
577	P	69.5	Low	81.7	Confident	30 Å²	30	69.4 Å²	69.4	20%	0.195	35%	0.349	C	S	.	.			trans	-65.5	128.9	169.4	-9.1	23.4	0	0	0	108.9	Y575 E579 K580 R581 F657	Y575-P577 HydrophobicContact CD2-CG 4.09Å; Y575-P577 HydrophobicContact CE2-CG 3.8Å; Y575-P577 WeakPolarHBondContact O-CD 3.44Å; P577-E579 PolarHBondContact O-N 3.48Å; P577-K580 HydrophobicContact CB-CB 4.14Å; P577-K580 HydrophobicContact CG-CB 4.23Å; P577-K580 CarbonylContact O-C 3.5Å; P577-K580 PolarHBondContact O-N 3.42Å; P577-R581 PolarHBondContact O-N 2.97Å; P577-F657 HydrophobicContact CG-CD1 3.56Å; P577-F657 HydrophobicContact CG-CE1 3.67Å
578	V	67.8	Low	81.1	Confident	113 Å²	113	71 Å²	71	69%	0.685	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-55.4	-39.4	-179.6	-179.1	0	0	0	0	111.2	V576 K580	V576-V578 PolarHBondContact O-N 3.42Å; V578-K580 VanDerWaalsContact C-N 3.32Å; V578-K580 PolarHBondContact O-N 3.08Å
579	E	73.5	Confident	80.7	Confident	188 Å²	188	73 Å²	73	88%	0.879	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-70.9	-22.1	-178.9	-63.2	160.4	-163	0	0	114	P577	P577-E579 PolarHBondContact O-N 3.48Å
580	K	77.6	Confident	80.6	Confident	79 Å²	79	75.7 Å²	75.7	34%	0.343	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-121.4	30.1	-171.2	-69	175.2	163.5	-76.9	0	112.5	P577 V578 N582 E583 F584 F657	P577-K580 HydrophobicContact CB-CB 4.14Å; P577-K580 HydrophobicContact CG-CB 4.23Å; P577-K580 CarbonylContact O-C 3.5Å; P577-K580 PolarHBondContact O-N 3.42Å; V578-K580 VanDerWaalsContact C-N 3.32Å; V578-K580 PolarHBondContact O-N 3.08Å; K580-N582 VanDerWaalsContact C-N 3.28Å; K580-N582 PolarHBondContact O-N 3.3Å; K580-E583 HydrophobicContact CB-CB 4.33Å; K580-E583 IonicContact NZ-OE1 3.02Å; K580-E583 PolarHBondContact NZ-OE1 2.96Å; K580-E583 IonicContact NZ-OE2 3.42Å; K580-E583 PolarHBondContact NZ-OE2 3.45Å; K580-E583 PolarHBondContact O-N 3.5Å; K580-F584 WeakPolarHBondContact O-CB 3.34Å; K580-F584 PolarHBondContact O-N 3.43Å; K580-F657 HydrophobicContact CB-CE1 4.18Å; K580-F657 HydrophobicContact CB-CZ 4.07Å; K580-F657 HydrophobicContact CD-CE1 3.89Å; K580-F657 HydrophobicContact CD-CZ 4.09Å
581	R	74.1	Confident	80.8	Confident	161 Å²	161	75.9 Å²	75.9	61%	0.608	38%	0.382	S	S	*	.	H	α-helix	trans	-57.4	-36.8	-178.8	-80.2	-177.1	177.1	-173.7	1.2	113.5	V576 P577 F584 S585	V576-R581 HydrophobicContact CG1-CG 3.83Å; P577-R581 PolarHBondContact O-N 2.97Å; R581-F584 WeakPolarHBondContact O-CB 3.29Å; R581-F584 PolarHBondContact O-N 3.37Å; R581-S585 PolarHBondContact O-N 3.23Å
582	N	77.9	Confident	81.1	Confident	141 Å²	141	78.4 Å²	78.4	75%	0.754	39%	0.387	S	S	*	.	H	α-helix	trans	-70.2	-48.7	178.7	-64.4	-9.8	0	0	0	111.1	K580 F584 S585	K580-N582 VanDerWaalsContact C-N 3.28Å; K580-N582 PolarHBondContact O-N 3.3Å; N582-F584 PolarHBondContact O-N 2.73Å; N582-S585 PolarHBondContact O-N 3.12Å; N582-S585 VanDerWaalsContact O-N 3.1Å
583	E	81.7	Confident	81.5	Confident	89 Å²	89	77.7 Å²	77.7	42%	0.416	38%	0.378	S	S	.	.	H	α-helix	trans	-56.9	-33.3	174	-63.2	177	-149.5	0	0	112	K580 D586 V587 F657	K580-E583 HydrophobicContact CB-CB 4.33Å; K580-E583 IonicContact NZ-OE1 3.02Å; K580-E583 PolarHBondContact NZ-OE1 2.96Å; K580-E583 IonicContact NZ-OE2 3.42Å; K580-E583 PolarHBondContact NZ-OE2 3.45Å; K580-E583 PolarHBondContact O-N 3.5Å; E583-D586 PolarHBondContact O-N 3.16Å; E583-V587 WeakPolarHBondContact O-CG2 3.41Å; E583-V587 PolarHBondContact O-N 3.15Å; E583-V587 VanDerWaalsContact O-N 3.08Å; E583-F657 HydrophobicContact CB-CE2 3.96Å; E583-F657 HydrophobicContact CB-CZ 3.94Å
584	F	81.2	Confident	81.8	Confident	20 Å²	20	82.2 Å²	82.2	9%	0.088	41%	0.408	C	S	.	.	H	α-helix	trans	-62.6	-41.4	178.5	176.9	-102	0	0	0	112.3	F574 V576 K580 R581 N582 D586 V587 Q588 F657	F574-F584 HydrophobicContact CB-CE2 3.74Å; F574-F584 HydrophobicContact CB-CZ 3.84Å; F574-F584 AromaticContact CD1-CE2 3.97Å; F574-F584 HydrophobicContact CD1-CE2 3.97Å; F574-F584 HydrophobicContact CD1-CZ 4.47Å; F574-F584 HydrophobicContact CG-CE2 4.04Å; F574-F584 HydrophobicContact CG-CZ 4.16Å; V576-F584 HydrophobicContact CG1-CB 4.38Å; V576-F584 HydrophobicContact CG1-CD1 4.09Å; V576-F584 HydrophobicContact CG1-CG 4.11Å; V576-F584 HydrophobicContact CG2-CD1 3.79Å; V576-F584 HydrophobicContact CG2-CD2 4.16Å; V576-F584 HydrophobicContact CG2-CE1 3.54Å; V576-F584 HydrophobicContact CG2-CE2 3.96Å; V576-F584 HydrophobicContact CG2-CG 4.09Å; V576-F584 HydrophobicContact CG2-CZ 3.64Å; K580-F584 WeakPolarHBondContact O-CB 3.34Å; K580-F584 PolarHBondContact O-N 3.43Å; R581-F584 WeakPolarHBondContact O-CB 3.29Å; R581-F584 PolarHBondContact O-N 3.37Å; N582-F584 PolarHBondContact O-N 2.73Å; F584-D586 PolarHBondContact O-N 3.43Å; F584-V587 PolarHBondContact O-N 3.32Å; F584-Q588 HydrophobicContact CE1-CB 4.4Å; F584-Q588 HydrophobicContact CZ-CB 4.31Å; F584-Q588 HydrophobicContact CZ-CG 4.32Å; F584-Q588 VanDerWaalsContact O-CB 3.26Å; F584-Q588 WeakPolarHBondContact O-CB 3.13Å; F584-Q588 PolarHBondContact O-N 3.28Å; F584-F657 HydrophobicContact CB-CD2 4.29Å; F584-F657 HydrophobicContact CB-CE2 4.46Å; F584-F657 HydrophobicContact CD2-CB 3.83Å; F584-F657 AromaticContact CD2-CD2 3.92Å; F584-F657 HydrophobicContact CD2-CD2 3.92Å; F584-F657 HydrophobicContact CD2-CG 4.07Å; F584-F657 HydrophobicContact CE2-CB 4.18Å
585	S	79	Confident	82	Confident	74 Å²	74	82 Å²	82	52%	0.517	41%	0.411	S	S	.	.	H	α-helix	trans	-61.6	-43.9	178.9	-164.7	0	0	0	0	111.6	R581 N582 V587 Q588 S589	R581-S585 PolarHBondContact O-N 3.23Å; N582-S585 PolarHBondContact O-N 3.12Å; N582-S585 VanDerWaalsContact O-N 3.1Å; S585-V587 VanDerWaalsContact C-N 3.34Å; S585-V587 PolarHBondContact O-N 2.83Å; S585-Q588 PolarHBondContact O-N 2.96Å; S585-S589 PolarHBondContact O-N 3.43Å
586	D	84.2	Confident	82.7	Confident	104 Å²	104	77.5 Å²	77.5	56%	0.556	39%	0.393	S	S	*	.	H	α-helix	trans	-66.6	-34	177.8	-64.9	-27.4	0	0	0	113.1	E583 F584 S589 R590	E583-D586 PolarHBondContact O-N 3.16Å; F584-D586 PolarHBondContact O-N 3.43Å; D586-S589 PolarHBondContact O-OG 3.37Å; D586-R590 WeakPolarHBondContact O-CG 3.47Å
587	V	84.5	Confident	83.6	Confident	8 Å²	8	74.8 Å²	74.8	5%	0.048	38%	0.376	C	S	.	.	H	α-helix	trans	-73.2	-43.2	175.9	163.9	0	0	0	0	111	E583 F584 S585 S589 R590 F591 N656 F657	E583-V587 WeakPolarHBondContact O-CG2 3.41Å; E583-V587 PolarHBondContact O-N 3.15Å; E583-V587 VanDerWaalsContact O-N 3.08Å; F584-V587 PolarHBondContact O-N 3.32Å; S585-V587 VanDerWaalsContact C-N 3.34Å; S585-V587 PolarHBondContact O-N 2.83Å; V587-S589 VanDerWaalsContact C-N 3.31Å; V587-S589 PolarHBondContact O-N 3.29Å; V587-R590 WeakPolarHBondContact O-CB 3.22Å; V587-R590 PolarHBondContact O-N 3.3Å; V587-F591 HydrophobicContact CG1-CE2 4.45Å; V587-F591 WeakPolarHBondContact O-CD2 3.21Å; V587-N656 VanDerWaalsContact CG1-C 3.47Å; V587-N656 VanDerWaalsContact CG1-CA 3.43Å; V587-N656 HydrophobicContact CG1-CB 4.02Å; V587-N656 VanDerWaalsContact CG1-O 3.29Å; V587-N656 WeakPolarHBondContact CG1-O 3.38Å; V587-F657 HydrophobicContact CB-CD2 3.84Å; V587-F657 HydrophobicContact CB-CE2 4.12Å; V587-F657 HydrophobicContact CG1-CD2 3.87Å; V587-F657 HydrophobicContact CG2-CD2 3.83Å; V587-F657 HydrophobicContact CG2-CE2 3.68Å
588	Q	82.6	Confident	84.9	Confident	35 Å²	35	73.4 Å²	73.4	16%	0.164	37%	0.367	C	S	.	.	H	α-helix	trans	-64.5	-38.9	-178.4	-168.1	-179.6	33.7	0	0	111	F584 S585 R590 F591 Q759	F584-Q588 HydrophobicContact CE1-CB 4.4Å; F584-Q588 HydrophobicContact CZ-CB 4.31Å; F584-Q588 HydrophobicContact CZ-CG 4.32Å; F584-Q588 VanDerWaalsContact O-CB 3.26Å; F584-Q588 WeakPolarHBondContact O-CB 3.13Å; F584-Q588 PolarHBondContact O-N 3.28Å; S585-Q588 PolarHBondContact O-N 2.96Å; Q588-R590 PolarHBondContact O-N 2.99Å; Q588-F591 PolarHBondContact O-N 3.01Å; Q588-Q759 VanDerWaalsContact CD-NE2 3.32Å
589	S	84.9	Confident	86.2	Confident	65 Å²	65	68.1 Å²	68.1	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-58.9	-27.9	177.8	73	0	0	0	0	113.5	S585 D586 V587 F591 R592	S585-S589 PolarHBondContact O-N 3.43Å; D586-S589 PolarHBondContact O-OG 3.37Å; V587-S589 VanDerWaalsContact C-N 3.31Å; V587-S589 PolarHBondContact O-N 3.29Å; S589-F591 PolarHBondContact O-N 2.85Å; S589-R592 VanDerWaalsContact O-CB 3.3Å; S589-R592 WeakPolarHBondContact O-CB 3.36Å; S589-R592 PolarHBondContact O-N 3.46Å
590	R	88.6	Confident	87.3	Confident	171 Å²	171	59.4 Å²	59.4	65%	0.645	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.7	176.3	-60.8	172.3	-172	176.6	-0.5	113.9	D586 V587 Q588	D586-R590 WeakPolarHBondContact O-CG 3.47Å; V587-R590 WeakPolarHBondContact O-CB 3.22Å; V587-R590 PolarHBondContact O-N 3.3Å; Q588-R590 PolarHBondContact O-N 2.99Å
591	F	91.4	Very high	88.1	Confident	17 Å²	17	56.4 Å²	56.4	8%	0.075	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	2.9	179.2	-60.5	-76.6	0	0	0	112.8	F574 V587 Q588 S589 S600 V604 W652 N656 I658	F574-F591 HydrophobicContact CE1-CD2 4.11Å; F574-F591 HydrophobicContact CE1-CE2 4.44Å; F574-F591 HydrophobicContact CZ-CB 4.38Å; F574-F591 AromaticContact CZ-CD2 3.96Å; F574-F591 HydrophobicContact CZ-CD2 3.96Å; F574-F591 HydrophobicContact CZ-CG 4.36Å; V587-F591 HydrophobicContact CG1-CE2 4.45Å; V587-F591 WeakPolarHBondContact O-CD2 3.21Å; Q588-F591 PolarHBondContact O-N 3.01Å; S589-F591 PolarHBondContact O-N 2.85Å; F591-S600 VanDerWaalsContact O-CA 3.29Å; F591-S600 WeakPolarHBondContact O-CA 3.3Å; F591-S600 WeakPolarHBondContact O-CB 3.36Å; F591-S600 PolarHBondContact O-OG 3.4Å; F591-V604 HydrophobicContact CB-CG2 3.68Å; F591-V604 HydrophobicContact CD1-CB 4.37Å; F591-V604 HydrophobicContact CD1-CG2 3.82Å; F591-V604 HydrophobicContact CD2-CG2 4.43Å; F591-V604 HydrophobicContact CG-CG2 3.72Å; F591-W652 HydrophobicContact CE1-CH2 4.1Å; F591-W652 AromaticContact CE1-CZ2 3.92Å; F591-W652 HydrophobicContact CE1-CZ2 3.92Å; F591-W652 AromaticContact CZ-CH2 3.92Å; F591-W652 HydrophobicContact CZ-CH2 3.92Å; F591-W652 AromaticContact CZ-CZ2 3.7Å; F591-W652 HydrophobicContact CZ-CZ2 3.7Å; F591-N656 HydrophobicContact CE2-CB 4.02Å; F591-N656 HydrophobicContact CZ-CB 4.18Å; F591-I658 HydrophobicContact CE2-CD1 4.17Å; F591-I658 HydrophobicContact CZ-CD1 4.1Å
592	R	90.8	Very high	89.2	Confident	87 Å²	87	48.8 Å²	48.8	33%	0.328	25%	0.254	S	S	.	.			trans	-74.3	132.3	-179.5	179.5	167.3	-171.8	-179.1	6.4	110.6	S589 Q759 S763	S589-R592 VanDerWaalsContact O-CB 3.3Å; S589-R592 WeakPolarHBondContact O-CB 3.36Å; S589-R592 PolarHBondContact O-N 3.46Å; R592-Q759 HydrophobicContact CG-CB 4.13Å; R592-Q759 PolarHBondContact NE-O 2.9Å; R592-Q759 PolarHBondContact NH2-O 3.22Å; R592-S763 VanDerWaalsContact NH2-N 3.1Å; R592-S763 PolarHBondContact NH2-OG 3.41Å
593	H	93.6	Very high	90	Very high	45 Å²	45	44.4 Å²	44.4	21%	0.208	23%	0.23	C	C	.	.			trans	-116.5	136.2	170	-165.9	-88.4	0	0	0	110.3	S595 G596 V599 S600 L603	H593-S595 PolarHBondContact CE1-OG 3.21Å; H593-S595 WeakPolarHBondContact ND1-CB 3.28Å; H593-S595 PolarHBondContact ND1-N 3.21Å; H593-S595 VanDerWaalsContact ND1-N 3.17Å; H593-S595 PolarHBondContact ND1-OG 3.36Å; H593-S595 VanDerWaalsContact ND1-OG 3.12Å; H593-S595 PolarHBondContact O-N 2.59Å; H593-G596 PolarHBondContact O-N 3.04Å; H593-V599 HydrophobicContact CB-CB 3.86Å; H593-V599 HydrophobicContact CB-CG1 3.81Å; H593-S600 PolarHBondContact N-OG 3.23Å; H593-L603 HydrophobicContact CB-CD1 4.07Å
594	P	91.6	Very high	90.7	Very high	100 Å²	100	40.2 Å²	40.2	65%	0.649	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-33.4	-179.2	-27.5	35.3	0	0	0	114.5	G596 L760 I804	P594-G596 PolarHBondContact O-N 3.01Å; P594-L760 WeakPolarHBondContact O-CD2 3.46Å; P594-I804 VanDerWaalsContact O-CD1 3.31Å; P594-I804 WeakPolarHBondContact O-CD1 3.23Å
595	S	92.1	Very high	91.4	Very high	32 Å²	32	40 Å²	40	22%	0.224	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-15.2	177	-44.1	0	0	0	0	114.4	H593 S803 I804	H593-S595 PolarHBondContact CE1-OG 3.21Å; H593-S595 WeakPolarHBondContact ND1-CB 3.28Å; H593-S595 PolarHBondContact ND1-N 3.21Å; H593-S595 VanDerWaalsContact ND1-N 3.17Å; H593-S595 PolarHBondContact ND1-OG 3.36Å; H593-S595 VanDerWaalsContact ND1-OG 3.12Å; H593-S595 PolarHBondContact O-N 2.59Å; S595-S803 WeakPolarHBondContact O-CA 3.44Å; S595-I804 PolarHBondContact O-N 3.01Å
596	G	94.1	Very high	92.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.199	C	C	.	.	B	Isolated β-bridge	trans	119.8	-163.5	174.1	0	0	0	0	0	116.3	H593 P594 L598 S600 V802	H593-G596 PolarHBondContact O-N 3.04Å; P594-G596 PolarHBondContact O-N 3.01Å; G596-L598 PolarHBondContact O-N 3.47Å; G596-S600 WeakPolarHBondContact O-CB 3.38Å; G596-S600 PolarHBondContact O-N 2.95Å; G596-S600 VanDerWaalsContact O-N 3.12Å; G596-S600 PolarHBondContact O-OG 3.08Å; G596-V802 CarbonylContact C-O 3.6Å; G596-V802 WeakPolarHBondContact CA-O 3.34Å
597	D	95.1	Very high	92.7	Very high	12 Å²	12	36.2 Å²	36.2	6%	0.064	18%	0.182	C	C	.	.	H	α-helix	trans	-68.5	-35.7	-165.8	-68.9	-27.4	0	0	0	113.3	V599 S600 L601 S758 Q759 H801 V802	D597-V599 PolarHBondContact O-N 3.32Å; D597-S600 WeakPolarHBondContact O-CB 3.13Å; D597-S600 PolarHBondContact O-N 3.32Å; D597-L601 WeakPolarHBondContact O-CG 3.35Å; D597-L601 PolarHBondContact O-N 3.26Å; D597-S758 VanDerWaalsContact CG-OG 3.27Å; D597-S758 PolarHBondContact OD1-OG 2.92Å; D597-S758 WeakPolarHBondContact OD2-CB 3.42Å; D597-S758 PolarHBondContact OD2-OG 3.29Å; D597-Q759 VanDerWaalsContact OD1-CB 3.3Å; D597-Q759 WeakPolarHBondContact OD1-CB 3.44Å; D597-Q759 WeakPolarHBondContact OD1-CG 3.21Å; D597-Q759 PolarHBondContact OD1-N 3Å; D597-H801 WeakPolarHBondContact OD2-CA 3.47Å; D597-H801 PolarHBondContact OD2-N 2.86Å; D597-V802 WeakPolarHBondContact CB-O 3.13Å; D597-V802 PolarHBondContact N-O 3.01Å; D597-V802 PolarHBondContact OD2-N 3.46Å
598	L	95.7	Very high	93.1	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-45.4	-178.4	-65.3	177.5	0	0	0	111.6	I564 L568 G596 L602 F700 I775 H801 S803	I564-L598 HydrophobicContact CG2-CB 4.37Å; I564-L598 HydrophobicContact CG2-CD2 3.79Å; L568-L598 HydrophobicContact CD1-CD2 4.24Å; L568-L598 HydrophobicContact CD2-CD2 4.32Å; G596-L598 PolarHBondContact O-N 3.47Å; L598-L602 PolarHBondContact O-N 2.94Å; L598-F700 HydrophobicContact CD1-CD2 3.65Å; L598-F700 HydrophobicContact CD1-CE2 3.77Å; L598-F700 HydrophobicContact CD1-CG 4.14Å; L598-F700 HydrophobicContact CD1-CZ 4.34Å; L598-F700 HydrophobicContact CD2-CE2 4.24Å; L598-F700 HydrophobicContact CD2-CZ 4.13Å; L598-I775 HydrophobicContact CD2-CG1 4.05Å; L598-H801 HydrophobicContact CD2-CB 4.5Å; L598-S803 WeakPolarHBondContact CD1-OG 3.12Å; L598-S803 VanDerWaalsContact CG-OG 3.27Å; L598-S803 WeakPolarHBondContact CG-OG 3.42Å
599	V	96.3	Very high	93.6	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-71.7	-35.8	176.6	-172	0	0	0	0	110.4	H593 D597 L601 L602 L603 V693 I696	H593-V599 HydrophobicContact CB-CB 3.86Å; H593-V599 HydrophobicContact CB-CG1 3.81Å; D597-V599 PolarHBondContact O-N 3.32Å; V599-L601 PolarHBondContact O-N 2.87Å; V599-L602 VanDerWaalsContact O-CB 3.32Å; V599-L602 WeakPolarHBondContact O-CB 3.26Å; V599-L602 PolarHBondContact O-N 3.16Å; V599-L602 VanDerWaalsContact O-N 3.14Å; V599-L603 WeakPolarHBondContact O-CG 3.3Å; V599-L603 PolarHBondContact O-N 2.95Å; V599-V693 HydrophobicContact CG1-CB 4.46Å; V599-V693 HydrophobicContact CG1-CG1 4.14Å; V599-V693 HydrophobicContact CG2-CB 4.18Å; V599-I696 HydrophobicContact CG2-CD1 4.33Å
600	S	95.4	Very high	93.9	Very high	5 Å²	5	37.8 Å²	37.8	4%	0.035	18%	0.182	C	C	.	.	H	α-helix	trans	-60.6	-43.7	174.6	-56.1	0	0	0	0	112	F591 H593 G596 D597 L602 L603 V604	F591-S600 VanDerWaalsContact O-CA 3.29Å; F591-S600 WeakPolarHBondContact O-CA 3.3Å; F591-S600 WeakPolarHBondContact O-CB 3.36Å; F591-S600 PolarHBondContact O-OG 3.4Å; H593-S600 PolarHBondContact N-OG 3.23Å; G596-S600 WeakPolarHBondContact O-CB 3.38Å; G596-S600 PolarHBondContact O-N 2.95Å; G596-S600 VanDerWaalsContact O-N 3.12Å; G596-S600 PolarHBondContact O-OG 3.08Å; D597-S600 WeakPolarHBondContact O-CB 3.13Å; D597-S600 PolarHBondContact O-N 3.32Å; S600-L602 VanDerWaalsContact C-N 3.31Å; S600-L602 PolarHBondContact O-N 3.02Å; S600-L603 WeakPolarHBondContact O-CB 3.21Å; S600-L603 PolarHBondContact O-N 3.41Å; S600-L603 VanDerWaalsContact O-N 3.13Å; S600-V604 WeakPolarHBondContact O-CG2 3.4Å; S600-V604 PolarHBondContact O-N 3.46Å
601	L	95.5	Very high	94	Very high	15 Å²	15	30.1 Å²	30.1	8%	0.079	16%	0.155	C	C	.	.	H	α-helix	trans	-61.4	-37.6	173.7	-73.2	174.6	0	0	0	112.4	M567 L568 V573 D597 V599 V604 Y605	M567-L601 HydrophobicContact CB-CB 4.13Å; M567-L601 HydrophobicContact CB-CD1 4.47Å; M567-L601 HydrophobicContact CB-CD2 4.43Å; M567-L601 HydrophobicContact CE-CD2 4.26Å; L568-L601 HydrophobicContact CD2-CD1 3.78Å; L568-L601 HydrophobicContact CG-CD1 4.35Å; V573-L601 HydrophobicContact CG2-CD2 4.13Å; D597-L601 WeakPolarHBondContact O-CG 3.35Å; D597-L601 PolarHBondContact O-N 3.26Å; V599-L601 PolarHBondContact O-N 2.87Å; L601-V604 PolarHBondContact O-N 3.03Å; L601-Y605 PolarHBondContact O-N 2.78Å
602	L	96.6	Very high	93.7	Very high	2 Å²	2	30.6 Å²	30.6	1%	0.01	16%	0.16	C	C	.	.	H	α-helix	trans	-62.9	-41.5	173.5	177.1	67	0	0	0	111.6	E560 I564 L598 V599 S600 Y605 R606 I696	E560-L602 HydrophobicContact CB-CD1 4.25Å; E560-L602 HydrophobicContact CB-CD2 3.92Å; E560-L602 HydrophobicContact CG-CD1 4.2Å; E560-L602 HydrophobicContact CG-CD2 3.53Å; I564-L602 HydrophobicContact CD1-CB 4.2Å; I564-L602 HydrophobicContact CG1-CB 3.91Å; L598-L602 PolarHBondContact O-N 2.94Å; V599-L602 VanDerWaalsContact O-CB 3.32Å; V599-L602 WeakPolarHBondContact O-CB 3.26Å; V599-L602 PolarHBondContact O-N 3.16Å; V599-L602 VanDerWaalsContact O-N 3.14Å; S600-L602 VanDerWaalsContact C-N 3.31Å; S600-L602 PolarHBondContact O-N 3.02Å; L602-Y605 PolarHBondContact O-N 2.81Å; L602-R606 HydrophobicContact CD1-CG 4.3Å; L602-R606 HydrophobicContact CG-CG 4.49Å; L602-R606 WeakPolarHBondContact O-CB 3.24Å; L602-R606 WeakPolarHBondContact O-CG 3.35Å; L602-R606 PolarHBondContact O-N 3.42Å; L602-I696 HydrophobicContact CD2-CD1 3.89Å
603	L	96	Very high	93.5	Very high	49 Å²	49	30 Å²	30	26%	0.257	16%	0.159	S	C	.	.	H	α-helix	trans	-62.7	-43.8	175.5	-66.3	179.2	0	0	0	111.6	H593 V599 S600 Y605 R606 G607	H593-L603 HydrophobicContact CB-CD1 4.07Å; V599-L603 WeakPolarHBondContact O-CG 3.3Å; V599-L603 PolarHBondContact O-N 2.95Å; S600-L603 WeakPolarHBondContact O-CB 3.21Å; S600-L603 PolarHBondContact O-N 3.41Å; S600-L603 VanDerWaalsContact O-N 3.13Å; L603-Y605 VanDerWaalsContact C-N 3.35Å; L603-Y605 PolarHBondContact O-N 3.44Å; L603-R606 PolarHBondContact O-N 3.3Å; L603-G607 PolarHBondContact O-N 2.98Å
604	V	95.2	Very high	92.9	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-57.6	-47.8	174.2	176.7	0	0	0	0	110.9	M567 V573 F574 F591 S600 L601 G607 F608 I658 L663	M567-V604 HydrophobicContact CE-CB 3.94Å; M567-V604 HydrophobicContact CE-CG1 3.69Å; V573-V604 HydrophobicContact CG2-CG1 4.23Å; F574-V604 HydrophobicContact CE2-CG2 4.03Å; F574-V604 HydrophobicContact CZ-CG2 3.65Å; F591-V604 HydrophobicContact CB-CG2 3.68Å; F591-V604 HydrophobicContact CD1-CB 4.37Å; F591-V604 HydrophobicContact CD1-CG2 3.82Å; F591-V604 HydrophobicContact CD2-CG2 4.43Å; F591-V604 HydrophobicContact CG-CG2 3.72Å; S600-V604 WeakPolarHBondContact O-CG2 3.4Å; S600-V604 PolarHBondContact O-N 3.46Å; L601-V604 PolarHBondContact O-N 3.03Å; V604-G607 PolarHBondContact O-N 2.93Å; V604-F608 PolarHBondContact O-N 2.68Å; V604-I658 HydrophobicContact CG1-CD1 3.85Å; V604-I658 HydrophobicContact CG1-CG1 4.43Å; V604-L663 HydrophobicContact CG1-CD1 4.36Å
605	Y	96.3	Very high	92.1	Very high	16 Å²	16	28.6 Å²	28.6	6%	0.063	15%	0.153	C	C	.	.	H	α-helix	trans	-61.9	-47.4	178.7	-177.1	-91.3	0	0	0	112	M567 L601 L602 L603 F608 V609 A666 V667 R670	M567-Y605 HydrophobicContact CG-CD2 4.08Å; M567-Y605 HydrophobicContact CG-CG 4.33Å; M567-Y605 HydrophobicContact SD-CD2 3.82Å; M567-Y605 HydrophobicContact SD-CG 4.38Å; L601-Y605 PolarHBondContact O-N 2.78Å; L602-Y605 PolarHBondContact O-N 2.81Å; L603-Y605 VanDerWaalsContact C-N 3.35Å; L603-Y605 PolarHBondContact O-N 3.44Å; Y605-F608 PolarHBondContact O-N 3.23Å; Y605-V609 HydrophobicContact CD1-CG2 4.07Å; Y605-V609 HydrophobicContact CE1-CG2 3.53Å; Y605-V609 HydrophobicContact CE2-CG2 4.33Å; Y605-V609 WeakPolarHBondContact O-CG2 3.49Å; Y605-V609 PolarHBondContact O-N 2.84Å; Y605-A666 HydrophobicContact CD2-CB 4.44Å; Y605-A666 HydrophobicContact CE2-CB 4.44Å; Y605-V667 HydrophobicContact CE2-CG2 3.85Å; Y605-R670 WeakPolarHBondContact OH-CD 3.49Å
606	R	95.4	Very high	90.9	Very high	78 Å²	78	35.8 Å²	35.8	29%	0.294	18%	0.175	S	C	.	.	H	α-helix	trans	-61.9	-43.3	178.3	-76	178	171.2	172.9	-3.2	111.4	E560 L602 L603 F608 V609 K610	E560-R606 IonicContact OE1-NH2 2.7Å; E560-R606 PolarHBondContact OE1-NH2 3.44Å; L602-R606 HydrophobicContact CD1-CG 4.3Å; L602-R606 HydrophobicContact CG-CG 4.49Å; L602-R606 WeakPolarHBondContact O-CB 3.24Å; L602-R606 WeakPolarHBondContact O-CG 3.35Å; L602-R606 PolarHBondContact O-N 3.42Å; L603-R606 PolarHBondContact O-N 3.3Å; R606-F608 PolarHBondContact O-N 2.9Å; R606-V609 PolarHBondContact O-N 3.13Å; R606-K610 WeakPolarHBondContact O-CB 3.34Å; R606-K610 PolarHBondContact O-N 3.42Å
607	G	94	Very high	89.6	Confident	20 Å²	20	39.4 Å²	39.4	21%	0.206	20%	0.2	C	C	.	.	H	α-helix	trans	-58.7	-45.6	175.5	0	0	0	0	0	112.3	L603 V604 K610 A611 W652	L603-G607 PolarHBondContact O-N 2.98Å; V604-G607 PolarHBondContact O-N 2.93Å; G607-K610 PolarHBondContact O-N 2.67Å; G607-A611 WeakPolarHBondContact O-CB 3.41Å; G607-A611 PolarHBondContact O-N 2.7Å; G607-W652 VanDerWaalsContact C-CZ2 3.45Å
608	F	94.1	Very high	87.8	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.009	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-48	176.2	178	-107.2	0	0	0	112.2	V604 Y605 R606 K610 A611 T612 K649 W652 C653 L663 E664 V667	V604-F608 PolarHBondContact O-N 2.68Å; Y605-F608 PolarHBondContact O-N 3.23Å; R606-F608 PolarHBondContact O-N 2.9Å; F608-K610 VanDerWaalsContact C-N 3.34Å; F608-K610 PolarHBondContact O-N 3.45Å; F608-A611 PolarHBondContact O-N 2.91Å; F608-T612 HydrophobicContact CE1-CG2 4.34Å; F608-T612 HydrophobicContact CE2-CG2 4.49Å; F608-T612 HydrophobicContact CZ-CG2 4.37Å; F608-T612 WeakPolarHBondContact O-CG2 3.36Å; F608-T612 PolarHBondContact O-N 2.89Å; F608-K649 HydrophobicContact CE2-CD 4.39Å; F608-K649 HydrophobicContact CE2-CG 4.23Å; F608-K649 HydrophobicContact CZ-CD 4.44Å; F608-W652 HydrophobicContact CB-CH2 4.05Å; F608-W652 HydrophobicContact CB-CZ3 3.75Å; F608-W652 HydrophobicContact CD2-CE3 4.13Å; F608-W652 AromaticContact CD2-CZ3 3.95Å; F608-W652 HydrophobicContact CD2-CZ3 3.95Å; F608-W652 HydrophobicContact CG-CZ3 4.37Å; F608-W652 VanDerWaalsContact N-CH2 3.35Å; F608-C653 VanDerWaalsContact CE2-SG 3.52Å; F608-L663 HydrophobicContact CB-CD1 4.01Å; F608-L663 HydrophobicContact CB-CG 4.41Å; F608-L663 HydrophobicContact CD1-CB 3.9Å; F608-L663 HydrophobicContact CD1-CD1 4.1Å; F608-L663 HydrophobicContact CD1-CG 4.32Å; F608-L663 HydrophobicContact CD2-CB 4Å; F608-L663 HydrophobicContact CD2-CG 4.19Å; F608-L663 HydrophobicContact CE1-CB 3.69Å; F608-L663 HydrophobicContact CE2-CB 3.8Å; F608-L663 HydrophobicContact CE2-CG 4.45Å; F608-L663 HydrophobicContact CG-CB 4.01Å; F608-L663 HydrophobicContact CG-CD1 4.02Å; F608-L663 HydrophobicContact CG-CG 4.07Å; F608-L663 HydrophobicContact CZ-CB 3.58Å; F608-E664 HydrophobicContact CZ-CG 4.12Å; F608-V667 HydrophobicContact CD1-CG2 4.19Å; F608-V667 HydrophobicContact CE1-CG2 3.85Å
609	V	93	Very high	85.7	Confident	30 Å²	30	53 Å²	53	18%	0.182	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-43.4	178.7	171.9	0	0	0	0	111	Y605 R606 T612 K613	Y605-V609 HydrophobicContact CD1-CG2 4.07Å; Y605-V609 HydrophobicContact CE1-CG2 3.53Å; Y605-V609 HydrophobicContact CE2-CG2 4.33Å; Y605-V609 WeakPolarHBondContact O-CG2 3.49Å; Y605-V609 PolarHBondContact O-N 2.84Å; R606-V609 PolarHBondContact O-N 3.13Å; V609-T612 PolarHBondContact O-N 3.32Å; V609-T612 VanDerWaalsContact O-N 3.14Å; V609-T612 PolarHBondContact O-OG1 3.08Å; V609-K613 HydrophobicContact CG1-CD 4.35Å; V609-K613 HydrophobicContact CG1-CG 4.43Å; V609-K613 PolarHBondContact O-N 2.91Å
610	K	92.1	Very high	83.6	Confident	108 Å²	108	56.8 Å²	56.8	47%	0.47	29%	0.288	S	S	.	.	H	α-helix	trans	-57.7	-51.7	175.6	-175.2	178.4	178	-178	0	111.2	R606 G607 F608 T612 K613 D614	R606-K610 WeakPolarHBondContact O-CB 3.34Å; R606-K610 PolarHBondContact O-N 3.42Å; G607-K610 PolarHBondContact O-N 2.67Å; F608-K610 VanDerWaalsContact C-N 3.34Å; F608-K610 PolarHBondContact O-N 3.45Å; K610-T612 PolarHBondContact O-N 3.44Å; K610-T612 VanDerWaalsContact O-N 3.15Å; K610-K613 PolarHBondContact O-N 3.09Å; K610-D614 PolarHBondContact O-N 3.24Å
611	A	89.4	Confident	81.6	Confident	10 Å²	10	62.6 Å²	62.6	8%	0.083	32%	0.317	C	S	.	.	H	α-helix	trans	-57	-33.5	176.3	0	0	0	0	0	112.9	G607 F608 A615 W652	G607-A611 WeakPolarHBondContact O-CB 3.41Å; G607-A611 PolarHBondContact O-N 2.7Å; F608-A611 PolarHBondContact O-N 2.91Å; A611-A615 PolarHBondContact O-N 3.21Å; A611-W652 HydrophobicContact CB-CB 4.01Å; A611-W652 HydrophobicContact CB-CD2 3.79Å; A611-W652 HydrophobicContact CB-CE3 4.43Å; A611-W652 HydrophobicContact CB-CG 3.56Å
612	T	86.3	Confident	79.3	Confident	27 Å²	27	69 Å²	69	17%	0.166	35%	0.351	C	S	.	.	H	α-helix	trans	-74.7	-31.4	173.8	68	0	0	0	0	114.5	F608 V609 K610 R616 K649	F608-T612 HydrophobicContact CE1-CG2 4.34Å; F608-T612 HydrophobicContact CE2-CG2 4.49Å; F608-T612 HydrophobicContact CZ-CG2 4.37Å; F608-T612 WeakPolarHBondContact O-CG2 3.36Å; F608-T612 PolarHBondContact O-N 2.89Å; V609-T612 PolarHBondContact O-N 3.32Å; V609-T612 VanDerWaalsContact O-N 3.14Å; V609-T612 PolarHBondContact O-OG1 3.08Å; K610-T612 PolarHBondContact O-N 3.44Å; K610-T612 VanDerWaalsContact O-N 3.15Å; T612-R616 WeakPolarHBondContact O-CG 3.43Å; T612-K649 HydrophobicContact CG2-CD 3.73Å; T612-K649 HydrophobicContact CG2-CG 4.05Å
613	K	85.3	Confident	77.1	Confident	75 Å²	75	74 Å²	74	33%	0.326	39%	0.387	S	S	.	.	H	α-helix	trans	-73.2	-43.7	176.8	-74.2	-175.3	179	-173.9	0	110.8	V609 K610 A615 R616 S617 D873	V609-K613 HydrophobicContact CG1-CD 4.35Å; V609-K613 HydrophobicContact CG1-CG 4.43Å; V609-K613 PolarHBondContact O-N 2.91Å; K610-K613 PolarHBondContact O-N 3.09Å; K613-A615 VanDerWaalsContact C-N 3.26Å; K613-A615 PolarHBondContact O-N 3.22Å; K613-R616 WeakPolarHBondContact O-CA 3.46Å; K613-R616 WeakPolarHBondContact O-CB 3.41Å; K613-R616 PolarHBondContact O-N 3.3Å; K613-S617 PolarHBondContact O-N 3.15Å; K613-S617 VanDerWaalsContact O-N 3.09Å; K613-S617 PolarHBondContact O-OG 3.16Å; K613-D873 IonicContact NZ-OD2 2.75Å
614	D	81.6	Confident	74.9	Confident	83 Å²	83	80.2 Å²	80.2	44%	0.444	41%	0.412	S	S	.	.	H	α-helix	trans	-60.9	-38	179.6	-62.1	-19	0	0	0	111.4	K610 R616 S617	K610-D614 PolarHBondContact O-N 3.24Å; D614-R616 PolarHBondContact O-N 3.25Å; D614-S617 PolarHBondContact O-N 3.48Å
615	A	73.8	Confident	72.4	Confident	33 Å²	33	86.7 Å²	86.7	27%	0.273	45%	0.446	S	S	.	.	H	α-helix	trans	-65.1	-17.7	172.4	0	0	0	0	0	114.3	A611 K613	A611-A615 PolarHBondContact O-N 3.21Å; K613-A615 VanDerWaalsContact C-N 3.26Å; K613-A615 PolarHBondContact O-N 3.22Å
616	R	68.6	Low	69.9	Low	182 Å²	182	95.4 Å²	95.4	69%	0.687	49%	0.487	S	S	*	.	H	α-helix	trans	-90.5	-41.7	175.1	-67.9	177	-178.2	-174.9	-0.5	112.1	T612 K613 D614 Q618 K619	T612-R616 WeakPolarHBondContact O-CG 3.43Å; K613-R616 WeakPolarHBondContact O-CA 3.46Å; K613-R616 WeakPolarHBondContact O-CB 3.41Å; K613-R616 PolarHBondContact O-N 3.3Å; D614-R616 PolarHBondContact O-N 3.25Å; R616-Q618 VanDerWaalsContact C-N 3.33Å; R616-Q618 PolarHBondContact O-N 2.87Å; R616-K619 WeakPolarHBondContact O-CB 3.42Å; R616-K619 PolarHBondContact O-N 3.32Å; R616-K619 VanDerWaalsContact O-N 3.08Å
617	S	65.5	Low	67.3	Low	77 Å²	77	96.5 Å²	96.5	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-63.1	-33.9	-174.5	-58.2	0	0	0	0	113.7	K613 D614 K619 S620	K613-S617 PolarHBondContact O-N 3.15Å; K613-S617 VanDerWaalsContact O-N 3.09Å; K613-S617 PolarHBondContact O-OG 3.16Å; D614-S617 PolarHBondContact O-N 3.48Å; S617-K619 PolarHBondContact O-N 3.35Å; S617-S620 PolarHBondContact O-N 3.34Å; S617-S620 VanDerWaalsContact O-N 3.13Å
618	Q	57.1	Low	65	Low	154 Å²	154	103.3 Å²	103.3	72%	0.72	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-12.9	175.2	-68.4	179.6	-10.2	0	0	114.1	R616	R616-Q618 VanDerWaalsContact C-N 3.33Å; R616-Q618 PolarHBondContact O-N 2.87Å
619	K	51.5	Low	62.3	Low	142 Å²	142	107.9 Å²	107.9	62%	0.617	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-23.8	173.4	-78.7	-178.6	172.4	-179.5	0	114.1	R616 S617	R616-K619 WeakPolarHBondContact O-CB 3.42Å; R616-K619 PolarHBondContact O-N 3.32Å; R616-K619 VanDerWaalsContact O-N 3.08Å; S617-K619 PolarHBondContact O-N 3.35Å
620	S	52	Low	59.7	Low	84 Å²	84	112.7 Å²	112.7	59%	0.587	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-22.1	-169.2	-172.4	0	0	0	0	114.1	S617	S617-S620 PolarHBondContact O-N 3.34Å; S617-S620 VanDerWaalsContact O-N 3.13Å
621	I	53.9	Low	57.3	Low	126 Å²	126	114.8 Å²	114.8	65%	0.646	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-34.3	-172.7	-61.6	173.6	0	0	0	111.1	S623	I621-S623 VanDerWaalsContact C-N 3.25Å; I621-S623 PolarHBondContact O-N 3.44Å
622	N	48	Very low	54.9	Low	149 Å²	149	121.9 Å²	121.9	80%	0.797	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	13.9	-176.2	-69.2	7.7	0	0	0	114.9
623	S	50.7	Low	52.5	Low	107 Å²	107	125.7 Å²	125.7	75%	0.748	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	4.7	-178.9	-140.9	0	0	0	0	114	I621	I621-S623 VanDerWaalsContact C-N 3.25Å; I621-S623 PolarHBondContact O-N 3.44Å
624	K	49.5	Very low	50.3	Low	181 Å²	181	127.3 Å²	127.3	79%	0.787	70%	0.695	S	S	*	*	S	Bend	trans	-115.5	-2.8	-177	-78.9	-172	173.8	-176.4	0	116
625	N	42.9	Very low	48.1	Very low	136 Å²	136	131 Å²	131	73%	0.727	71%	0.713	S	S	*	*			trans	-124.4	87.4	-178.7	-64.5	-3	0	0	0	110.5
626	H	43	Very low	46.3	Very low	199 Å²	199	137.8 Å²	137.8	92%	0.921	74%	0.739	S	S	*	*			trans	-165.5	82.9	157.1	-96.6	-40.3	0	0	0	110.5
627	S	41.5	Very low	44.4	Very low	101 Å²	101	134 Å²	134	71%	0.706	74%	0.74	S	S	*	*			trans	-135	141.1	157.7	49.9	0	0	0	0	106.8
628	Q	44.3	Very low	42.7	Very low	163 Å²	163	136.8 Å²	136.8	76%	0.762	76%	0.757	S	S	*	*			trans	72.8	98.1	-169.8	-86.1	82.8	12.3	0	0	114.8
629	S	38	Very low	41.6	Very low	98 Å²	98	134.6 Å²	134.6	69%	0.685	76%	0.758	S	S	*	*				73.4	116.8	86.2	72.9	0	0	0	0	111
630	T	38.7	Very low	40.8	Very low	132 Å²	132	137.2 Å²	137.2	81%	0.81	77%	0.77	S	S	*	*			cis	-167	143.1	49.7	27.3	0	0	0	0	110.1
631	I	41.4	Very low	39.8	Very low	152 Å²	152	138.9 Å²	138.9	78%	0.779	78%	0.78	S	S	*	*			trans	-11.1	121.2	152	-57.6	166.4	0	0	0	116
632	D	39.6	Very low	38.9	Very low	158 Å²	158	141.8 Å²	141.8	85%	0.845	79%	0.788	S	S	*	*				-154.9	142.5	125.9	-107.1	-19.1	0	0	0	113.1
633	S	35.6	Very low	38.3	Very low	108 Å²	108	141.8 Å²	141.8	76%	0.755	79%	0.785	S	S	*	*			trans	-92.5	126.6	-158.6	45.5	0	0	0	0	114.5
634	S	38.8	Very low	38.2	Very low	109 Å²	109	140.6 Å²	140.6	76%	0.762	78%	0.777	S	S	*	*			trans	-162.2	110.3	144.4	48.2	0	0	0	0	112.5
635	I	36.6	Very low	38	Very low	159 Å²	159	139.2 Å²	139.2	82%	0.815	77%	0.771	S	S	*	*				39.5	93.3	129.7	-50.3	166.9	0	0	0	116.7
636	Q	35.1	Very low	38.2	Very low	177 Å²	177	142.3 Å²	142.3	83%	0.827	77%	0.772	S	S	*	*				172.1	113.1	129.2	-94	167	30.1	0	0	112
637	S	29.3	Very low	39.1	Very low	102 Å²	102	136.8 Å²	136.8	71%	0.713	75%	0.749	S	S	*	*			trans	5.5	116.5	157.4	53	0	0	0	0	119.8
638	P	29.7	Very low	40.5	Very low	136 Å²	136	134.5 Å²	134.5	88%	0.883	73%	0.734	S	S	*	*			trans	-97	99	175.9	34	-27.8	0	0	0	112.5
639	S	33.5	Very low	42	Very low	107 Å²	107	128.8 Å²	128.8	75%	0.748	71%	0.706	S	S	*	*			trans	-145.2	42.1	173.7	63	0	0	0	0	114.5
640	K	35.2	Very low	44	Very low	197 Å²	197	126.3 Å²	126.3	86%	0.857	69%	0.685	S	S	*	*			trans	-136	6	-179.2	-88	-178.4	179.4	171.8	0	119
641	C	30.2	Very low	46.2	Very low	119 Å²	119	126.2 Å²	126.2	80%	0.804	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	43.9	-169.9	-149.6	0	0	0	0	117.3
642	K	34.6	Very low	48.5	Very low	187 Å²	187	121.7 Å²	121.7	81%	0.813	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116	-7.7	168.2	-75.6	-176.1	-179.4	172.3	0	114.9
643	M	35.4	Very low	50.8	Low	149 Å²	149	114.3 Å²	114.3	73%	0.734	61%	0.609	S	S	*	*	S	Bend	trans	-88.3	-27.8	-165.5	-135.6	88.4	76.2	0	0	115.3	K645	M643-K645 PolarHBondContact O-N 2.92Å
644	S	49.1	Very low	53.2	Low	83 Å²	83	117.4 Å²	117.4	58%	0.58	61%	0.605	S	S	*	*	G	3₁₀ helix	trans	-71.6	-30.1	-168.1	63.9	0	0	0	0	115	R646 N647	S644-R646 PolarHBondContact O-N 3.45Å; S644-N647 PolarHBondContact O-N 3.44Å
645	K	44.8	Very low	55.5	Low	151 Å²	151	115 Å²	115	66%	0.657	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-73.1	-23.7	-169.2	-62.9	176.8	-177.9	175.5	0	114.8	M643 N647	M643-K645 PolarHBondContact O-N 2.92Å; K645-N647 VanDerWaalsContact C-N 3.3Å
646	R	48.6	Very low	58.1	Low	202 Å²	202	108.1 Å²	108.1	76%	0.762	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-81.5	-12.7	-178.8	-146.5	173.6	-175.9	133.8	-1.8	112.1	S644 I650	S644-R646 PolarHBondContact O-N 3.45Å; R646-I650 WeakPolarHBondContact O-CD1 3.44Å
647	N	60.7	Low	60.6	Low	82 Å²	82	100.3 Å²	100.3	44%	0.439	52%	0.519	S	S	.	.	H	α-helix	trans	-81.2	-37.3	-170.3	-73	-14.7	0	0	0	114	S644 K645 K649 I650 Q651	S644-N647 PolarHBondContact O-N 3.44Å; K645-N647 VanDerWaalsContact C-N 3.3Å; N647-K649 PolarHBondContact O-N 2.93Å; N647-I650 PolarHBondContact O-N 3.44Å; N647-I650 VanDerWaalsContact O-N 3.14Å; N647-Q651 WeakPolarHBondContact O-CB 3.44Å; N647-Q651 PolarHBondContact O-N 3.16Å
648	S	70.6	Confident	63.4	Low	54 Å²	54	95.6 Å²	95.6	38%	0.378	49%	0.486	S	S	.	.	H	α-helix	trans	-58.5	-48.9	-171.9	172.7	0	0	0	0	114.4	I650 Q651 W652	S648-I650 PolarHBondContact O-N 3.19Å; S648-Q651 PolarHBondContact O-N 3.08Å; S648-W652 PolarHBondContact O-N 3.18Å
649	K	77.4	Confident	66.1	Low	43 Å²	43	90.7 Å²	90.7	19%	0.187	45%	0.453	C	S	.	.	H	α-helix	trans	-61.7	-42	176.4	-179.5	-178.7	-176.6	-177.3	0	112.6	F608 T612 N647 Q651 C653 E664	F608-K649 HydrophobicContact CE2-CD 4.39Å; F608-K649 HydrophobicContact CE2-CG 4.23Å; F608-K649 HydrophobicContact CZ-CD 4.44Å; T612-K649 HydrophobicContact CG2-CD 3.73Å; T612-K649 HydrophobicContact CG2-CG 4.05Å; N647-K649 PolarHBondContact O-N 2.93Å; K649-Q651 VanDerWaalsContact C-N 3.31Å; K649-C653 PolarHBondContact O-N 2.99Å; K649-C653 PolarHBondContact O-SG 2.88Å; K649-E664 IonicContact NZ-OE1 2.83Å; K649-E664 PolarHBondContact NZ-OE1 2.87Å
650	I	80.2	Confident	68.6	Low	46 Å²	46	89.1 Å²	89.1	24%	0.236	43%	0.43	C	S	.	.	H	α-helix	trans	-65.1	-43.1	178.8	-62.4	176.8	0	0	0	109.3	R646 N647 S648 C653 R654	R646-I650 WeakPolarHBondContact O-CD1 3.44Å; N647-I650 PolarHBondContact O-N 3.44Å; N647-I650 VanDerWaalsContact O-N 3.14Å; S648-I650 PolarHBondContact O-N 3.19Å; I650-C653 PolarHBondContact O-N 3.29Å; I650-R654 HydrophobicContact CG2-CG 4.36Å; I650-R654 WeakPolarHBondContact O-CB 3.34Å; I650-R654 VanDerWaalsContact O-CG 3.29Å; I650-R654 WeakPolarHBondContact O-CG 3.41Å; I650-R654 PolarHBondContact O-N 3.23Å
651	Q	83.7	Confident	70.8	Confident	130 Å²	130	80.9 Å²	80.9	61%	0.607	40%	0.397	S	S	*	.	H	α-helix	trans	-66.1	-43.7	-179.3	-171.8	174.7	3.4	0	0	111.4	N647 S648 K649 C653 R654 A655	N647-Q651 WeakPolarHBondContact O-CB 3.44Å; N647-Q651 PolarHBondContact O-N 3.16Å; S648-Q651 PolarHBondContact O-N 3.08Å; K649-Q651 VanDerWaalsContact C-N 3.31Å; Q651-C653 PolarHBondContact O-N 3.04Å; Q651-R654 PolarHBondContact O-N 2.72Å; Q651-A655 VanDerWaalsContact O-CB 3.22Å; Q651-A655 WeakPolarHBondContact O-CB 3.47Å; Q651-A655 PolarHBondContact O-N 3.08Å
652	W	89.7	Confident	73.5	Confident	56 Å²	56	76.3 Å²	76.3	21%	0.212	36%	0.363	C	S	.	.	H	α-helix	trans	-61	-46.5	175.3	-173.5	89.9	0	0	0	111.8	F591 G607 F608 A611 S648 R654 A655 N656 I658	F591-W652 HydrophobicContact CE1-CH2 4.1Å; F591-W652 AromaticContact CE1-CZ2 3.92Å; F591-W652 HydrophobicContact CE1-CZ2 3.92Å; F591-W652 AromaticContact CZ-CH2 3.92Å; F591-W652 HydrophobicContact CZ-CH2 3.92Å; F591-W652 AromaticContact CZ-CZ2 3.7Å; F591-W652 HydrophobicContact CZ-CZ2 3.7Å; G607-W652 VanDerWaalsContact C-CZ2 3.45Å; F608-W652 HydrophobicContact CB-CH2 4.05Å; F608-W652 HydrophobicContact CB-CZ3 3.75Å; F608-W652 HydrophobicContact CD2-CE3 4.13Å; F608-W652 AromaticContact CD2-CZ3 3.95Å; F608-W652 HydrophobicContact CD2-CZ3 3.95Å; F608-W652 HydrophobicContact CG-CZ3 4.37Å; F608-W652 VanDerWaalsContact N-CH2 3.35Å; A611-W652 HydrophobicContact CB-CB 4.01Å; A611-W652 HydrophobicContact CB-CD2 3.79Å; A611-W652 HydrophobicContact CB-CE3 4.43Å; A611-W652 HydrophobicContact CB-CG 3.56Å; S648-W652 PolarHBondContact O-N 3.18Å; W652-R654 VanDerWaalsContact C-N 3.35Å; W652-R654 PolarHBondContact O-N 2.98Å; W652-A655 PolarHBondContact O-N 3.34Å; W652-N656 PolarHBondContact NE1-ND2 2.98Å; W652-N656 WeakPolarHBondContact O-CB 3.19Å; W652-N656 PolarHBondContact O-N 3.2Å; W652-N656 PolarHBondContact O-ND2 2.95Å; W652-I658 HydrophobicContact CH2-CD1 3.59Å; W652-I658 HydrophobicContact CZ3-CD1 3.61Å
653	C	88.9	Confident	76.2	Confident	4 Å²	4	67.4 Å²	67.4	3%	0.027	33%	0.325	C	S	.	.	H	α-helix	trans	-62.6	-41	175.9	-71.5	0	0	0	0	112.4	F608 K649 I650 Q651 N656 F657 I658 R660	F608-C653 VanDerWaalsContact CE2-SG 3.52Å; K649-C653 PolarHBondContact O-N 2.99Å; K649-C653 PolarHBondContact O-SG 2.88Å; I650-C653 PolarHBondContact O-N 3.29Å; Q651-C653 PolarHBondContact O-N 3.04Å; C653-N656 PolarHBondContact O-N 2.85Å; C653-F657 PolarHBondContact O-N 3.04Å; C653-F657 VanDerWaalsContact O-N 3.15Å; C653-I658 PolarHBondContact O-N 3.17Å; C653-R660 HydrophobicContact CB-CB 4.09Å
654	R	85.9	Confident	78.8	Confident	173 Å²	173	63.2 Å²	63.2	65%	0.653	30%	0.303	S	S	*	.	H	α-helix	trans	-64.7	-48.5	177.5	-78.8	178.8	174.9	170.9	-4.1	111.9	I650 Q651 W652 N656 F657	I650-R654 HydrophobicContact CG2-CG 4.36Å; I650-R654 WeakPolarHBondContact O-CB 3.34Å; I650-R654 VanDerWaalsContact O-CG 3.29Å; I650-R654 WeakPolarHBondContact O-CG 3.41Å; I650-R654 PolarHBondContact O-N 3.23Å; Q651-R654 PolarHBondContact O-N 2.72Å; W652-R654 VanDerWaalsContact C-N 3.35Å; W652-R654 PolarHBondContact O-N 2.98Å; R654-N656 PolarHBondContact O-N 3.5Å; R654-F657 PolarHBondContact O-N 2.72Å
655	A	87.2	Confident	80.6	Confident	59 Å²	59	60.5 Å²	60.5	49%	0.488	28%	0.283	S	S	.	.	H	α-helix	trans	-64.1	-24.9	-179.8	0	0	0	0	0	113	Q651 W652	Q651-A655 VanDerWaalsContact O-CB 3.22Å; Q651-A655 WeakPolarHBondContact O-CB 3.47Å; Q651-A655 PolarHBondContact O-N 3.08Å; W652-A655 PolarHBondContact O-N 3.34Å
656	N	89.8	Confident	82.8	Confident	14 Å²	14	53.3 Å²	53.3	8%	0.075	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105	12.2	178.5	-66.2	-77.4	0	0	0	113.5	V587 F591 W652 C653 R654 I658	V587-N656 VanDerWaalsContact CG1-C 3.47Å; V587-N656 VanDerWaalsContact CG1-CA 3.43Å; V587-N656 HydrophobicContact CG1-CB 4.02Å; V587-N656 VanDerWaalsContact CG1-O 3.29Å; V587-N656 WeakPolarHBondContact CG1-O 3.38Å; F591-N656 HydrophobicContact CE2-CB 4.02Å; F591-N656 HydrophobicContact CZ-CB 4.18Å; W652-N656 PolarHBondContact NE1-ND2 2.98Å; W652-N656 WeakPolarHBondContact O-CB 3.19Å; W652-N656 PolarHBondContact O-N 3.2Å; W652-N656 PolarHBondContact O-ND2 2.95Å; C653-N656 PolarHBondContact O-N 2.85Å; R654-N656 PolarHBondContact O-N 3.5Å; N656-I658 HydrophobicContact CB-CD1 3.76Å; N656-I658 HydrophobicContact CB-CG1 4.28Å; N656-I658 WeakPolarHBondContact O-CG1 3.45Å; N656-I658 PolarHBondContact O-N 3.36Å; N656-I658 VanDerWaalsContact O-N 3.09Å
657	F	87.5	Confident	85	Confident	12 Å²	12	46.4 Å²	46.4	5%	0.053	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	35.8	-179	-53.5	-66.9	0	0	0	114.3	F574 Y575 P577 K580 E583 F584 V587 C653 R654	F574-F657 CarbonylContact C-O 3.59Å; F574-F657 WeakPolarHBondContact CA-O 3.42Å; Y575-F657 WeakPolarHBondContact CD1-O 3.49Å; Y575-F657 VanDerWaalsContact CE1-CA 3.46Å; Y575-F657 HydrophobicContact CE1-CB 4.32Å; Y575-F657 WeakPolarHBondContact CE1-O 3.26Å; Y575-F657 HydrophobicContact CE2-CD1 4.31Å; Y575-F657 PolarHBondContact N-O 3.37Å; Y575-F657 WeakPolarHBondContact O-CB 3.46Å; P577-F657 HydrophobicContact CG-CD1 3.56Å; P577-F657 HydrophobicContact CG-CE1 3.67Å; K580-F657 HydrophobicContact CB-CE1 4.18Å; K580-F657 HydrophobicContact CB-CZ 4.07Å; K580-F657 HydrophobicContact CD-CE1 3.89Å; K580-F657 HydrophobicContact CD-CZ 4.09Å; E583-F657 HydrophobicContact CB-CE2 3.96Å; E583-F657 HydrophobicContact CB-CZ 3.94Å; F584-F657 HydrophobicContact CB-CD2 4.29Å; F584-F657 HydrophobicContact CB-CE2 4.46Å; F584-F657 HydrophobicContact CD2-CB 3.83Å; F584-F657 AromaticContact CD2-CD2 3.92Å; F584-F657 HydrophobicContact CD2-CD2 3.92Å; F584-F657 HydrophobicContact CD2-CG 4.07Å; F584-F657 HydrophobicContact CE2-CB 4.18Å; V587-F657 HydrophobicContact CB-CD2 3.84Å; V587-F657 HydrophobicContact CB-CE2 4.12Å; V587-F657 HydrophobicContact CG1-CD2 3.87Å; V587-F657 HydrophobicContact CG2-CD2 3.83Å; V587-F657 HydrophobicContact CG2-CE2 3.68Å; C653-F657 PolarHBondContact O-N 3.04Å; C653-F657 VanDerWaalsContact O-N 3.15Å; R654-F657 PolarHBondContact O-N 2.72Å
658	I	89.1	Confident	86.5	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.015	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-103.7	135.3	-178	-74.2	161.3	0	0	0	110.7	F574 F591 V604 W652 C653 N656 R660 L663	F574-I658 HydrophobicContact CD1-CG1 3.76Å; F574-I658 HydrophobicContact CE1-CD1 4.04Å; F574-I658 HydrophobicContact CE1-CG1 3.62Å; F574-I658 HydrophobicContact CZ-CG1 4.47Å; F591-I658 HydrophobicContact CE2-CD1 4.17Å; F591-I658 HydrophobicContact CZ-CD1 4.1Å; V604-I658 HydrophobicContact CG1-CD1 3.85Å; V604-I658 HydrophobicContact CG1-CG1 4.43Å; W652-I658 HydrophobicContact CH2-CD1 3.59Å; W652-I658 HydrophobicContact CZ3-CD1 3.61Å; C653-I658 PolarHBondContact O-N 3.17Å; N656-I658 HydrophobicContact CB-CD1 3.76Å; N656-I658 HydrophobicContact CB-CG1 4.28Å; N656-I658 WeakPolarHBondContact O-CG1 3.45Å; N656-I658 PolarHBondContact O-N 3.36Å; N656-I658 VanDerWaalsContact O-N 3.09Å; I658-R660 PolarHBondContact O-N 2.82Å; I658-L663 HydrophobicContact CG2-CD2 3.28Å; I658-L663 HydrophobicContact CG2-CG 3.67Å
659	N	85.7	Confident	87.5	Confident	34 Å²	34	44.9 Å²	44.9	18%	0.182	21%	0.212	C	C	.	.			trans	-73.5	100.8	175.2	-172.2	-40.1	0	0	0	111	V573 S661 R662 L663	V573-N659 PolarHBondContact O-N 3.28Å; N659-S661 PolarHBondContact O-N 3.25Å; N659-S661 VanDerWaalsContact O-N 3.14Å; N659-S661 WeakPolarHBondContact OD1-CB 3.25Å; N659-S661 PolarHBondContact OD1-N 3.06Å; N659-R662 HydrophobicContact CB-CB 4.14Å; N659-R662 HydrophobicContact CB-CG 3.97Å; N659-R662 PolarHBondContact O-N 3.2Å; N659-R662 VanDerWaalsContact O-N 3.14Å; N659-R662 PolarHBondContact OD1-N 2.88Å; N659-L663 WeakPolarHBondContact O-CD2 3.46Å; N659-L663 PolarHBondContact O-N 2.85Å
660	R	86.6	Confident	88.4	Confident	74 Å²	74	45.1 Å²	45.1	28%	0.279	21%	0.211	S	C	.	.	H	α-helix	trans	-49.7	-41.6	179.4	176.6	-177.3	163	140.4	-0.6	113.7	C653 I658 L663 E664	C653-R660 HydrophobicContact CB-CB 4.09Å; I658-R660 PolarHBondContact O-N 2.82Å; R660-L663 PolarHBondContact O-N 2.63Å; R660-E664 HydrophobicContact CG-CG 4.35Å; R660-E664 IonicContact CZ-OE1 3.61Å; R660-E664 IonicContact NE-OE1 3.73Å; R660-E664 PolarHBondContact NE-OE1 2.97Å; R660-E664 IonicContact NE-OE2 2.75Å; R660-E664 IonicContact NH2-OE1 3.4Å; R660-E664 PolarHBondContact NH2-OE1 3.21Å; R660-E664 WeakPolarHBondContact O-CG 3.33Å; R660-E664 PolarHBondContact O-N 2.84Å
661	S	81.3	Confident	89.1	Confident	23 Å²	23	44.3 Å²	44.3	16%	0.161	22%	0.215	C	C	.	.	H	α-helix	trans	-69.5	-37.4	-175.4	178	0	0	0	0	112.1	P341 N659 E664 T665	P341-S661 WeakPolarHBondContact CA-OG 3.42Å; P341-S661 WeakPolarHBondContact CB-OG 3.3Å; N659-S661 PolarHBondContact O-N 3.25Å; N659-S661 VanDerWaalsContact O-N 3.14Å; N659-S661 WeakPolarHBondContact OD1-CB 3.25Å; N659-S661 PolarHBondContact OD1-N 3.06Å; S661-E664 PolarHBondContact O-N 2.95Å; S661-T665 WeakPolarHBondContact O-CB 3.44Å; S661-T665 PolarHBondContact O-N 3.33Å; S661-T665 PolarHBondContact O-OG1 2.9Å
662	R	86.6	Confident	89.5	Confident	24 Å²	24	40.4 Å²	40.4	9%	0.091	20%	0.197	C	C	.	.	H	α-helix	trans	-62.6	-46.2	173.3	-65.9	-175.4	-171.2	-146.9	7.6	110.2	E302 S339 V570 P572 N659 E664 T665 A666	E302-R662 IonicContact OE1-NH2 2.89Å; E302-R662 PolarHBondContact OE1-NH2 3.35Å; E302-R662 IonicContact OE2-NH2 3.21Å; E302-R662 PolarHBondContact OE2-NH2 3.23Å; S339-R662 VanDerWaalsContact CB-NH2 3.25Å; S339-R662 PolarHBondContact OG-NH2 3.12Å; V570-R662 HydrophobicContact CB-CB 4.1Å; V570-R662 HydrophobicContact CG2-CB 4.29Å; V570-R662 WeakPolarHBondContact O-CD 3.41Å; P572-R662 WeakPolarHBondContact O-CD 3.37Å; P572-R662 VanDerWaalsContact O-CZ 3.3Å; P572-R662 PolarHBondContact O-NE 3.01Å; P572-R662 PolarHBondContact O-NH1 2.9Å; N659-R662 HydrophobicContact CB-CB 4.14Å; N659-R662 HydrophobicContact CB-CG 3.97Å; N659-R662 PolarHBondContact O-N 3.2Å; N659-R662 VanDerWaalsContact O-N 3.14Å; N659-R662 PolarHBondContact OD1-N 2.88Å; R662-E664 PolarHBondContact O-N 3.15Å; R662-T665 CarbonylContact O-C 3.56Å; R662-T665 WeakPolarHBondContact O-CA 2.93Å; R662-T665 WeakPolarHBondContact O-CB 3.43Å; R662-T665 PolarHBondContact O-N 2.95Å; R662-T665 VanDerWaalsContact O-N 3.08Å; R662-A666 PolarHBondContact O-N 3.07Å
663	L	91.3	Very high	89.8	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.7	-39.1	177.5	-85.7	-68.6	0	0	0	113.5	M567 V573 V604 F608 I658 N659 R660 T665 A666 V667	M567-L663 HydrophobicContact CE-CD1 3.8Å; M567-L663 HydrophobicContact SD-CD1 3.69Å; V573-L663 HydrophobicContact CB-CD2 3.95Å; V573-L663 HydrophobicContact CG1-CD2 4.1Å; V604-L663 HydrophobicContact CG1-CD1 4.36Å; F608-L663 HydrophobicContact CB-CD1 4.01Å; F608-L663 HydrophobicContact CB-CG 4.41Å; F608-L663 HydrophobicContact CD1-CB 3.9Å; F608-L663 HydrophobicContact CD1-CD1 4.1Å; F608-L663 HydrophobicContact CD1-CG 4.32Å; F608-L663 HydrophobicContact CD2-CB 4Å; F608-L663 HydrophobicContact CD2-CG 4.19Å; F608-L663 HydrophobicContact CE1-CB 3.69Å; F608-L663 HydrophobicContact CE2-CB 3.8Å; F608-L663 HydrophobicContact CE2-CG 4.45Å; F608-L663 HydrophobicContact CG-CB 4.01Å; F608-L663 HydrophobicContact CG-CD1 4.02Å; F608-L663 HydrophobicContact CG-CG 4.07Å; F608-L663 HydrophobicContact CZ-CB 3.58Å; I658-L663 HydrophobicContact CG2-CD2 3.28Å; I658-L663 HydrophobicContact CG2-CG 3.67Å; N659-L663 WeakPolarHBondContact O-CD2 3.46Å; N659-L663 PolarHBondContact O-N 2.85Å; R660-L663 PolarHBondContact O-N 2.63Å; L663-T665 PolarHBondContact O-N 3.44Å; L663-A666 PolarHBondContact O-N 2.87Å; L663-V667 WeakPolarHBondContact O-CG2 3.37Å; L663-V667 PolarHBondContact O-N 3.38Å
664	E	89.6	Confident	90.1	Very high	60 Å²	60	41.6 Å²	41.6	28%	0.28	20%	0.203	S	C	.	.	H	α-helix	trans	-61.8	-34	171.8	-76.9	179.2	160.8	0	0	112.1	F608 K649 R660 S661 R662 R668	F608-E664 HydrophobicContact CZ-CG 4.12Å; K649-E664 IonicContact NZ-OE1 2.83Å; K649-E664 PolarHBondContact NZ-OE1 2.87Å; R660-E664 HydrophobicContact CG-CG 4.35Å; R660-E664 IonicContact CZ-OE1 3.61Å; R660-E664 IonicContact NE-OE1 3.73Å; R660-E664 PolarHBondContact NE-OE1 2.97Å; R660-E664 IonicContact NE-OE2 2.75Å; R660-E664 IonicContact NH2-OE1 3.4Å; R660-E664 PolarHBondContact NH2-OE1 3.21Å; R660-E664 WeakPolarHBondContact O-CG 3.33Å; R660-E664 PolarHBondContact O-N 2.84Å; S661-E664 PolarHBondContact O-N 2.95Å; R662-E664 PolarHBondContact O-N 3.15Å; E664-R668 WeakPolarHBondContact O-CG 3.32Å; E664-R668 PolarHBondContact O-N 3.39Å
665	T	86.9	Confident	90.5	Very high	26 Å²	26	38.6 Å²	38.6	16%	0.16	20%	0.196	C	C	.	.	H	α-helix	trans	-71.4	-42.1	174.2	-57.4	0	0	0	0	111.4	Y569 V570 S661 R662 L663 V667 R668 V669	Y569-T665 HydrophobicContact CE1-CG2 4.49Å; V570-T665 HydrophobicContact CG1-CG2 3.88Å; S661-T665 WeakPolarHBondContact O-CB 3.44Å; S661-T665 PolarHBondContact O-N 3.33Å; S661-T665 PolarHBondContact O-OG1 2.9Å; R662-T665 CarbonylContact O-C 3.56Å; R662-T665 WeakPolarHBondContact O-CA 2.93Å; R662-T665 WeakPolarHBondContact O-CB 3.43Å; R662-T665 PolarHBondContact O-N 2.95Å; R662-T665 VanDerWaalsContact O-N 3.08Å; L663-T665 PolarHBondContact O-N 3.44Å; T665-V667 VanDerWaalsContact C-N 3.31Å; T665-V667 PolarHBondContact O-N 3.19Å; T665-R668 WeakPolarHBondContact O-CB 3.29Å; T665-R668 PolarHBondContact O-N 3.04Å; T665-R668 VanDerWaalsContact O-N 3.07Å; T665-R668 PolarHBondContact OG1-NH2 3.46Å; T665-V669 HydrophobicContact CG2-CG2 4.28Å; T665-V669 WeakPolarHBondContact O-CG2 3.23Å; T665-V669 PolarHBondContact O-N 2.95Å
666	A	92.7	Very high	90.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-57.5	-42.4	173.8	0	0	0	0	0	112.2	S566 M567 V570 Y605 R662 L663 R668 V669 R670	S566-A666 WeakPolarHBondContact CB-O 3.34Å; S566-A666 WeakPolarHBondContact O-CB 3.5Å; M567-A666 HydrophobicContact SD-CB 3.78Å; V570-A666 HydrophobicContact CG1-CB 4.29Å; V570-A666 HydrophobicContact CG2-CB 3.82Å; Y605-A666 HydrophobicContact CD2-CB 4.44Å; Y605-A666 HydrophobicContact CE2-CB 4.44Å; R662-A666 PolarHBondContact O-N 3.07Å; L663-A666 PolarHBondContact O-N 2.87Å; A666-R668 VanDerWaalsContact C-N 3.32Å; A666-R668 PolarHBondContact O-N 3.02Å; A666-V669 PolarHBondContact O-N 3.19Å; A666-R670 WeakPolarHBondContact O-CB 3.44Å; A666-R670 PolarHBondContact O-N 3.26Å
667	V	94.4	Very high	90.9	Very high	58 Å²	58	36 Å²	36	35%	0.352	17%	0.174	S	C	.	.	H	α-helix	trans	-60.9	-40.6	175.4	172.9	0	0	0	0	111.7	Y605 F608 L663 T665 G671	Y605-V667 HydrophobicContact CE2-CG2 3.85Å; F608-V667 HydrophobicContact CD1-CG2 4.19Å; F608-V667 HydrophobicContact CE1-CG2 3.85Å; L663-V667 WeakPolarHBondContact O-CG2 3.37Å; L663-V667 PolarHBondContact O-N 3.38Å; T665-V667 VanDerWaalsContact C-N 3.31Å; T665-V667 PolarHBondContact O-N 3.19Å; V667-G671 PolarHBondContact O-N 3.07Å
668	R	91.4	Very high	91.2	Very high	104 Å²	104	39 Å²	39	39%	0.392	19%	0.188	S	C	.	.	H	α-helix	trans	-67.2	-43.9	176.3	-71.7	-176	-70	172.7	1.6	112.1	F128 E664 T665 A666 G671 Q672	F128-R668 HydrophobicContact CD1-CB 4.25Å; F128-R668 HydrophobicContact CG-CB 4.34Å; E664-R668 WeakPolarHBondContact O-CG 3.32Å; E664-R668 PolarHBondContact O-N 3.39Å; T665-R668 WeakPolarHBondContact O-CB 3.29Å; T665-R668 PolarHBondContact O-N 3.04Å; T665-R668 VanDerWaalsContact O-N 3.07Å; T665-R668 PolarHBondContact OG1-NH2 3.46Å; A666-R668 VanDerWaalsContact C-N 3.32Å; A666-R668 PolarHBondContact O-N 3.02Å; R668-G671 PolarHBondContact O-N 2.9Å; R668-Q672 PolarHBondContact O-N 2.89Å
669	V	91.7	Very high	91.3	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-58	-49.6	175.3	178	0	0	0	0	109.8	F128 Y569 T665 A666 G671 Q672 L673	F128-V669 HydrophobicContact CE1-CG2 4.23Å; F128-V669 HydrophobicContact CE2-CG2 4.01Å; F128-V669 HydrophobicContact CZ-CB 4.12Å; F128-V669 HydrophobicContact CZ-CG2 3.42Å; F128-V669 VanDerWaalsContact CZ-CG2 3.42Å; Y569-V669 HydrophobicContact CD1-CG2 3.48Å; Y569-V669 VanDerWaalsContact CD1-CG2 3.48Å; Y569-V669 HydrophobicContact CE1-CG2 3.87Å; Y569-V669 HydrophobicContact CG-CG1 4.48Å; Y569-V669 HydrophobicContact CG-CG2 4.17Å; T665-V669 HydrophobicContact CG2-CG2 4.28Å; T665-V669 WeakPolarHBondContact O-CG2 3.23Å; T665-V669 PolarHBondContact O-N 2.95Å; A666-V669 PolarHBondContact O-N 3.19Å; V669-G671 VanDerWaalsContact C-N 3.33Å; V669-G671 PolarHBondContact O-N 3.36Å; V669-Q672 WeakPolarHBondContact O-CB 3.36Å; V669-Q672 PolarHBondContact O-N 3.34Å; V669-Q672 VanDerWaalsContact O-N 3.17Å; V669-L673 HydrophobicContact CG1-CD1 3.98Å; V669-L673 HydrophobicContact CG1-CG 4.31Å; V669-L673 WeakPolarHBondContact O-CG 3.25Å; V669-L673 PolarHBondContact O-N 2.85Å
670	R	96.4	Very high	91.4	Very high	47 Å²	47	41.7 Å²	41.7	18%	0.177	21%	0.207	C	C	.	.	H	α-helix	trans	-60.7	-42.6	179.3	-167.7	-172	176.3	-88.2	1.4	112.1	L562 S563 S566 Y605 A666 L673 K674	L562-R670 HydrophobicContact CB-CG 4.17Å; S563-R670 PolarHBondContact OG-NE 3.25Å; S566-R670 WeakPolarHBondContact OG-CA 3.34Å; S566-R670 VanDerWaalsContact OG-CB 3.26Å; S566-R670 WeakPolarHBondContact OG-CB 3.29Å; S566-R670 PolarHBondContact OG-N 2.87Å; Y605-R670 WeakPolarHBondContact OH-CD 3.49Å; A666-R670 WeakPolarHBondContact O-CB 3.44Å; A666-R670 PolarHBondContact O-N 3.26Å; R670-L673 PolarHBondContact O-N 3.29Å; R670-K674 VanDerWaalsContact O-CB 3.29Å; R670-K674 WeakPolarHBondContact O-CB 3.38Å; R670-K674 PolarHBondContact O-N 2.68Å
671	G	95.2	Very high	91.6	Very high	30 Å²	30	40.2 Å²	40.2	31%	0.309	22%	0.215	S	C	.	.	H	α-helix	trans	-58.7	-46.5	175.3	0	0	0	0	0	112.1	V667 R668 V669 K674 Q675	V667-G671 PolarHBondContact O-N 3.07Å; R668-G671 PolarHBondContact O-N 2.9Å; V669-G671 VanDerWaalsContact C-N 3.33Å; V669-G671 PolarHBondContact O-N 3.36Å; G671-K674 PolarHBondContact O-N 2.88Å; G671-Q675 WeakPolarHBondContact O-CG 3.47Å; G671-Q675 PolarHBondContact O-N 3.01Å
672	Q	92.6	Very high	92	Very high	48 Å²	48	39.6 Å²	39.6	22%	0.224	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-49.6	175.9	-177.2	-179.3	49.4	0	0	111.6	F128 R668 V669 K674 Q675 I676	F128-Q672 HydrophobicContact CD1-CB 4.28Å; F128-Q672 HydrophobicContact CE1-CB 3.86Å; F128-Q672 HydrophobicContact CE1-CG 4.36Å; R668-Q672 PolarHBondContact O-N 2.89Å; V669-Q672 WeakPolarHBondContact O-CB 3.36Å; V669-Q672 PolarHBondContact O-N 3.34Å; V669-Q672 VanDerWaalsContact O-N 3.17Å; Q672-K674 VanDerWaalsContact C-N 3.33Å; Q672-K674 PolarHBondContact O-N 2.83Å; Q672-Q675 PolarHBondContact O-N 3.15Å; Q672-I676 HydrophobicContact CG-CD1 3.98Å; Q672-I676 WeakPolarHBondContact O-CG1 3.47Å; Q672-I676 PolarHBondContact O-N 2.59Å
673	L	95.1	Very high	92.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63	-39.5	-179.7	-66.9	178	0	0	0	111.9	F539 L541 L562 I565 V669 R670 I676 A677	F539-L673 HydrophobicContact CD1-CD2 4.09Å; L541-L673 HydrophobicContact CD1-CD1 4.2Å; L541-L673 HydrophobicContact CD1-CD2 3.74Å; L541-L673 HydrophobicContact CD2-CD1 4.5Å; L541-L673 HydrophobicContact CD2-CD2 4.25Å; L541-L673 HydrophobicContact CG-CD2 3.98Å; L562-L673 HydrophobicContact CD2-CB 3.46Å; L562-L673 VanDerWaalsContact CD2-CB 3.46Å; I565-L673 HydrophobicContact CG2-CD1 4Å; V669-L673 HydrophobicContact CG1-CD1 3.98Å; V669-L673 HydrophobicContact CG1-CG 4.31Å; V669-L673 WeakPolarHBondContact O-CG 3.25Å; V669-L673 PolarHBondContact O-N 2.85Å; R670-L673 PolarHBondContact O-N 3.29Å; L673-I676 PolarHBondContact O-N 3.47Å; L673-A677 WeakPolarHBondContact O-CB 3.4Å; L673-A677 PolarHBondContact O-N 3.11Å
674	K	96.3	Very high	92.1	Very high	84 Å²	84	47.8 Å²	47.8	37%	0.365	26%	0.258	S	S	.	.	H	α-helix	trans	-59.9	-48	173.8	-178.9	179.2	176.9	178.4	0	111.2	L562 R670 G671 Q672 I676 A677 Q678	L562-K674 HydrophobicContact CD1-CB 4.3Å; R670-K674 VanDerWaalsContact O-CB 3.29Å; R670-K674 WeakPolarHBondContact O-CB 3.38Å; R670-K674 PolarHBondContact O-N 2.68Å; G671-K674 PolarHBondContact O-N 2.88Å; Q672-K674 VanDerWaalsContact C-N 3.33Å; Q672-K674 PolarHBondContact O-N 2.83Å; K674-I676 VanDerWaalsContact C-N 3.33Å; K674-I676 PolarHBondContact O-N 3.09Å; K674-A677 PolarHBondContact O-N 3.22Å; K674-Q678 WeakPolarHBondContact O-CB 3.38Å; K674-Q678 VanDerWaalsContact O-CG 3.29Å; K674-Q678 WeakPolarHBondContact O-CG 3.35Å; K674-Q678 PolarHBondContact O-N 3.22Å
675	Q	93.9	Very high	92.2	Very high	110 Å²	110	48.4 Å²	48.4	51%	0.514	26%	0.258	S	S	.	.	H	α-helix	trans	-60.8	-42	178.2	-74.1	173.8	-3	0	0	111.9	G671 Q672 Q678 S679	G671-Q675 WeakPolarHBondContact O-CG 3.47Å; G671-Q675 PolarHBondContact O-N 3.01Å; Q672-Q675 PolarHBondContact O-N 3.15Å; Q675-Q678 PolarHBondContact O-N 3.02Å; Q675-S679 WeakPolarHBondContact O-CB 3.38Å; Q675-S679 PolarHBondContact O-N 3.04Å; Q675-S679 PolarHBondContact O-OG 3.38Å
676	I	92	Very high	92.5	Very high	18 Å²	18	48.8 Å²	48.8	9%	0.092	26%	0.259	C	S	.	.	H	α-helix	trans	-63.9	-49.7	176.6	-65.9	170.3	0	0	0	110	A538 F539 P540 Q672 L673 K674 Q678 S679 I680	A538-I676 HydrophobicContact CB-CG2 4.48Å; A538-I676 WeakPolarHBondContact O-CG2 3.37Å; F539-I676 HydrophobicContact CD1-CB 4.16Å; F539-I676 HydrophobicContact CD1-CG2 3.59Å; F539-I676 HydrophobicContact CE1-CB 4.07Å; F539-I676 HydrophobicContact CE1-CG2 3.62Å; F539-I676 HydrophobicContact CG-CG2 4.28Å; F539-I676 HydrophobicContact CZ-CG2 4.34Å; P540-I676 VanDerWaalsContact CD-CD1 3.49Å; P540-I676 HydrophobicContact CG-CD1 4.07Å; Q672-I676 HydrophobicContact CG-CD1 3.98Å; Q672-I676 WeakPolarHBondContact O-CG1 3.47Å; Q672-I676 PolarHBondContact O-N 2.59Å; L673-I676 PolarHBondContact O-N 3.47Å; K674-I676 VanDerWaalsContact C-N 3.33Å; K674-I676 PolarHBondContact O-N 3.09Å; I676-Q678 VanDerWaalsContact C-N 3.28Å; I676-Q678 PolarHBondContact O-N 3.42Å; I676-S679 WeakPolarHBondContact CA-OG 3.21Å; I676-S679 PolarHBondContact O-N 2.84Å; I676-S679 PolarHBondContact O-OG 3.29Å; I676-I680 HydrophobicContact CG2-CG2 4.5Å; I676-I680 WeakPolarHBondContact O-CG1 3.47Å; I676-I680 PolarHBondContact O-N 2.87Å
677	A	93.3	Very high	92.6	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-56	-43.2	178.3	0	0	0	0	0	111.8	F539 L673 K674 I680 G681 L682 M686	F539-A677 HydrophobicContact CE1-CB 4.09Å; F539-A677 HydrophobicContact CZ-CB 4.07Å; L673-A677 WeakPolarHBondContact O-CB 3.4Å; L673-A677 PolarHBondContact O-N 3.11Å; K674-A677 PolarHBondContact O-N 3.22Å; A677-I680 VanDerWaalsContact O-CG1 3.26Å; A677-I680 WeakPolarHBondContact O-CG1 3.38Å; A677-I680 PolarHBondContact O-N 2.65Å; A677-G681 PolarHBondContact O-N 3.02Å; A677-L682 HydrophobicContact CB-CB 4.26Å; A677-L682 HydrophobicContact CB-CD1 4.26Å; A677-L682 WeakPolarHBondContact O-CA 3.46Å; A677-L682 VanDerWaalsContact O-CB 3.3Å; A677-L682 WeakPolarHBondContact O-CB 3.47Å; A677-L682 PolarHBondContact O-N 2.88Å; A677-M686 HydrophobicContact CB-CE 3.37Å
678	Q	93.9	Very high	92.6	Very high	75 Å²	75	53.8 Å²	53.8	35%	0.35	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-42.5	174.6	-71.1	174.8	-42.8	0	0	112.3	K674 Q675 I676 I680 G681 T683	K674-Q678 WeakPolarHBondContact O-CB 3.38Å; K674-Q678 VanDerWaalsContact O-CG 3.29Å; K674-Q678 WeakPolarHBondContact O-CG 3.35Å; K674-Q678 PolarHBondContact O-N 3.22Å; Q675-Q678 PolarHBondContact O-N 3.02Å; I676-Q678 VanDerWaalsContact C-N 3.28Å; I676-Q678 PolarHBondContact O-N 3.42Å; Q678-I680 VanDerWaalsContact C-N 3.29Å; Q678-I680 PolarHBondContact O-N 2.66Å; Q678-G681 PolarHBondContact O-N 3.34Å; Q678-T683 WeakPolarHBondContact CA-OG1 3.45Å; Q678-T683 PolarHBondContact O-OG1 3.24Å
679	S	89.6	Confident	92.7	Very high	62 Å²	62	49.5 Å²	49.5	43%	0.434	27%	0.27	S	S	.	.	H	α-helix	trans	-67.4	-26.1	-178.3	73.7	0	0	0	0	114.4	Q675 I676 M839	Q675-S679 WeakPolarHBondContact O-CB 3.38Å; Q675-S679 PolarHBondContact O-N 3.04Å; Q675-S679 PolarHBondContact O-OG 3.38Å; I676-S679 WeakPolarHBondContact CA-OG 3.21Å; I676-S679 PolarHBondContact O-N 2.84Å; I676-S679 PolarHBondContact O-OG 3.29Å; S679-M839 WeakPolarHBondContact OG-CE 3.3Å
680	I	89.7	Confident	92.8	Very high	33 Å²	33	50.9 Å²	50.9	17%	0.169	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	3.3	176.9	67.8	175.5	0	0	0	113	L535 A538 F539 I676 A677 Q678 L682	L535-I680 HydrophobicContact CD2-CB 4.03Å; L535-I680 HydrophobicContact CD2-CD1 4.09Å; L535-I680 HydrophobicContact CD2-CG1 4.34Å; A538-I680 HydrophobicContact CB-CG2 3.71Å; F539-I680 HydrophobicContact CD2-CD1 4.42Å; F539-I680 HydrophobicContact CE1-CD1 4.43Å; F539-I680 HydrophobicContact CE2-CD1 3.41Å; F539-I680 VanDerWaalsContact CE2-CD1 3.41Å; F539-I680 HydrophobicContact CZ-CD1 3.42Å; F539-I680 VanDerWaalsContact CZ-CD1 3.42Å; I676-I680 HydrophobicContact CG2-CG2 4.5Å; I676-I680 WeakPolarHBondContact O-CG1 3.47Å; I676-I680 PolarHBondContact O-N 2.87Å; A677-I680 VanDerWaalsContact O-CG1 3.26Å; A677-I680 WeakPolarHBondContact O-CG1 3.38Å; A677-I680 PolarHBondContact O-N 2.65Å; Q678-I680 VanDerWaalsContact C-N 3.29Å; Q678-I680 PolarHBondContact O-N 2.66Å; I680-L682 HydrophobicContact CD1-CD1 3.89Å; I680-L682 HydrophobicContact CD1-CG 4.19Å; I680-L682 HydrophobicContact CG1-CD1 4.27Å; I680-L682 HydrophobicContact CG1-CG 4.07Å
681	G	89.5	Confident	92.5	Very high	43 Å²	43	53.7 Å²	53.7	44%	0.443	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	12.6	175.7	0	0	0	0	0	115.9	A677 Q678 T683	A677-G681 PolarHBondContact O-N 3.02Å; Q678-G681 PolarHBondContact O-N 3.34Å; G681-T683 PolarHBondContact O-N 3.19Å
682	L	90.7	Very high	92.4	Very high	10 Å²	10	55.5 Å²	55.5	5%	0.052	31%	0.31	C	S	.	.			trans	-85.4	13	175.5	-59.7	177.9	0	0	0	113.6	F539 A553 L558 A677 I680 D684 Y685 M686	F539-L682 HydrophobicContact CZ-CD1 4.22Å; A553-L682 HydrophobicContact CB-CD2 4.14Å; L558-L682 HydrophobicContact CD2-CB 4.29Å; A677-L682 HydrophobicContact CB-CB 4.26Å; A677-L682 HydrophobicContact CB-CD1 4.26Å; A677-L682 WeakPolarHBondContact O-CA 3.46Å; A677-L682 VanDerWaalsContact O-CB 3.3Å; A677-L682 WeakPolarHBondContact O-CB 3.47Å; A677-L682 PolarHBondContact O-N 2.88Å; I680-L682 HydrophobicContact CD1-CD1 3.89Å; I680-L682 HydrophobicContact CD1-CG 4.19Å; I680-L682 HydrophobicContact CG1-CD1 4.27Å; I680-L682 HydrophobicContact CG1-CG 4.07Å; L682-D684 VanDerWaalsContact C-N 3.32Å; L682-D684 PolarHBondContact O-N 3.39Å; L682-Y685 HydrophobicContact CD2-CD2 4.3Å; L682-Y685 PolarHBondContact O-N 3.41Å; L682-Y685 VanDerWaalsContact O-N 3.13Å; L682-M686 HydrophobicContact CB-CE 4.37Å; L682-M686 PolarHBondContact O-N 3.43Å
683	T	90.9	Very high	92.4	Very high	66 Å²	66	54.4 Å²	54.4	41%	0.405	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-58.4	-44.4	-179	-56.7	0	0	0	0	111.7	Q678 G681 Y685 M686	Q678-T683 WeakPolarHBondContact CA-OG1 3.45Å; Q678-T683 PolarHBondContact O-OG1 3.24Å; G681-T683 PolarHBondContact O-N 3.19Å; T683-Y685 PolarHBondContact O-N 3.42Å; T683-M686 WeakPolarHBondContact O-CB 3.41Å; T683-M686 WeakPolarHBondContact O-CG 3.49Å; T683-M686 PolarHBondContact O-N 2.88Å
684	D	89.2	Confident	92.3	Very high	130 Å²	130	59.3 Å²	59.3	70%	0.695	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-74	-4.9	-178.5	-55.9	-32.8	0	0	0	113.1	L682 H687	L682-D684 VanDerWaalsContact C-N 3.32Å; L682-D684 PolarHBondContact O-N 3.39Å; D684-H687 PolarHBondContact O-CE1 3.5Å; D684-H687 PolarHBondContact O-NE2 3.45Å
685	Y	91.3	Very high	92.2	Very high	73 Å²	73	58.3 Å²	58.3	29%	0.286	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-109.6	10.1	178.1	-59.6	-92.9	0	0	0	112.4	A553 L682 T683 H687	A553-Y685 HydrophobicContact CB-CG 4.36Å; L682-Y685 HydrophobicContact CD2-CD2 4.3Å; L682-Y685 PolarHBondContact O-N 3.41Å; L682-Y685 VanDerWaalsContact O-N 3.13Å; T683-Y685 PolarHBondContact O-N 3.42Å; Y685-H687 PolarHBondContact O-N 2.97Å
686	M	92.2	Very high	92.2	Very high	34 Å²	34	53.1 Å²	53.1	17%	0.167	30%	0.3	C	S	.	.			trans	-74.2	66.6	175.5	-71.5	-73.1	143.2	0	0	111	L558 I559 L562 A677 L682 T683	L558-M686 HydrophobicContact CD2-CE 3.21Å; L558-M686 HydrophobicContact CD2-SD 3.99Å; L558-M686 HydrophobicContact CG-CE 3.76Å; L558-M686 HydrophobicContact CG-SD 4.12Å; I559-M686 WeakPolarHBondContact CD1-O 3.39Å; L562-M686 HydrophobicContact CD1-CE 4.04Å; L562-M686 HydrophobicContact CD1-SD 3.82Å; A677-M686 HydrophobicContact CB-CE 3.37Å; L682-M686 HydrophobicContact CB-CE 4.37Å; L682-M686 PolarHBondContact O-N 3.43Å; T683-M686 WeakPolarHBondContact O-CB 3.41Å; T683-M686 WeakPolarHBondContact O-CG 3.49Å; T683-M686 PolarHBondContact O-N 2.88Å
687	H	94.6	Very high	92.2	Very high	101 Å²	101	52.3 Å²	52.3	47%	0.468	30%	0.297	S	S	.	.			trans	-103.4	153.9	179.4	-58.9	133.3	0	0	0	112	L558 I559 D684 Y685	L558-H687 PolarHBondContact N-O 3.18Å; I559-H687 WeakPolarHBondContact CG1-O 3.24Å; I559-H687 PolarHBondContact N-O 3.44Å; I559-H687 VanDerWaalsContact N-O 3.16Å; D684-H687 PolarHBondContact O-CE1 3.5Å; D684-H687 PolarHBondContact O-NE2 3.45Å; Y685-H687 PolarHBondContact O-N 2.97Å
688	S	95.3	Very high	92.2	Very high	61 Å²	61	54.3 Å²	54.3	43%	0.427	31%	0.306	S	S	.	.			trans	-101.9	140.8	172	173.4	0	0	0	0	109.7	G556 E560 G690	G556-S688 CarbonylContact O-C 3.55Å; E560-S688 WeakPolarHBondContact OE1-CB 3.25Å; E560-S688 PolarHBondContact OE1-OG 2.84Å; E560-S688 VanDerWaalsContact OE2-CA 3.26Å; E560-S688 WeakPolarHBondContact OE2-CA 3.08Å; S688-G690 PolarHBondContact O-N 3.4Å; S688-G690 PolarHBondContact OG-N 3.48Å
689	C	94	Very high	92.1	Very high	14 Å²	14	50.8 Å²	50.8	10%	0.095	29%	0.289	C	S	.	.			trans	-75.3	-4.9	174.6	64	0	0	0	0	113.9	G556 C557 E560 T691 N692 K695	G556-C689 WeakPolarHBondContact O-CA 3.44Å; G556-C689 PolarHBondContact O-N 3.36Å; G556-C689 VanDerWaalsContact O-N 3.15Å; C557-C689 HydrophobicContact CB-CB 3.64Å; E560-C689 PolarHBondContact OE2-N 3.09Å; E560-C689 VanDerWaalsContact OE2-N 3.08Å; C689-T691 PolarHBondContact O-N 3.23Å; C689-N692 WeakPolarHBondContact CB-O 3.32Å; C689-N692 PolarHBondContact O-N 3.42Å; C689-N692 VanDerWaalsContact O-N 3.09Å; C689-K695 HydrophobicContact CB-CB 4.2Å; C689-K695 HydrophobicContact CB-CD 4.03Å
690	G	93.1	Very high	92.2	Very high	29 Å²	29	47.8 Å²	47.8	30%	0.299	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.8	-121	-178.5	0	0	0	0	0	111.7	S688	S688-G690 PolarHBondContact O-N 3.4Å; S688-G690 PolarHBondContact OG-N 3.48Å
691	T	90.8	Very high	92.1	Very high	107 Å²	107	46.4 Å²	46.4	66%	0.656	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-17	178.9	56.2	0	0	0	0	113.3	C689 V693 F878	C689-T691 PolarHBondContact O-N 3.23Å; T691-V693 VanDerWaalsContact C-N 3.3Å; T691-V693 PolarHBondContact O-N 3.48Å; T691-F878 HydrophobicContact CG2-CE2 3.92Å; T691-F878 HydrophobicContact CG2-CZ 3.76Å
692	N	92.7	Very high	91.8	Very high	68 Å²	68	46.8 Å²	46.8	36%	0.364	25%	0.253	S	S	.	.			trans	-81.8	77.4	-179.6	-172.4	-23.6	0	0	0	110.2	C689 E694 K695	C689-N692 WeakPolarHBondContact CB-O 3.32Å; C689-N692 PolarHBondContact O-N 3.42Å; C689-N692 VanDerWaalsContact O-N 3.09Å; N692-E694 PolarHBondContact O-N 3.33Å; N692-E694 WeakPolarHBondContact OD1-CB 3.26Å; N692-E694 PolarHBondContact OD1-N 2.87Å; N692-K695 HydrophobicContact CB-CD 4.42Å
693	V	93	Very high	91.4	Very high	25 Å²	25	46.3 Å²	46.3	15%	0.152	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-15.5	-179.5	-64.8	0	0	0	0	113.2	V599 T691 K695 I696	V599-V693 HydrophobicContact CG1-CB 4.46Å; V599-V693 HydrophobicContact CG1-CG1 4.14Å; V599-V693 HydrophobicContact CG2-CB 4.18Å; T691-V693 VanDerWaalsContact C-N 3.3Å; T691-V693 PolarHBondContact O-N 3.48Å; V693-K695 PolarHBondContact O-N 3.2Å; V693-I696 HydrophobicContact CB-CD1 4.26Å; V693-I696 HydrophobicContact CG1-CD1 4.4Å; V693-I696 WeakPolarHBondContact O-CB 3.15Å; V693-I696 PolarHBondContact O-N 3.07Å
694	E	92.3	Very high	90.6	Very high	102 Å²	102	43.3 Å²	43.3	48%	0.477	23%	0.233	S	C	.	.	H	α-helix	trans	-59.5	-36.3	177.1	-64.2	175.7	-174	0	0	111.7	N692 I696 V697 Q698 W809	N692-E694 PolarHBondContact O-N 3.33Å; N692-E694 WeakPolarHBondContact OD1-CB 3.26Å; N692-E694 PolarHBondContact OD1-N 2.87Å; E694-I696 PolarHBondContact O-N 3.24Å; E694-I696 VanDerWaalsContact O-N 3.07Å; E694-V697 PolarHBondContact O-N 3.37Å; E694-Q698 WeakPolarHBondContact O-CG 3.46Å; E694-Q698 PolarHBondContact O-N 2.73Å; E694-W809 HydrophobicContact CB-CH2 3.62Å; E694-W809 HydrophobicContact CB-CZ2 3.69Å; E694-W809 HydrophobicContact CG-CH2 3.82Å; E694-W809 HydrophobicContact CG-CZ2 3.79Å
695	K	93	Very high	90.4	Very high	64 Å²	64	37.3 Å²	37.3	28%	0.278	20%	0.201	S	C	.	.	H	α-helix	trans	-54.1	-28	173.2	-70	179.1	168.1	-157.9	0	113.6	L555 C557 C689 N692 V693 A699	L555-K695 WeakPolarHBondContact O-CD 3.36Å; L555-K695 PolarHBondContact O-NZ 2.75Å; C557-K695 HydrophobicContact CB-CB 4.11Å; C557-K695 PolarHBondContact SG-O 2.92Å; C557-K695 VanDerWaalsContact SG-O 3.41Å; C689-K695 HydrophobicContact CB-CB 4.2Å; C689-K695 HydrophobicContact CB-CD 4.03Å; N692-K695 HydrophobicContact CB-CD 4.42Å; V693-K695 PolarHBondContact O-N 3.2Å; K695-A699 WeakPolarHBondContact O-CB 3.41Å; K695-A699 PolarHBondContact O-N 2.66Å
696	I	94.7	Very high	89.8	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-67.2	-52.3	176.2	-63.5	169.8	0	0	0	109.1	E560 I561 I564 V599 L602 V693 E694 A699 F700	E560-I696 HydrophobicContact CB-CD1 3.98Å; E560-I696 HydrophobicContact CB-CG1 4.16Å; E560-I696 HydrophobicContact CG-CD1 4.18Å; I561-I696 HydrophobicContact CD1-CB 4.4Å; I561-I696 HydrophobicContact CD1-CG2 3.77Å; I564-I696 HydrophobicContact CD1-CD1 4.14Å; I564-I696 HydrophobicContact CD1-CG1 4.46Å; I564-I696 HydrophobicContact CD1-CG2 3.32Å; V599-I696 HydrophobicContact CG2-CD1 4.33Å; L602-I696 HydrophobicContact CD2-CD1 3.89Å; V693-I696 HydrophobicContact CB-CD1 4.26Å; V693-I696 HydrophobicContact CG1-CD1 4.4Å; V693-I696 WeakPolarHBondContact O-CB 3.15Å; V693-I696 PolarHBondContact O-N 3.07Å; E694-I696 PolarHBondContact O-N 3.24Å; E694-I696 VanDerWaalsContact O-N 3.07Å; I696-A699 WeakPolarHBondContact O-CB 3.18Å; I696-A699 PolarHBondContact O-N 2.99Å; I696-F700 HydrophobicContact CG2-CE2 4.45Å; I696-F700 WeakPolarHBondContact O-CD2 3.42Å; I696-F700 PolarHBondContact O-N 2.91Å
697	V	93	Very high	89.1	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.012	21%	0.205	C	C	.	.	H	α-helix	trans	-66.6	-41.6	-178.8	-176.8	0	0	0	0	110.4	E694 A699 F700 L701 L773 I805 W809	E694-V697 PolarHBondContact O-N 3.37Å; V697-A699 VanDerWaalsContact C-N 3.29Å; V697-A699 PolarHBondContact O-N 3.02Å; V697-F700 PolarHBondContact O-N 3Å; V697-F700 VanDerWaalsContact O-N 3.15Å; V697-L701 PolarHBondContact O-N 3.31Å; V697-L773 HydrophobicContact CG1-CD2 4.37Å; V697-I805 HydrophobicContact CG1-CG1 4.26Å; V697-W809 HydrophobicContact CB-CZ3 3.97Å; V697-W809 HydrophobicContact CG1-CZ3 3.92Å
698	Q	91.7	Very high	88.7	Confident	42 Å²	42	33.7 Å²	33.7	20%	0.196	19%	0.188	C	C	.	.	H	α-helix	trans	-56.8	-41.5	172.5	-69.7	174	-13.3	0	0	111.7	L555 E694 F700 L701 L702 W809	L555-Q698 HydrophobicContact CD1-CB 4.02Å; E694-Q698 WeakPolarHBondContact O-CG 3.46Å; E694-Q698 PolarHBondContact O-N 2.73Å; Q698-F700 VanDerWaalsContact C-N 3.31Å; Q698-F700 PolarHBondContact O-N 3.04Å; Q698-L701 PolarHBondContact O-N 2.88Å; Q698-L702 WeakPolarHBondContact O-CB 3.3Å; Q698-L702 VanDerWaalsContact O-CG 3.24Å; Q698-L702 WeakPolarHBondContact O-CG 3.49Å; Q698-L702 PolarHBondContact O-N 2.54Å; Q698-W809 HydrophobicContact CG-CD2 4.06Å; Q698-W809 HydrophobicContact CG-CE3 3.88Å; Q698-W809 HydrophobicContact CG-CH2 4.42Å; Q698-W809 HydrophobicContact CG-CZ3 4.08Å
699	A	92.3	Very high	88.3	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-59.9	-39.6	177.5	0	0	0	0	0	112.6	T548 A552 L555 I561 K695 I696 V697 S703	T548-A699 HydrophobicContact CG2-CB 4.37Å; A552-A699 HydrophobicContact CB-CB 4.23Å; L555-A699 HydrophobicContact CD1-CB 3.88Å; I561-A699 HydrophobicContact CD1-CB 4.08Å; I561-A699 HydrophobicContact CG1-CB 4.29Å; K695-A699 WeakPolarHBondContact O-CB 3.41Å; K695-A699 PolarHBondContact O-N 2.66Å; I696-A699 WeakPolarHBondContact O-CB 3.18Å; I696-A699 PolarHBondContact O-N 2.99Å; V697-A699 VanDerWaalsContact C-N 3.29Å; V697-A699 PolarHBondContact O-N 3.02Å; A699-S703 VanDerWaalsContact O-CB 3.26Å; A699-S703 WeakPolarHBondContact O-CB 3.49Å; A699-S703 PolarHBondContact O-OG 3.13Å
700	F	91.9	Very high	88.1	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-69.3	-45.1	174	-78.4	-90.9	0	0	0	111.5	F545 T548 I561 I564 I565 L568 L598 I696 V697 Q698 L702 S703 F705 L773 I775	F545-F700 HydrophobicContact CD1-CE1 4.14Å; F545-F700 HydrophobicContact CE1-CE1 4.02Å; T548-F700 HydrophobicContact CG2-CD1 3.93Å; T548-F700 HydrophobicContact CG2-CD2 4Å; T548-F700 HydrophobicContact CG2-CE1 4Å; T548-F700 HydrophobicContact CG2-CE2 4.06Å; T548-F700 HydrophobicContact CG2-CG 3.93Å; T548-F700 HydrophobicContact CG2-CZ 4.06Å; I561-F700 HydrophobicContact CD1-CD2 3.91Å; I561-F700 HydrophobicContact CD1-CE2 3.45Å; I561-F700 VanDerWaalsContact CD1-CE2 3.45Å; I561-F700 HydrophobicContact CD1-CZ 4.37Å; I564-F700 HydrophobicContact CG2-CE2 4.08Å; I564-F700 HydrophobicContact CG2-CZ 3.91Å; I565-F700 HydrophobicContact CG1-CZ 4.4Å; L568-F700 HydrophobicContact CD1-CE1 4.18Å; L568-F700 HydrophobicContact CD1-CZ 4.07Å; L598-F700 HydrophobicContact CD1-CD2 3.65Å; L598-F700 HydrophobicContact CD1-CE2 3.77Å; L598-F700 HydrophobicContact CD1-CG 4.14Å; L598-F700 HydrophobicContact CD1-CZ 4.34Å; L598-F700 HydrophobicContact CD2-CE2 4.24Å; L598-F700 HydrophobicContact CD2-CZ 4.13Å; I696-F700 HydrophobicContact CG2-CE2 4.45Å; I696-F700 WeakPolarHBondContact O-CD2 3.42Å; I696-F700 PolarHBondContact O-N 2.91Å; V697-F700 PolarHBondContact O-N 3Å; V697-F700 VanDerWaalsContact O-N 3.15Å; Q698-F700 VanDerWaalsContact C-N 3.31Å; Q698-F700 PolarHBondContact O-N 3.04Å; F700-L702 VanDerWaalsContact C-N 3.31Å; F700-L702 PolarHBondContact O-N 3.37Å; F700-S703 PolarHBondContact O-N 3.09Å; F700-F705 HydrophobicContact CB-CD2 4.3Å; F700-F705 HydrophobicContact CD1-CD2 4.02Å; F700-F705 AromaticContact CD1-CE2 3.75Å; F700-F705 HydrophobicContact CD1-CE2 3.75Å; F700-F705 HydrophobicContact CD1-CZ 4.29Å; F700-F705 HydrophobicContact CE1-CE2 4.41Å; F700-F705 WeakPolarHBondContact O-CD2 3.35Å; F700-L773 HydrophobicContact CB-CD2 3.66Å; F700-I775 HydrophobicContact CB-CD1 4.49Å; F700-I775 HydrophobicContact CD1-CD1 3.45Å; F700-I775 VanDerWaalsContact CD1-CD1 3.45Å; F700-I775 HydrophobicContact CE1-CD1 3.85Å; F700-I775 HydrophobicContact CE1-CG1 4.49Å; F700-I775 HydrophobicContact CG-CD1 4.13Å
701	L	88	Confident	87.9	Confident	4 Å²	4	31.4 Å²	31.4	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-57.2	-42.4	179.3	-171.7	61.1	0	0	0	112.6	V697 Q698 S703 Q706 V709 I805 W809 I813	V697-L701 PolarHBondContact O-N 3.31Å; Q698-L701 PolarHBondContact O-N 2.88Å; L701-S703 PolarHBondContact O-N 2.84Å; L701-Q706 WeakPolarHBondContact O-CG 3.48Å; L701-V709 HydrophobicContact CD1-CG2 3.67Å; L701-I805 HydrophobicContact CD1-CD1 4.28Å; L701-I805 HydrophobicContact CD2-CG2 4.18Å; L701-W809 HydrophobicContact CD2-CB 3.93Å; L701-I813 HydrophobicContact CD1-CD1 3.62Å; L701-I813 HydrophobicContact CD2-CD1 3.72Å; L701-I813 HydrophobicContact CD2-CG1 4.22Å; L701-I813 HydrophobicContact CG-CD1 3.56Å; L701-I813 HydrophobicContact CG-CG1 4.16Å
702	L	83.3	Confident	87.8	Confident	51 Å²	51	27.1 Å²	27.1	27%	0.267	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-7	176.7	-64.8	-176.7	0	0	0	114.3	L555 Q698 F700 I816	L555-L702 HydrophobicContact CD1-CD1 3.98Å; L555-L702 HydrophobicContact CD2-CD1 4.33Å; L555-L702 HydrophobicContact CG-CD1 4.42Å; Q698-L702 WeakPolarHBondContact O-CB 3.3Å; Q698-L702 VanDerWaalsContact O-CG 3.24Å; Q698-L702 WeakPolarHBondContact O-CG 3.49Å; Q698-L702 PolarHBondContact O-N 2.54Å; F700-L702 VanDerWaalsContact C-N 3.31Å; F700-L702 PolarHBondContact O-N 3.37Å; L702-I816 HydrophobicContact CD2-CD1 3.31Å; L702-I816 HydrophobicContact CD2-CG1 4.48Å
703	S	81.8	Confident	87.4	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	30	-169	-59.2	0	0	0	0	114	L487 R547 T548 S551 A699 F700 L701	L487-S703 WeakPolarHBondContact CD2-O 3.47Å; R547-S703 PolarHBondContact O-OG 3.24Å; T548-S703 WeakPolarHBondContact CA-OG 3.16Å; T548-S703 PolarHBondContact N-OG 3.48Å; T548-S703 WeakPolarHBondContact OG1-CB 3.42Å; S551-S703 WeakPolarHBondContact CB-OG 3.46Å; S551-S703 PolarHBondContact OG-OG 3.19Å; A699-S703 VanDerWaalsContact O-CB 3.26Å; A699-S703 WeakPolarHBondContact O-CB 3.49Å; A699-S703 PolarHBondContact O-OG 3.13Å; F700-S703 PolarHBondContact O-N 3.09Å; L701-S703 PolarHBondContact O-N 2.84Å
704	G	75.2	Confident	86.4	Confident	3 Å²	3	30.8 Å²	30.8	3%	0.031	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.3	1	173.3	0	0	0	0	0	114.9	R544 Q706	R544-G704 PolarHBondContact NH1-O 3.4Å; R544-G704 PolarHBondContact NH2-O 3.39Å; G704-Q706 PolarHBondContact O-N 2.89Å; G704-Q706 VanDerWaalsContact O-N 3.17Å
705	F	84.2	Confident	85	Confident	4 Å²	4	31.1 Å²	31.1	2%	0.018	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-78.6	16	176.9	-71.3	-86.8	0	0	0	114.5	R544 F545 F700 D707 Q708 L773 I775	R544-F705 HydrophobicContact CB-CD2 4.29Å; R544-F705 HydrophobicContact CB-CE2 3.54Å; R544-F705 HydrophobicContact CB-CZ 3.66Å; R544-F705 HydrophobicContact CG-CE2 4.41Å; R544-F705 HydrophobicContact CG-CZ 4.43Å; F545-F705 HydrophobicContact CD1-CE2 4.34Å; F545-F705 HydrophobicContact CD1-CZ 4.03Å; F545-F705 HydrophobicContact CE1-CE2 4.36Å; F545-F705 AromaticContact CE1-CZ 3.68Å; F545-F705 HydrophobicContact CE1-CZ 3.68Å; F545-F705 HydrophobicContact CZ-CZ 4.42Å; F700-F705 HydrophobicContact CB-CD2 4.3Å; F700-F705 HydrophobicContact CD1-CD2 4.02Å; F700-F705 AromaticContact CD1-CE2 3.75Å; F700-F705 HydrophobicContact CD1-CE2 3.75Å; F700-F705 HydrophobicContact CD1-CZ 4.29Å; F700-F705 HydrophobicContact CE1-CE2 4.41Å; F700-F705 WeakPolarHBondContact O-CD2 3.35Å; F705-D707 VanDerWaalsContact C-N 3.27Å; F705-D707 PolarHBondContact O-N 3.17Å; F705-Q708 HydrophobicContact CD1-CB 4.45Å; F705-Q708 HydrophobicContact CD1-CG 4.38Å; F705-Q708 CarbonylContact O-C 3.49Å; F705-Q708 WeakPolarHBondContact O-CA 3.39Å; F705-Q708 PolarHBondContact O-N 3.48Å; F705-L773 HydrophobicContact CB-CD1 3.78Å; F705-L773 WeakPolarHBondContact O-CD1 3.31Å; F705-I775 HydrophobicContact CD1-CD1 3.89Å; F705-I775 HydrophobicContact CE1-CD1 3.83Å; F705-I775 HydrophobicContact CE1-CG2 3.98Å; F705-I775 HydrophobicContact CG-CD1 4.33Å; F705-I775 HydrophobicContact CZ-CD1 4.18Å; F705-I775 HydrophobicContact CZ-CG2 4.27Å
706	Q	78.7	Confident	83.5	Confident	44 Å²	44	29.3 Å²	29.3	21%	0.206	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-66.5	-30.7	-176.6	-59.1	169.8	-4.5	0	0	112.6	L701 G704 Q708 I813	L701-Q706 WeakPolarHBondContact O-CG 3.48Å; G704-Q706 PolarHBondContact O-N 2.89Å; G704-Q706 VanDerWaalsContact O-N 3.17Å; Q706-Q708 VanDerWaalsContact C-N 3.26Å; Q706-I813 VanDerWaalsContact CD-CG2 3.46Å; Q706-I813 HydrophobicContact CG-CD1 4.27Å; Q706-I813 HydrophobicContact CG-CG2 4.17Å
707	D	78.1	Confident	81.7	Confident	63 Å²	63	35.1 Å²	35.1	34%	0.337	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-73.2	-16.6	172.4	60.3	-29.7	0	0	0	113.1	R544 F705 V709 H738	R544-D707 IonicContact CZ-OD1 3.67Å; R544-D707 IonicContact CZ-OD2 3.33Å; R544-D707 IonicContact NH1-OD1 3.85Å; R544-D707 PolarHBondContact NH1-OD1 3.47Å; R544-D707 IonicContact NH1-OD2 2.72Å; R544-D707 IonicContact NH2-OD1 2.88Å; R544-D707 PolarHBondContact NH2-OD1 3.4Å; R544-D707 IonicContact NH2-OD2 3.04Å; R544-D707 PolarHBondContact NH2-OD2 3.35Å; F705-D707 VanDerWaalsContact C-N 3.27Å; F705-D707 PolarHBondContact O-N 3.17Å; D707-V709 VanDerWaalsContact C-N 3.33Å; D707-H738 PolarHBondContact O-CE1 3.08Å; D707-H738 VanDerWaalsContact O-CE1 3.22Å; D707-H738 PolarHBondContact O-ND1 3.18Å
708	Q	85	Confident	79.6	Confident	24 Å²	24	39.9 Å²	39.9	11%	0.112	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-99.3	24.2	176.6	-57.9	-175	10.7	0	0	112.3	F705 Q706 L773 F774 I775	F705-Q708 HydrophobicContact CD1-CB 4.45Å; F705-Q708 HydrophobicContact CD1-CG 4.38Å; F705-Q708 CarbonylContact O-C 3.49Å; F705-Q708 WeakPolarHBondContact O-CA 3.39Å; F705-Q708 PolarHBondContact O-N 3.48Å; Q706-Q708 VanDerWaalsContact C-N 3.26Å; Q708-L773 HydrophobicContact CB-CD1 4.46Å; Q708-F774 HydrophobicContact CB-CD1 4.19Å; Q708-F774 HydrophobicContact CB-CD2 4.24Å; Q708-F774 HydrophobicContact CB-CE1 3.9Å; Q708-F774 HydrophobicContact CB-CE2 3.96Å; Q708-F774 HydrophobicContact CB-CG 4.36Å; Q708-F774 HydrophobicContact CB-CZ 3.79Å; Q708-F774 WeakPolarHBondContact CB-O 3.27Å; Q708-F774 HydrophobicContact CG-CE2 3.95Å; Q708-F774 HydrophobicContact CG-CZ 3.96Å; Q708-F774 WeakPolarHBondContact O-CD1 3.31Å; Q708-F774 WeakPolarHBondContact O-CE1 3.36Å; Q708-F774 PolarHBondContact O-N 3.33Å; Q708-F774 VanDerWaalsContact O-N 3.12Å; Q708-F774 PolarHBondContact OE1-O 3.07Å; Q708-I775 PolarHBondContact OE1-O 2.93Å
709	V	88.2	Confident	77.6	Confident	12 Å²	12	46.6 Å²	46.6	7%	0.073	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	131.2	169.7	179.7	0	0	0	0	109.2	L701 D707 C771 L772 L773 I805 L810	L701-V709 HydrophobicContact CD1-CG2 3.67Å; D707-V709 VanDerWaalsContact C-N 3.33Å; V709-C771 VanDerWaalsContact CG1-SG 3.59Å; V709-L772 WeakPolarHBondContact CA-O 3.3Å; V709-L773 HydrophobicContact CG2-CD1 3.97Å; V709-I805 HydrophobicContact CB-CD1 4.38Å; V709-I805 HydrophobicContact CG1-CD1 3.92Å; V709-I805 HydrophobicContact CG2-CD1 3.72Å; V709-L810 HydrophobicContact CG1-CD2 4.06Å; V709-L810 HydrophobicContact CG2-CD2 4.47Å
710	V	88.7	Confident	75.3	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	152.3	179.4	-60.3	0	0	0	0	111.2	Y736 V737 L752 C771 L772 F774 M799	V710-Y736 HydrophobicContact CB-CD1 4.45Å; V710-Y736 HydrophobicContact CG2-CD1 3.76Å; V710-Y736 HydrophobicContact CG2-CG 3.96Å; V710-V737 CarbonylContact C-O 3.53Å; V710-V737 WeakPolarHBondContact CA-O 3.45Å; V710-V737 WeakPolarHBondContact CB-O 3.33Å; V710-L752 HydrophobicContact CG1-CD1 3.56Å; V710-C771 WeakPolarHBondContact O-CA 3.48Å; V710-L772 HydrophobicContact CG2-CB 3.81Å; V710-L772 PolarHBondContact N-O 2.7Å; V710-L772 PolarHBondContact O-N 3.04Å; V710-F774 HydrophobicContact CG1-CD1 4.06Å; V710-F774 HydrophobicContact CG1-CE1 3.63Å; V710-M799 HydrophobicContact CB-SD 4.43Å; V710-M799 HydrophobicContact CG1-SD 4.09Å; V710-M799 HydrophobicContact CG2-CE 3.97Å; V710-M799 HydrophobicContact CG2-SD 3.57Å; V710-M799 VanDerWaalsContact CG2-SD 3.57Å
711	I	89.1	Confident	72.8	Confident	44 Å²	44	59.2 Å²	59.2	23%	0.226	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	144.2	179.5	-56.9	175.8	0	0	0	108.1	S713 Y736 V737 P770	I711-S713 PolarHBondContact O-N 3.14Å; I711-Y736 WeakPolarHBondContact O-CA 3.49Å; I711-V737 PolarHBondContact N-O 3.47Å; I711-V737 PolarHBondContact O-N 3.41Å; I711-P770 WeakPolarHBondContact CA-O 3.44Å
712	L	88.9	Confident	70.1	Confident	17 Å²	17	62.7 Å²	62.7	9%	0.089	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	122	175.2	-176.6	67.8	0	0	0	110.2	K717 P734 Y736 P768 P770	L712-K717 HydrophobicContact CD2-CG 4.33Å; L712-P734 HydrophobicContact CD1-CB 3.77Å; L712-Y736 HydrophobicContact CB-CD1 4.35Å; L712-Y736 HydrophobicContact CB-CE1 3.96Å; L712-Y736 HydrophobicContact CD1-CE1 4.06Å; L712-Y736 HydrophobicContact CD1-CE2 4.27Å; L712-P768 HydrophobicContact CD1-CB 3.94Å; L712-P768 HydrophobicContact CD1-CG 4.38Å; L712-P768 HydrophobicContact CD2-CB 3.98Å; L712-P768 HydrophobicContact CD2-CG 3.78Å; L712-P770 PolarHBondContact N-O 3.11Å
713	S	84.4	Confident	67.6	Low	14 Å²	14	67.5 Å²	67.5	10%	0.098	37%	0.369	C	S	.	.			trans	-62.6	143.2	-179.6	-179.4	0	0	0	0	111.5	I711 L715 S716 I735	I711-S713 PolarHBondContact O-N 3.14Å; S713-L715 PolarHBondContact O-N 3.42Å; S713-L715 PolarHBondContact OG-N 3.24Å; S713-S716 WeakPolarHBondContact O-CB 3.39Å; S713-S716 PolarHBondContact O-N 3.07Å; S713-I735 VanDerWaalsContact CB-O 3.22Å; S713-I735 WeakPolarHBondContact CB-O 3.35Å; S713-I735 PolarHBondContact N-O 2.88Å
714	E	71.6	Confident	65.2	Low	157 Å²	157	74.5 Å²	74.5	73%	0.734	41%	0.412	S	S	*	.	H	α-helix	trans	-61.7	-30.3	174.6	-63.4	-170.2	164.7	0	0	112.3	S716 K717 S718	E714-S716 PolarHBondContact O-N 3.35Å; E714-S716 VanDerWaalsContact O-N 3.16Å; E714-K717 WeakPolarHBondContact O-CA 3.12Å; E714-K717 WeakPolarHBondContact O-CB 3.25Å; E714-K717 PolarHBondContact O-N 3.09Å; E714-S718 PolarHBondContact O-N 2.94Å
715	L	63.5	Low	63.1	Low	109 Å²	109	83.5 Å²	83.5	57%	0.571	45%	0.453	S	S	*	.	H	α-helix	trans	-57.4	-30.2	172.5	-69.6	166.1	0	0	0	111.9	S713 Y719	S713-L715 PolarHBondContact O-N 3.42Å; S713-L715 PolarHBondContact OG-N 3.24Å; L715-Y719 WeakPolarHBondContact O-CD2 3.26Å; L715-Y719 WeakPolarHBondContact O-CE2 3.48Å
716	S	61.2	Low	60.5	Low	26 Å²	26	94.4 Å²	94.4	18%	0.182	49%	0.494	C	S	.	.	H	α-helix	trans	-80.6	-18.4	174.9	-61.6	0	0	0	0	113.4	S713 E714 I735	S713-S716 WeakPolarHBondContact O-CB 3.39Å; S713-S716 PolarHBondContact O-N 3.07Å; E714-S716 PolarHBondContact O-N 3.35Å; E714-S716 VanDerWaalsContact O-N 3.16Å; S716-I735 WeakPolarHBondContact OG-CB 3.3Å; S716-I735 PolarHBondContact OG-N 3.5Å; S716-I735 PolarHBondContact OG-O 3.15Å
717	K	57.4	Low	58.2	Low	121 Å²	121	100.4 Å²	100.4	53%	0.526	53%	0.527	S	S	.	.	H	α-helix	trans	-83	-28.3	178.5	-62	179.2	-174.6	170.7	0	112.5	L712 E714 Y719	L712-K717 HydrophobicContact CD2-CG 4.33Å; E714-K717 WeakPolarHBondContact O-CA 3.12Å; E714-K717 WeakPolarHBondContact O-CB 3.25Å; E714-K717 PolarHBondContact O-N 3.09Å; K717-Y719 VanDerWaalsContact C-N 3.32Å; K717-Y719 PolarHBondContact O-N 2.93Å
718	S	49.2	Very low	56.1	Low	102 Å²	102	103.5 Å²	103.5	71%	0.713	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-74.6	-8.6	-178.1	-105	0	0	0	0	115.9	E714 K720	E714-S718 PolarHBondContact O-N 2.94Å; S718-K720 PolarHBondContact O-N 3.41Å; S718-K720 VanDerWaalsContact O-N 3.11Å
719	Y	48.1	Very low	53.6	Low	184 Å²	184	111.8 Å²	111.8	72%	0.722	58%	0.583	S	S	*	*	G	3₁₀ helix	trans	-75.9	7.4	-179	-79.3	-81.4	0	0	0	115.1	L715 K717	L715-Y719 WeakPolarHBondContact O-CD2 3.26Å; L715-Y719 WeakPolarHBondContact O-CE2 3.48Å; K717-Y719 VanDerWaalsContact C-N 3.32Å; K717-Y719 PolarHBondContact O-N 2.93Å
720	K	45.4	Very low	51.3	Low	204 Å²	204	116.9 Å²	116.9	89%	0.887	61%	0.61	S	S	*	*	G	3₁₀ helix	trans	-93.4	4.8	179.6	-75.1	-168.2	175.1	-175.8	0	115.2	S718	S718-K720 PolarHBondContact O-N 3.41Å; S718-K720 VanDerWaalsContact O-N 3.11Å
721	G	37.8	Very low	49.6	Very low	61 Å²	61	119.8 Å²	119.8	63%	0.629	63%	0.63	S	S	*	*	S	Bend	trans	-112.9	116.9	175	0	0	0	0	0	112	D723	G721-D723 PolarHBondContact O-N 3.04Å
722	G	32.4	Very low	48.3	Very low	76 Å²	76	126.1 Å²	126.1	78%	0.784	66%	0.659	S	S	*	*			trans	-74.6	99.9	175.7	0	0	0	0	0	111.3
723	D	29.9	Very low	47.8	Very low	152 Å²	152	128 Å²	128	81%	0.813	67%	0.667	S	S	*	*			trans	168.7	96.9	142.7	-87.2	-23.5	0	0	0	109.6	G721	G721-D723 PolarHBondContact O-N 3.04Å
724	T	32.8	Very low	47.8	Very low	147 Å²	147	127.9 Å²	127.9	90%	0.902	67%	0.666	S	S	*	*			trans	178.7	85.4	146.6	22	0	0	0	0	108.8	R726	T724-R726 PolarHBondContact O-N 3.28Å; T724-R726 VanDerWaalsContact O-N 3.14Å
725	Q	31.2	Very low	48.6	Very low	192 Å²	192	122 Å²	122	90%	0.897	64%	0.639	S	S	*	*			trans	-69.5	99.4	161	-69.5	178.3	6.1	0	0	108.6
726	R	29.2	Very low	49.8	Very low	234 Å²	234	116.8 Å²	116.8	88%	0.883	61%	0.612	S	S	*	*			trans	-179.5	122.8	145.8	-100.5	158.2	-171.1	-162.1	3.4	110.2	T724	T724-R726 PolarHBondContact O-N 3.28Å; T724-R726 VanDerWaalsContact O-N 3.14Å
727	L	30	Very low	51	Low	169 Å²	169	116.3 Å²	116.3	89%	0.885	61%	0.608	S	S	*	*	S	Bend	trans	72.9	86	167.4	-46.9	158.8	0	0	0	112.7
728	V	33.2	Very low	51.9	Low	128 Å²	128	112.2 Å²	112.2	78%	0.776	59%	0.59	S	S	*	*				-156.1	119.9	70.3	171	0	0	0	0	108.1	N730	V728-N730 PolarHBondContact O-N 3.12Å
729	K	32.8	Very low	52.6	Low	198 Å²	198	109 Å²	109	86%	0.861	57%	0.573	S	S	*	*			trans	-67.6	97.5	164.8	-73.9	177.6	176.3	178	0	107.5
730	N	40.8	Very low	53	Low	120 Å²	120	108.4 Å²	108.4	64%	0.642	58%	0.575	S	S	*	*	S	Bend	trans	163.9	117.3	138.3	-81.7	-24.4	0	0	0	112.8	V728	V728-N730 PolarHBondContact O-N 3.12Å
731	S	52.5	Low	53.1	Low	60 Å²	60	101.3 Å²	101.3	42%	0.42	55%	0.548	S	S	.	.			trans	83.8	107.4	154.7	69.3	0	0	0	0	119.1	H733 R796	S731-H733 WeakPolarHBondContact CB-CD2 3.23Å; S731-H733 PolarHBondContact O-N 2.89Å; S731-R796 PolarHBondContact OG-NH1 3Å
732	H	62.7	Low	53.2	Low	177 Å²	177	104.4 Å²	104.4	82%	0.819	55%	0.549	S	S	*	.			trans	-62.5	43.1	164.9	-67.9	-70	0	0	0	113.9
733	H	78	Confident	53.4	Low	56 Å²	56	107.8 Å²	107.8	26%	0.259	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-98	135.4	-178.3	-67.2	-35.9	0	0	0	111.3	S731 I735 L753 Y761 L765	S731-H733 WeakPolarHBondContact CB-CD2 3.23Å; S731-H733 PolarHBondContact O-N 2.89Å; H733-I735 PolarHBondContact O-N 3.06Å; H733-L753 HydrophobicContact CB-CD2 3.93Å; H733-Y761 AromaticContact CE1-CZ 3.78Å; H733-Y761 PolarHBondContact CE1-OH 3.28Å; H733-Y761 PolarHBondContact NE2-OH 2.89Å; H733-Y761 VanDerWaalsContact NE2-OH 3.12Å; H733-L765 WeakPolarHBondContact ND1-CD2 3.48Å
734	P	85.1	Confident	53.6	Low	12 Å²	12	106.5 Å²	106.5	8%	0.078	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-65.9	127.9	177	27.6	-34.3	0	0	0	110.6	L712 Y736 P768	L712-P734 HydrophobicContact CD1-CB 3.77Å; P734-Y736 HydrophobicContact CB-CE2 3.91Å; P734-Y736 HydrophobicContact CG-CE2 4.11Å; P734-P768 HydrophobicContact CB-CB 3.71Å; P734-P768 HydrophobicContact CB-CG 4.48Å; P734-P768 HydrophobicContact CG-CB 4.18Å
735	I	87.7	Confident	53.7	Low	33 Å²	33	105.3 Å²	105.3	17%	0.169	54%	0.54	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	132.3	178.8	-58.5	173	0	0	0	108.7	S713 S716 H733 E751 L753	S713-I735 VanDerWaalsContact CB-O 3.22Å; S713-I735 WeakPolarHBondContact CB-O 3.35Å; S713-I735 PolarHBondContact N-O 2.88Å; S716-I735 WeakPolarHBondContact OG-CB 3.3Å; S716-I735 PolarHBondContact OG-N 3.5Å; S716-I735 PolarHBondContact OG-O 3.15Å; H733-I735 PolarHBondContact O-N 3.06Å; I735-E751 HydrophobicContact CG2-CB 3.81Å; I735-E751 HydrophobicContact CG2-CG 3.87Å; I735-L753 HydrophobicContact CG1-CD2 4.15Å
736	Y	89.4	Confident	54.1	Low	0 Å²	0	101.6 Å²	101.6	0%	0	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	148.5	177.8	-69.4	-90.9	0	0	0	110.4	V710 I711 L712 P734 L752 I754 P769 L772 M799	V710-Y736 HydrophobicContact CB-CD1 4.45Å; V710-Y736 HydrophobicContact CG2-CD1 3.76Å; V710-Y736 HydrophobicContact CG2-CG 3.96Å; I711-Y736 WeakPolarHBondContact O-CA 3.49Å; L712-Y736 HydrophobicContact CB-CD1 4.35Å; L712-Y736 HydrophobicContact CB-CE1 3.96Å; L712-Y736 HydrophobicContact CD1-CE1 4.06Å; L712-Y736 HydrophobicContact CD1-CE2 4.27Å; P734-Y736 HydrophobicContact CB-CE2 3.91Å; P734-Y736 HydrophobicContact CG-CE2 4.11Å; Y736-L752 PolarHBondContact N-O 3Å; Y736-L752 PolarHBondContact O-N 3.32Å; Y736-I754 HydrophobicContact CD2-CG1 4.42Å; Y736-I754 HydrophobicContact CE2-CD1 3.76Å; Y736-I754 HydrophobicContact CE2-CG1 3.97Å; Y736-P769 VanDerWaalsContact CE1-O 3.27Å; Y736-P769 WeakPolarHBondContact CE1-O 3.45Å; Y736-P769 WeakPolarHBondContact OH-CD 3.45Å; Y736-P769 PolarHBondContact OH-O 3.21Å; Y736-L772 HydrophobicContact CD1-CD1 3.87Å; Y736-L772 HydrophobicContact CD1-CG 4.38Å; Y736-L772 HydrophobicContact CD2-CD1 4.2Å; Y736-L772 HydrophobicContact CE1-CD1 3.34Å; Y736-L772 HydrophobicContact CE1-CG 3.8Å; Y736-L772 HydrophobicContact CE2-CD1 3.7Å; Y736-L772 HydrophobicContact CG-CD1 4.28Å; Y736-M799 HydrophobicContact CD2-CE 3.7Å; Y736-M799 HydrophobicContact CE2-CE 4.47Å; Y736-M799 HydrophobicContact CG-CE 3.81Å
737	V	85.3	Confident	54.8	Low	17 Å²	17	97.1 Å²	97.1	10%	0.103	52%	0.523	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	152.1	175.6	-67.4	0	0	0	0	109.7	V710 I711 G739 P749	V710-V737 CarbonylContact C-O 3.53Å; V710-V737 WeakPolarHBondContact CA-O 3.45Å; V710-V737 WeakPolarHBondContact CB-O 3.33Å; I711-V737 PolarHBondContact N-O 3.47Å; I711-V737 PolarHBondContact O-N 3.41Å; V737-G739 PolarHBondContact O-N 3.5Å; V737-P749 HydrophobicContact CG1-CB 4.12Å; V737-P749 HydrophobicContact CG1-CG 4.41Å
738	H	76.8	Confident	55.9	Low	34 Å²	34	94 Å²	94	16%	0.157	52%	0.516	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	132.7	174.4	-74.3	-79.4	0	0	0	110.6	F395 D707 K740 T741 F774	F395-H738 AromaticContact CZ-NE2 3.58Å; D707-H738 PolarHBondContact O-CE1 3.08Å; D707-H738 VanDerWaalsContact O-CE1 3.22Å; D707-H738 PolarHBondContact O-ND1 3.18Å; H738-K740 PolarHBondContact O-N 3.21Å; H738-T741 PolarHBondContact O-N 3.05Å; H738-T741 VanDerWaalsContact O-N 3.08Å; H738-F774 AromaticContact CE1-CZ 3.94Å
739	G	62.9	Low	57.2	Low	34 Å²	34	91 Å²	91	35%	0.351	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-18	-174.9	0	0	0	0	0	115	V737	V737-G739 PolarHBondContact O-N 3.5Å
740	K	56.9	Low	59.1	Low	173 Å²	173	84.9 Å²	84.9	75%	0.752	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-10.4	178.3	-68.8	-175.7	178.3	-179.4	0	114.3	H738	H738-K740 PolarHBondContact O-N 3.21Å
741	T	47.7	Very low	61	Low	55 Å²	55	84 Å²	84	34%	0.337	47%	0.466	S	S	.	.			trans	-97.1	8.3	-167.1	-40.9	0	0	0	0	113.7	H738 N743 P749	H738-T741 PolarHBondContact O-N 3.05Å; H738-T741 VanDerWaalsContact O-N 3.08Å; T741-N743 PolarHBondContact O-N 3.07Å; T741-N743 VanDerWaalsContact O-N 3.16Å; T741-P749 HydrophobicContact CG2-CB 4.43Å
742	I	41.1	Very low	62.6	Low	125 Å²	125	81.1 Å²	81.1	64%	0.641	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-13.6	-175.8	-58.4	175.2	0	0	0	112.4
743	N	35.4	Very low	63.9	Low	148 Å²	148	73.4 Å²	73.4	79%	0.791	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.7	17.9	-172.5	-69.4	-12.5	0	0	0	116.8	T741	T741-N743 PolarHBondContact O-N 3.07Å; T741-N743 VanDerWaalsContact O-N 3.16Å
744	L	34.7	Very low	64.5	Low	124 Å²	124	71 Å²	71	65%	0.649	40%	0.399	S	S	*	.			trans	-113	106.7	176.2	-76.5	119.4	0	0	0	112	T746	L744-T746 VanDerWaalsContact C-N 3.31Å; L744-T746 PolarHBondContact O-N 3.28Å
745	S	34.1	Very low	64.7	Low	123 Å²	123	70.4 Å²	70.4	86%	0.86	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	19.4	-170.5	52.2	0	0	0	0	116.5
746	T	40	Very low	64.6	Low	113 Å²	113	71.7 Å²	71.7	69%	0.693	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.2	-1.2	-172.4	54.6	0	0	0	0	116.7	L744	L744-T746 VanDerWaalsContact C-N 3.31Å; L744-T746 PolarHBondContact O-N 3.28Å
747	N	44.5	Very low	64.2	Low	140 Å²	140	76 Å²	76	75%	0.749	43%	0.426	S	S	*	.	S	Bend	trans	-141.9	129.2	170.3	-79.8	-50.2	0	0	0	109.8
748	S	52.1	Low	64.4	Low	103 Å²	103	75.7 Å²	75.7	72%	0.72	42%	0.424	S	S	*	.			trans	-50.9	125.7	175.2	54.3	0	0	0	0	109.7	Q750	S748-Q750 PolarHBondContact O-N 3.45Å
749	P	60.9	Low	65	Low	65 Å²	65	75 Å²	75	42%	0.422	42%	0.421	S	S	.	.			trans	-58.4	136.1	-178	24.3	-33.2	0	0	0	109.5	V737 T741 E751	V737-P749 HydrophobicContact CG1-CB 4.12Å; V737-P749 HydrophobicContact CG1-CG 4.41Å; T741-P749 HydrophobicContact CG2-CB 4.43Å; P749-E751 PolarHBondContact O-N 2.92Å; P749-E751 VanDerWaalsContact O-N 3.1Å
750	Q	72.4	Confident	66.3	Low	71 Å²	71	73.5 Å²	73.5	33%	0.332	41%	0.405	S	S	.	.			trans	-64.6	115.5	178.3	-174.6	170.5	27.8	0	0	109.7	F395 S748 V797	F395-Q750 VanDerWaalsContact CE2-OE1 3.31Å; S748-Q750 PolarHBondContact O-N 3.45Å; Q750-V797 HydrophobicContact CG-CG2 4.33Å
751	E	80.8	Confident	67.8	Low	101 Å²	101	67.6 Å²	67.6	47%	0.472	38%	0.378	S	S	.	.			trans	-77.4	126.9	-179.7	-64.3	-175.8	162.4	0	0	111	I735 P749	I735-E751 HydrophobicContact CG2-CB 3.81Å; I735-E751 HydrophobicContact CG2-CG 3.87Å; P749-E751 PolarHBondContact O-N 2.92Å; P749-E751 VanDerWaalsContact O-N 3.1Å
752	L	86.2	Confident	69.7	Low	0 Å²	0	69.2 Å²	69.2	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.6	-179.2	-67.4	159.6	0	0	0	110.3	F395 V710 Y736 F774 V797 M799	F395-L752 HydrophobicContact CE2-CD2 4.21Å; F395-L752 HydrophobicContact CZ-CD2 4.1Å; V710-L752 HydrophobicContact CG1-CD1 3.56Å; Y736-L752 PolarHBondContact N-O 3Å; Y736-L752 PolarHBondContact O-N 3.32Å; L752-F774 HydrophobicContact CD1-CE1 4.43Å; L752-V797 WeakPolarHBondContact CA-O 3.47Å; L752-V797 HydrophobicContact CD2-CB 3.77Å; L752-V797 HydrophobicContact CD2-CG1 3.45Å; L752-V797 VanDerWaalsContact CD2-CG1 3.45Å; L752-M799 HydrophobicContact CB-CE 4.23Å; L752-M799 HydrophobicContact CB-CG 4.03Å; L752-M799 HydrophobicContact CB-SD 3.92Å; L752-M799 HydrophobicContact CD1-SD 4.46Å; L752-M799 HydrophobicContact CD2-CG 4.13Å
753	L	90.1	Very high	71.8	Confident	14 Å²	14	65.3 Å²	65.3	7%	0.073	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	149.4	-179.4	-65.7	159.1	0	0	0	109.7	H733 I735 H755 R796 V797 F798 M799	H733-L753 HydrophobicContact CB-CD2 3.93Å; I735-L753 HydrophobicContact CG1-CD2 4.15Å; L753-H755 PolarHBondContact O-N 2.99Å; L753-R796 HydrophobicContact CD1-CB 4.03Å; L753-R796 HydrophobicContact CD1-CG 4.2Å; L753-V797 PolarHBondContact N-O 3.08Å; L753-F798 HydrophobicContact CB-CD1 3.73Å; L753-F798 HydrophobicContact CB-CE1 3.92Å; L753-F798 HydrophobicContact CD1-CD1 4.5Å; L753-F798 HydrophobicContact CD1-CE1 4.02Å; L753-F798 HydrophobicContact CD1-CZ 4.33Å; L753-F798 CarbonylContact O-C 3.57Å; L753-F798 VanDerWaalsContact O-CA 3.23Å; L753-F798 WeakPolarHBondContact O-CA 3.49Å; L753-M799 PolarHBondContact O-N 3.46Å
754	I	91.1	Very high	74.3	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.026	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	130.2	170.6	-64.4	165.5	0	0	0	108.6	Y736 S758 Y761 S764 L772 M799 V802	Y736-I754 HydrophobicContact CD2-CG1 4.42Å; Y736-I754 HydrophobicContact CE2-CD1 3.76Å; Y736-I754 HydrophobicContact CE2-CG1 3.97Å; I754-S758 VanDerWaalsContact CG2-CB 3.5Å; I754-Y761 HydrophobicContact CB-CD2 4.45Å; I754-Y761 HydrophobicContact CG2-CD2 4.28Å; I754-Y761 WeakPolarHBondContact O-CD2 3.38Å; I754-S764 WeakPolarHBondContact CD1-OG 3.42Å; I754-L772 HydrophobicContact CD1-CD1 3.8Å; I754-L772 HydrophobicContact CG1-CD1 4.01Å; I754-M799 HydrophobicContact CG1-CE 4.03Å; I754-V802 HydrophobicContact CG2-CG2 4.49Å
755	H	87.8	Confident	76.8	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	32%	0.321	C	S	.	.			trans	-64	140.2	177.7	-169.6	-94.3	0	0	0	111.3	L753 E757 S758 Y783 F798 M799 R800	L753-H755 PolarHBondContact O-N 2.99Å; H755-E757 VanDerWaalsContact CE1-CG 3.47Å; H755-E757 WeakPolarHBondContact CE1-CG 3.39Å; H755-E757 IonicContact CE1-OE2 3.44Å; H755-E757 PolarHBondContact CE1-OE2 3.38Å; H755-E757 VanDerWaalsContact CE1-OE2 3.32Å; H755-E757 WeakPolarHBondContact ND1-CB 3.32Å; H755-E757 PolarHBondContact ND1-N 3.36Å; H755-E757 IonicContact ND1-OE2 2.77Å; H755-E757 PolarHBondContact O-N 3.17Å; H755-E757 VanDerWaalsContact O-N 3.1Å; H755-S758 WeakPolarHBondContact O-CB 3.42Å; H755-S758 PolarHBondContact O-N 2.86Å; H755-Y783 PolarHBondContact CE1-OH 3.27Å; H755-Y783 AromaticContact NE2-CE2 3.74Å; H755-Y783 AromaticContact NE2-CZ 3.65Å; H755-Y783 PolarHBondContact NE2-OH 2.94Å; H755-F798 HydrophobicContact CB-CB 3.97Å; H755-M799 WeakPolarHBondContact CB-O 3.35Å; H755-M799 PolarHBondContact N-O 3.48Å; H755-R800 HydrophobicContact CB-CG 3.87Å; H755-R800 PolarHBondContact CE1-NE 3.21Å; H755-R800 PolarHBondContact NE2-NE 2.89Å; H755-R800 PolarHBondContact NE2-NH2 3.35Å
756	P	85.5	Confident	79.2	Confident	60 Å²	60	56.7 Å²	56.7	39%	0.39	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-27.4	-178.9	-28.4	36	0	0	0	115.5	S758 Y761	P756-S758 VanDerWaalsContact C-N 3.28Å; P756-S758 PolarHBondContact O-N 3.31Å; P756-Y761 HydrophobicContact CB-CD1 4.39Å; P756-Y761 HydrophobicContact CB-CE1 4.23Å; P756-Y761 HydrophobicContact CB-CE2 4.43Å; P756-Y761 HydrophobicContact CG-CE2 4.19Å
757	E	82.7	Confident	81.5	Confident	91 Å²	91	57.5 Å²	57.5	43%	0.425	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-12.2	175.6	-62.8	-178.8	147.3	0	0	114.2	H755 Q759	H755-E757 VanDerWaalsContact CE1-CG 3.47Å; H755-E757 WeakPolarHBondContact CE1-CG 3.39Å; H755-E757 IonicContact CE1-OE2 3.44Å; H755-E757 PolarHBondContact CE1-OE2 3.38Å; H755-E757 VanDerWaalsContact CE1-OE2 3.32Å; H755-E757 WeakPolarHBondContact ND1-CB 3.32Å; H755-E757 PolarHBondContact ND1-N 3.36Å; H755-E757 IonicContact ND1-OE2 2.77Å; H755-E757 PolarHBondContact O-N 3.17Å; H755-E757 VanDerWaalsContact O-N 3.1Å; E757-Q759 PolarHBondContact O-NE2 3.48Å
758	S	89.3	Confident	83.7	Confident	9 Å²	9	52.7 Å²	52.7	6%	0.063	29%	0.293	C	S	.	.	S	Bend	trans	-65.5	137.5	176.6	-177.4	0	0	0	0	109.9	D597 I754 H755 P756 L760 Y761	D597-S758 VanDerWaalsContact CG-OG 3.27Å; D597-S758 PolarHBondContact OD1-OG 2.92Å; D597-S758 WeakPolarHBondContact OD2-CB 3.42Å; D597-S758 PolarHBondContact OD2-OG 3.29Å; I754-S758 VanDerWaalsContact CG2-CB 3.5Å; H755-S758 WeakPolarHBondContact O-CB 3.42Å; H755-S758 PolarHBondContact O-N 2.86Å; P756-S758 VanDerWaalsContact C-N 3.28Å; P756-S758 PolarHBondContact O-N 3.31Å; S758-L760 PolarHBondContact O-N 3.46Å; S758-L760 VanDerWaalsContact O-N 3.14Å; S758-L760 PolarHBondContact OG-N 2.93Å; S758-Y761 VanDerWaalsContact O-CB 3.25Å; S758-Y761 WeakPolarHBondContact O-CB 3.47Å; S758-Y761 PolarHBondContact O-N 3.43Å
759	Q	87.7	Confident	85.5	Confident	21 Å²	21	48.3 Å²	48.3	10%	0.098	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.2	173.5	-58.5	-50.2	-59.5	0	0	112.4	Q588 R592 D597 E757	Q588-Q759 VanDerWaalsContact CD-NE2 3.32Å; R592-Q759 HydrophobicContact CG-CB 4.13Å; R592-Q759 PolarHBondContact NE-O 2.9Å; R592-Q759 PolarHBondContact NH2-O 3.22Å; D597-Q759 VanDerWaalsContact OD1-CB 3.3Å; D597-Q759 WeakPolarHBondContact OD1-CB 3.44Å; D597-Q759 WeakPolarHBondContact OD1-CG 3.21Å; D597-Q759 PolarHBondContact OD1-N 3Å; E757-Q759 PolarHBondContact O-NE2 3.48Å
760	L	90.9	Very high	86.9	Confident	2 Å²	2	49 Å²	49	1%	0.01	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-11.9	174.7	-65.9	177.8	0	0	0	113.4	P594 S758 T762 S763 S764 L772 V802 I804	P594-L760 WeakPolarHBondContact O-CD2 3.46Å; S758-L760 PolarHBondContact O-N 3.46Å; S758-L760 VanDerWaalsContact O-N 3.14Å; S758-L760 PolarHBondContact OG-N 2.93Å; L760-T762 PolarHBondContact O-N 2.98Å; L760-S763 PolarHBondContact O-N 3.32Å; L760-S763 PolarHBondContact O-OG 3.28Å; L760-S764 WeakPolarHBondContact O-CB 3.45Å; L760-S764 PolarHBondContact O-N 3.46Å; L760-S764 PolarHBondContact O-OG 3.25Å; L760-L772 HydrophobicContact CD1-CD2 4.25Å; L760-V802 HydrophobicContact CD1-CB 4.27Å; L760-V802 HydrophobicContact CD1-CG1 3.89Å; L760-I804 HydrophobicContact CD1-CG1 3.84Å; L760-I804 HydrophobicContact CD2-CD1 4.12Å; L760-I804 HydrophobicContact CD2-CG1 4.32Å
761	Y	89.7	Confident	87.8	Confident	48 Å²	48	45.7 Å²	45.7	19%	0.188	25%	0.251	C	S	.	.	H	α-helix	trans	-56.9	-55.8	-171.4	-179	-106.3	0	0	0	112.7	H733 I754 P756 S758 S763 S764 L765	H733-Y761 AromaticContact CE1-CZ 3.78Å; H733-Y761 PolarHBondContact CE1-OH 3.28Å; H733-Y761 PolarHBondContact NE2-OH 2.89Å; H733-Y761 VanDerWaalsContact NE2-OH 3.12Å; I754-Y761 HydrophobicContact CB-CD2 4.45Å; I754-Y761 HydrophobicContact CG2-CD2 4.28Å; I754-Y761 WeakPolarHBondContact O-CD2 3.38Å; P756-Y761 HydrophobicContact CB-CD1 4.39Å; P756-Y761 HydrophobicContact CB-CE1 4.23Å; P756-Y761 HydrophobicContact CB-CE2 4.43Å; P756-Y761 HydrophobicContact CG-CE2 4.19Å; S758-Y761 VanDerWaalsContact O-CB 3.25Å; S758-Y761 WeakPolarHBondContact O-CB 3.47Å; S758-Y761 PolarHBondContact O-N 3.43Å; Y761-S763 VanDerWaalsContact C-N 3.35Å; Y761-S763 PolarHBondContact O-N 2.91Å; Y761-S764 PolarHBondContact O-N 3.39Å; Y761-S764 PolarHBondContact O-OG 2.88Å; Y761-L765 WeakPolarHBondContact O-CG 3.38Å; Y761-L765 PolarHBondContact O-N 2.98Å
762	T	85.9	Confident	88.4	Confident	89 Å²	89	40.9 Å²	40.9	55%	0.546	23%	0.229	S	C	.	.	H	α-helix	trans	-66.9	-34.2	-178.7	-46.9	0	0	0	0	112.9	L760	L760-T762 PolarHBondContact O-N 2.98Å
763	S	86.2	Confident	88.7	Confident	43 Å²	43	40.9 Å²	40.9	30%	0.301	23%	0.229	S	C	.	.	H	α-helix	trans	-71.3	-35.6	179.1	41.1	0	0	0	0	112.3	R592 L760 Y761 L765 N766 N767	R592-S763 VanDerWaalsContact NH2-N 3.1Å; R592-S763 PolarHBondContact NH2-OG 3.41Å; L760-S763 PolarHBondContact O-N 3.32Å; L760-S763 PolarHBondContact O-OG 3.28Å; Y761-S763 VanDerWaalsContact C-N 3.35Å; Y761-S763 PolarHBondContact O-N 2.91Å; S763-L765 VanDerWaalsContact C-N 3.25Å; S763-L765 PolarHBondContact O-N 3.01Å; S763-N766 PolarHBondContact O-N 3.35Å; S763-N767 PolarHBondContact O-N 2.73Å
764	S	87.4	Confident	88.8	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-72.4	-19.6	-176.4	64.9	0	0	0	0	113	I754 L760 Y761 N766 P768	I754-S764 WeakPolarHBondContact CD1-OG 3.42Å; L760-S764 WeakPolarHBondContact O-CB 3.45Å; L760-S764 PolarHBondContact O-N 3.46Å; L760-S764 PolarHBondContact O-OG 3.25Å; Y761-S764 PolarHBondContact O-N 3.39Å; Y761-S764 PolarHBondContact O-OG 2.88Å; S764-N766 VanDerWaalsContact C-N 3.27Å; S764-N766 PolarHBondContact O-N 3.43Å; S764-P768 WeakPolarHBondContact O-CA 3.4Å; S764-P768 WeakPolarHBondContact O-CB 3.48Å; S764-P768 WeakPolarHBondContact O-CD 3.33Å
765	L	86.6	Confident	88.7	Confident	69 Å²	69	40.9 Å²	40.9	36%	0.361	23%	0.229	S	C	.	.	H	α-helix	trans	-61.6	-36.6	172.6	-59.9	179.8	0	0	0	112.2	H733 Y761 S763	H733-L765 WeakPolarHBondContact ND1-CD2 3.48Å; Y761-L765 WeakPolarHBondContact O-CG 3.38Å; Y761-L765 PolarHBondContact O-N 2.98Å; S763-L765 VanDerWaalsContact C-N 3.25Å; S763-L765 PolarHBondContact O-N 3.01Å
766	N	85.3	Confident	88.5	Confident	144 Å²	144	44.3 Å²	44.3	77%	0.77	25%	0.245	S	C	*	.	H	α-helix	trans	-95.8	-41.4	-178.4	-65.4	-22	0	0	0	112.2	S763 S764	S763-N766 PolarHBondContact O-N 3.35Å; S764-N766 VanDerWaalsContact C-N 3.27Å; S764-N766 PolarHBondContact O-N 3.43Å
767	N	87.9	Confident	88.2	Confident	131 Å²	131	41.7 Å²	41.7	70%	0.701	23%	0.229	S	C	*	.	S	Bend	trans	-135.9	81.9	-178.7	-168.1	16	0	0	0	109.8	S763 P769	S763-N767 PolarHBondContact O-N 2.73Å; N767-P769 WeakPolarHBondContact O-CD 3.5Å
768	P	90.2	Very high	87.9	Confident	38 Å²	38	37.5 Å²	37.5	25%	0.247	21%	0.209	C	C	.	.			trans	-66.6	123.7	-177.2	25.2	-32.4	0	0	0	110.6	L712 P734 S764	L712-P768 HydrophobicContact CD1-CB 3.94Å; L712-P768 HydrophobicContact CD1-CG 4.38Å; L712-P768 HydrophobicContact CD2-CB 3.98Å; L712-P768 HydrophobicContact CD2-CG 3.78Å; P734-P768 HydrophobicContact CB-CB 3.71Å; P734-P768 HydrophobicContact CB-CG 4.48Å; P734-P768 HydrophobicContact CG-CB 4.18Å; S764-P768 WeakPolarHBondContact O-CA 3.4Å; S764-P768 WeakPolarHBondContact O-CB 3.48Å; S764-P768 WeakPolarHBondContact O-CD 3.33Å
769	P	91.4	Very high	87	Confident	12 Å²	12	37.7 Å²	37.7	8%	0.078	21%	0.21	C	C	.	.			trans	-60.4	140.6	175.5	-23	33.6	0	0	0	110.7	Y736 N767 C771 L772 I804	Y736-P769 VanDerWaalsContact CE1-O 3.27Å; Y736-P769 WeakPolarHBondContact CE1-O 3.45Å; Y736-P769 WeakPolarHBondContact OH-CD 3.45Å; Y736-P769 PolarHBondContact OH-O 3.21Å; N767-P769 WeakPolarHBondContact O-CD 3.5Å; P769-C771 PolarHBondContact O-N 3.14Å; P769-L772 HydrophobicContact CB-CD2 3.67Å; P769-L772 HydrophobicContact CB-CG 4.36Å; P769-L772 HydrophobicContact CG-CD2 3.96Å; P769-I804 HydrophobicContact CB-CD1 4.1Å; P769-I804 HydrophobicContact CB-CG1 4Å; P769-I804 HydrophobicContact CB-CG2 4.16Å; P769-I804 HydrophobicContact CG-CD1 3.7Å; P769-I804 HydrophobicContact CG-CG1 3.88Å
770	P	90.2	Very high	85.8	Confident	78 Å²	78	37.1 Å²	37.1	51%	0.506	21%	0.208	S	C	.	.	S	Bend	trans	-70.4	-32.3	-174.9	26.9	-34.5	0	0	0	112.9	I711 L712	I711-P770 WeakPolarHBondContact CA-O 3.44Å; L712-P770 PolarHBondContact N-O 3.11Å
771	C	91.3	Very high	84.1	Confident	2 Å²	2	38.6 Å²	38.6	1%	0.014	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	133.7	-176.1	-171.4	0	0	0	0	110.3	V709 V710 P769 I805	V709-C771 VanDerWaalsContact CG1-SG 3.59Å; V710-C771 WeakPolarHBondContact O-CA 3.48Å; P769-C771 PolarHBondContact O-N 3.14Å; C771-I805 PolarHBondContact O-N 3.23Å
772	L	93.7	Very high	82.3	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	146	-176.9	-63	174.5	0	0	0	111.3	V709 V710 Y736 I754 L760 P769 M799 V802 S803 I804	V709-L772 WeakPolarHBondContact CA-O 3.3Å; V710-L772 HydrophobicContact CG2-CB 3.81Å; V710-L772 PolarHBondContact N-O 2.7Å; V710-L772 PolarHBondContact O-N 3.04Å; Y736-L772 HydrophobicContact CD1-CD1 3.87Å; Y736-L772 HydrophobicContact CD1-CG 4.38Å; Y736-L772 HydrophobicContact CD2-CD1 4.2Å; Y736-L772 HydrophobicContact CE1-CD1 3.34Å; Y736-L772 HydrophobicContact CE1-CG 3.8Å; Y736-L772 HydrophobicContact CE2-CD1 3.7Å; Y736-L772 HydrophobicContact CG-CD1 4.28Å; I754-L772 HydrophobicContact CD1-CD1 3.8Å; I754-L772 HydrophobicContact CG1-CD1 4.01Å; L760-L772 HydrophobicContact CD1-CD2 4.25Å; P769-L772 HydrophobicContact CB-CD2 3.67Å; P769-L772 HydrophobicContact CB-CG 4.36Å; P769-L772 HydrophobicContact CG-CD2 3.96Å; L772-M799 HydrophobicContact CD1-CE 4.25Å; L772-V802 HydrophobicContact CB-CG1 3.97Å; L772-V802 HydrophobicContact CD1-CG1 3.75Å; L772-V802 HydrophobicContact CD2-CG1 3.81Å; L772-V802 HydrophobicContact CG-CG1 4.07Å; L772-S803 WeakPolarHBondContact CA-O 3.39Å; L772-I804 HydrophobicContact CD2-CG1 4.04Å
773	L	91.9	Very high	80.4	Confident	1 Å²	1	39 Å²	39	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	135.6	162.2	-173.8	68.2	0	0	0	108.1	V697 F700 F705 Q708 V709 I775 V802 S803 I805	V697-L773 HydrophobicContact CG1-CD2 4.37Å; F700-L773 HydrophobicContact CB-CD2 3.66Å; F705-L773 HydrophobicContact CB-CD1 3.78Å; F705-L773 WeakPolarHBondContact O-CD1 3.31Å; Q708-L773 HydrophobicContact CB-CD1 4.46Å; V709-L773 HydrophobicContact CG2-CD1 3.97Å; L773-I775 HydrophobicContact CD2-CD1 4.25Å; L773-V802 CarbonylContact O-C 3.46Å; L773-V802 VanDerWaalsContact O-CA 3.27Å; L773-V802 WeakPolarHBondContact O-CA 3.46Å; L773-S803 PolarHBondContact N-O 3.5Å; L773-S803 PolarHBondContact O-N 3.49Å; L773-I805 HydrophobicContact CB-CD1 3.51Å; L773-I805 HydrophobicContact CB-CG1 3.73Å; L773-I805 HydrophobicContact CD1-CD1 4.34Å; L773-I805 HydrophobicContact CG-CD1 4.45Å
774	F	91.5	Very high	78.3	Confident	1 Å²	1	41.1 Å²	41.1	0%	0.004	22%	0.216	C	C	.	.			trans	-119	161.4	164.2	68.2	-87.6	0	0	0	110.3	F395 Q708 V710 H738 L752 E776 A777 M799 V802	F395-F774 HydrophobicContact CD1-CE2 4.38Å; F395-F774 AromaticContact CE1-CE2 3.66Å; F395-F774 HydrophobicContact CE1-CE2 3.66Å; F395-F774 AromaticContact CE1-CZ 3.58Å; F395-F774 HydrophobicContact CE1-CZ 3.58Å; F395-F774 HydrophobicContact CZ-CE2 4.42Å; F395-F774 HydrophobicContact CZ-CZ 4.01Å; Q708-F774 HydrophobicContact CB-CD1 4.19Å; Q708-F774 HydrophobicContact CB-CD2 4.24Å; Q708-F774 HydrophobicContact CB-CE1 3.9Å; Q708-F774 HydrophobicContact CB-CE2 3.96Å; Q708-F774 HydrophobicContact CB-CG 4.36Å; Q708-F774 HydrophobicContact CB-CZ 3.79Å; Q708-F774 WeakPolarHBondContact CB-O 3.27Å; Q708-F774 HydrophobicContact CG-CE2 3.95Å; Q708-F774 HydrophobicContact CG-CZ 3.96Å; Q708-F774 WeakPolarHBondContact O-CD1 3.31Å; Q708-F774 WeakPolarHBondContact O-CE1 3.36Å; Q708-F774 PolarHBondContact O-N 3.33Å; Q708-F774 VanDerWaalsContact O-N 3.12Å; Q708-F774 PolarHBondContact OE1-O 3.07Å; V710-F774 HydrophobicContact CG1-CD1 4.06Å; V710-F774 HydrophobicContact CG1-CE1 3.63Å; H738-F774 AromaticContact CE1-CZ 3.94Å; L752-F774 HydrophobicContact CD1-CE1 4.43Å; F774-E776 WeakPolarHBondContact CD2-O 3.49Å; F774-A777 HydrophobicContact CD2-CB 4.3Å; F774-A777 HydrophobicContact CE2-CB 3.93Å; F774-M799 HydrophobicContact CB-CB 3.81Å; F774-M799 HydrophobicContact CB-CG 4.16Å; F774-M799 HydrophobicContact CB-SD 4.22Å; F774-M799 HydrophobicContact CD1-CG 3.96Å; F774-M799 HydrophobicContact CD1-SD 3.5Å; F774-M799 WeakPolarHBondContact CD1-SD 3.4Å; F774-M799 HydrophobicContact CD2-CG 4.46Å; F774-M799 HydrophobicContact CE1-CG 4.48Å; F774-M799 HydrophobicContact CE1-SD 4.1Å; F774-M799 HydrophobicContact CG-CB 4.1Å; F774-M799 HydrophobicContact CG-CG 3.94Å; F774-M799 HydrophobicContact CG-SD 4.01Å; F774-V802 HydrophobicContact CB-CG2 4.34Å
775	I	89.2	Confident	76	Confident	17 Å²	17	45.3 Å²	45.3	9%	0.087	23%	0.234	C	C	.	.	S	Bend	trans	-109.4	-29.5	177.3	-55.4	-58.7	0	0	0	111.5	F545 L568 L598 F700 F705 Q708 L773 R800 H801	F545-I775 HydrophobicContact CE1-CG2 3.8Å; F545-I775 HydrophobicContact CZ-CG2 3.76Å; L568-I775 HydrophobicContact CD1-CG2 4.42Å; L598-I775 HydrophobicContact CD2-CG1 4.05Å; F700-I775 HydrophobicContact CB-CD1 4.49Å; F700-I775 HydrophobicContact CD1-CD1 3.45Å; F700-I775 VanDerWaalsContact CD1-CD1 3.45Å; F700-I775 HydrophobicContact CE1-CD1 3.85Å; F700-I775 HydrophobicContact CE1-CG1 4.49Å; F700-I775 HydrophobicContact CG-CD1 4.13Å; F705-I775 HydrophobicContact CD1-CD1 3.89Å; F705-I775 HydrophobicContact CE1-CD1 3.83Å; F705-I775 HydrophobicContact CE1-CG2 3.98Å; F705-I775 HydrophobicContact CG-CD1 4.33Å; F705-I775 HydrophobicContact CZ-CD1 4.18Å; F705-I775 HydrophobicContact CZ-CG2 4.27Å; Q708-I775 PolarHBondContact OE1-O 2.93Å; L773-I775 HydrophobicContact CD2-CD1 4.25Å; I775-R800 PolarHBondContact N-O 3.44Å; I775-H801 HydrophobicContact CB-CB 3.95Å; I775-H801 HydrophobicContact CG1-CB 4.02Å
776	E	84	Confident	73.7	Confident	74 Å²	74	51.6 Å²	51.6	35%	0.346	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	150.5	-179.6	-178.2	179.7	-167.4	0	0	109.3	F774 V778 R800	F774-E776 WeakPolarHBondContact CD2-O 3.49Å; E776-V778 HydrophobicContact CG-CG1 4.34Å; E776-R800 HydrophobicContact CB-CB 4.23Å; E776-R800 PolarHBondContact N-O 2.98Å; E776-R800 PolarHBondContact O-N 3.09Å
777	A	80.1	Confident	71.1	Confident	5 Å²	5	48.7 Å²	48.7	4%	0.041	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	139.3	171.9	0	0	0	0	0	109.1	F395 F774 V797 F798	F395-A777 HydrophobicContact CD1-CB 3.72Å; F395-A777 HydrophobicContact CD2-CB 4.43Å; F395-A777 HydrophobicContact CE1-CB 3.88Å; F395-A777 HydrophobicContact CG-CB 4.04Å; F395-A777 HydrophobicContact CZ-CB 4.28Å; F774-A777 HydrophobicContact CD2-CB 4.3Å; F774-A777 HydrophobicContact CE2-CB 3.93Å; A777-V797 HydrophobicContact CB-CG1 3.78Å; A777-F798 CarbonylContact C-O 3.58Å; A777-F798 VanDerWaalsContact CA-O 3.28Å; A777-F798 WeakPolarHBondContact CA-O 3.5Å
778	V	75.2	Confident	68.8	Low	2 Å²	2	49.2 Å²	49.2	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	142.2	-177.6	-63.4	0	0	0	0	111	E776 V797 F798 R800	E776-V778 HydrophobicContact CG-CG1 4.34Å; V778-V797 CarbonylContact O-C 3.57Å; V778-F798 HydrophobicContact CG2-CB 3.94Å; V778-F798 PolarHBondContact N-O 3.43Å; V778-F798 PolarHBondContact O-N 3.37Å; V778-R800 HydrophobicContact CG2-CG 4.32Å
779	T	71.4	Confident	66.1	Low	13 Å²	13	53.7 Å²	53.7	8%	0.08	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	148.1	179.4	49.9	0	0	0	0	112	C397 S781 E782 D795 R796 V797	C397-T779 HydrophobicContact CB-CG2 4.33Å; T779-S781 PolarHBondContact O-N 3.01Å; T779-S781 PolarHBondContact OG1-OG 3.32Å; T779-E782 PolarHBondContact O-N 3.2Å; T779-D795 HydrophobicContact CG2-CB 4.43Å; T779-R796 CarbonylContact C-O 3.56Å; T779-R796 WeakPolarHBondContact CA-O 3.47Å; T779-V797 HydrophobicContact CG2-CG2 4.19Å
780	S	61.9	Low	63.5	Low	10 Å²	10	57.5 Å²	57.5	7%	0.07	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-59.8	-11.6	177.9	59.8	0	0	0	0	115.3	E782 Y783 K784 R796	S780-E782 PolarHBondContact O-N 2.88Å; S780-E782 VanDerWaalsContact O-N 3.13Å; S780-Y783 WeakPolarHBondContact O-CA 3.3Å; S780-Y783 WeakPolarHBondContact O-CB 3.29Å; S780-Y783 PolarHBondContact O-N 3.32Å; S780-K784 PolarHBondContact O-N 2.88Å; S780-K784 VanDerWaalsContact O-N 3.11Å; S780-R796 WeakPolarHBondContact CB-O 3.46Å; S780-R796 PolarHBondContact N-O 3.27Å; S780-R796 PolarHBondContact OG-N 2.96Å; S780-R796 VanDerWaalsContact OG-N 3.15Å; S780-R796 PolarHBondContact OG-O 3.27Å
781	S	55.6	Low	60.9	Low	32 Å²	32	61.2 Å²	61.2	22%	0.224	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-58.4	-17.7	167.2	54.1	0	0	0	0	112.9	T779 Y783	T779-S781 PolarHBondContact O-N 3.01Å; T779-S781 PolarHBondContact OG1-OG 3.32Å; S781-Y783 PolarHBondContact O-N 3.12Å
782	E	50.8	Low	58.3	Low	33 Å²	33	68.9 Å²	68.9	15%	0.154	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-63.9	-20.8	166.1	-69.2	-166.7	163.6	0	0	113.3	T779 S780 R800	T779-E782 PolarHBondContact O-N 3.2Å; S780-E782 PolarHBondContact O-N 2.88Å; S780-E782 VanDerWaalsContact O-N 3.13Å; E782-R800 IonicContact OE2-CZ 2.73Å; E782-R800 IonicContact OE2-NH1 3.48Å; E782-R800 IonicContact OE2-NH2 3.55Å; E782-R800 PolarHBondContact OE2-NH2 3.09Å
783	Y	46.5	Very low	55.9	Low	113 Å²	113	76.5 Å²	76.5	44%	0.443	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-14	-175.4	-64.6	-75.8	0	0	0	114.9	H755 S780 S781 F785 F798	H755-Y783 PolarHBondContact CE1-OH 3.27Å; H755-Y783 AromaticContact NE2-CE2 3.74Å; H755-Y783 AromaticContact NE2-CZ 3.65Å; H755-Y783 PolarHBondContact NE2-OH 2.94Å; S780-Y783 WeakPolarHBondContact O-CA 3.3Å; S780-Y783 WeakPolarHBondContact O-CB 3.29Å; S780-Y783 PolarHBondContact O-N 3.32Å; S781-Y783 PolarHBondContact O-N 3.12Å; Y783-F785 VanDerWaalsContact C-N 3.26Å; Y783-F785 PolarHBondContact O-N 3.11Å; Y783-F798 HydrophobicContact CD2-CE2 4.49Å
784	K	42.1	Very low	54	Low	88 Å²	88	83.3 Å²	83.3	38%	0.383	42%	0.424	S	S	.	.			trans	-79.2	69.2	-179.2	-69.2	179.4	-177.6	174.9	0	111.5	S780 D795	S780-K784 PolarHBondContact O-N 2.88Å; S780-K784 VanDerWaalsContact O-N 3.11Å; K784-D795 IonicContact NZ-OD1 2.71Å; K784-D795 PolarHBondContact NZ-OD1 3.13Å
785	F	38.8	Very low	52.6	Low	89 Å²	89	85.7 Å²	85.7	39%	0.39	44%	0.436	S	S	.	.	S	Bend	trans	-115.6	65.4	162.1	-89.1	-76.4	0	0	0	109.1	Y272 V400 Y783	Y272-F785 AromaticContact CE1-CE1 3.67Å; Y272-F785 HydrophobicContact CE1-CE1 3.67Å; Y272-F785 HydrophobicContact CE1-CZ 4.11Å; Y272-F785 AromaticContact CZ-CE1 3.91Å; Y272-F785 AromaticContact CZ-CZ 3.98Å; Y272-F785 WeakPolarHBondContact OH-CE1 3.49Å; Y272-F785 WeakPolarHBondContact OH-CZ 3.39Å; V400-F785 HydrophobicContact CG2-CE2 4.24Å; V400-F785 HydrophobicContact CG2-CZ 4.29Å; Y783-F785 VanDerWaalsContact C-N 3.26Å; Y783-F785 PolarHBondContact O-N 3.11Å
786	Q	39	Very low	51.9	Low	201 Å²	201	90.1 Å²	90.1	94%	0.939	45%	0.452	S	S	*	.	S	Bend	trans	-171.4	-7.5	165.4	-107.5	153.1	52.4	0	0	117.2
787	S	30.8	Very low	51.7	Low	82 Å²	82	86.8 Å²	86.8	57%	0.573	44%	0.437	S	S	*	.			trans	-125	118.7	-179	69.9	0	0	0	0	113.9	N789	S787-N789 VanDerWaalsContact C-N 3.28Å; S787-N789 PolarHBondContact O-N 2.75Å
788	N	38.7	Very low	52	Low	143 Å²	143	87.8 Å²	87.8	77%	0.765	44%	0.44	S	S	*	.			trans	-86.2	20.6	174.8	-77.7	-16	0	0	0	113.7	P790	N788-P790 VanDerWaalsContact O-CD 3.25Å; N788-P790 WeakPolarHBondContact O-CD 3.24Å
789	N	33.5	Very low	52.7	Low	132 Å²	132	87.7 Å²	87.7	71%	0.706	44%	0.44	S	S	*	.			trans	-82	116.1	178.4	-82.2	-13.3	0	0	0	110.6	S787 I791	S787-N789 VanDerWaalsContact C-N 3.28Å; S787-N789 PolarHBondContact O-N 2.75Å; N789-I791 PolarHBondContact O-N 3.42Å; N789-I791 VanDerWaalsContact O-N 3.14Å
790	P	36.8	Very low	53.5	Low	92 Å²	92	89.2 Å²	89.2	60%	0.597	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-1.6	-177.4	-13.4	29.5	0	0	0	114.4	N788	N788-P790 VanDerWaalsContact O-CD 3.25Å; N788-P790 WeakPolarHBondContact O-CD 3.24Å
791	I	35.9	Very low	55	Low	156 Å²	156	90 Å²	90	80%	0.8	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-9.2	-159.8	-60	168.6	0	0	0	113.1	N789	N789-I791 PolarHBondContact O-N 3.42Å; N789-I791 VanDerWaalsContact O-N 3.14Å
792	E	36.7	Very low	56.8	Low	163 Å²	163	88.5 Å²	88.5	76%	0.762	44%	0.436	S	S	*	.			trans	-108.2	69.7	173.2	-69.8	-174.3	179.8	0	0	111.4
793	Q	43.5	Very low	58.9	Low	159 Å²	159	87 Å²	87	74%	0.743	43%	0.429	S	S	*	.			trans	-91.7	13.2	-169.5	-96.8	179.7	1.3	0	0	116.2	D795	Q793-D795 PolarHBondContact O-N 3.3Å
794	N	52.5	Low	61.2	Low	145 Å²	145	84.3 Å²	84.3	78%	0.775	42%	0.422	S	S	*	.			trans	-88.6	103.7	166.1	-81.7	-5	0	0	0	109.8	R796	N794-R796 PolarHBondContact O-N 2.98Å
795	D	62.4	Low	63.5	Low	51 Å²	51	80.3 Å²	80.3	27%	0.273	40%	0.404	S	S	.	.			trans	-63.3	103.9	170.8	-84.6	-13	0	0	0	109.1	R399 T779 K784 Q793 V797	R399-D795 IonicContact CZ-OD2 2.84Å; R399-D795 IonicContact NH1-OD2 2.75Å; R399-D795 PolarHBondContact NH1-OD2 3.05Å; T779-D795 HydrophobicContact CG2-CB 4.43Å; K784-D795 IonicContact NZ-OD1 2.71Å; K784-D795 PolarHBondContact NZ-OD1 3.13Å; Q793-D795 PolarHBondContact O-N 3.3Å; D795-V797 PolarHBondContact O-N 3.34Å
796	R	73.2	Confident	65.8	Low	110 Å²	110	80.1 Å²	80.1	42%	0.415	41%	0.407	S	S	.	.			trans	-53.9	137.6	171.3	-66	-178.9	-176.1	-159.3	-1.8	110	S731 L753 T779 S780 N794 F798	S731-R796 PolarHBondContact OG-NH1 3Å; L753-R796 HydrophobicContact CD1-CB 4.03Å; L753-R796 HydrophobicContact CD1-CG 4.2Å; T779-R796 CarbonylContact C-O 3.56Å; T779-R796 WeakPolarHBondContact CA-O 3.47Å; S780-R796 WeakPolarHBondContact CB-O 3.46Å; S780-R796 PolarHBondContact N-O 3.27Å; S780-R796 PolarHBondContact OG-N 2.96Å; S780-R796 VanDerWaalsContact OG-N 3.15Å; S780-R796 PolarHBondContact OG-O 3.27Å; N794-R796 PolarHBondContact O-N 2.98Å; R796-F798 HydrophobicContact CB-CE2 4.33Å
797	V	80	Confident	67.8	Low	4 Å²	4	76.2 Å²	76.2	2%	0.024	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.8	178.4	-173.9	0	0	0	0	109.7	F395 Q750 L752 L753 A777 V778 T779 D795	F395-V797 HydrophobicContact CD2-CG1 4.36Å; F395-V797 HydrophobicContact CE2-CG1 4.28Å; Q750-V797 HydrophobicContact CG-CG2 4.33Å; L752-V797 WeakPolarHBondContact CA-O 3.47Å; L752-V797 HydrophobicContact CD2-CB 3.77Å; L752-V797 HydrophobicContact CD2-CG1 3.45Å; L752-V797 VanDerWaalsContact CD2-CG1 3.45Å; L753-V797 PolarHBondContact N-O 3.08Å; A777-V797 HydrophobicContact CB-CG1 3.78Å; V778-V797 CarbonylContact O-C 3.57Å; T779-V797 HydrophobicContact CG2-CG2 4.19Å; D795-V797 PolarHBondContact O-N 3.34Å
798	F	86.3	Confident	70.2	Confident	26 Å²	26	75.3 Å²	75.3	11%	0.114	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	126.3	-178.8	-68.6	-80.7	0	0	0	111.3	L753 H755 A777 V778 Y783 R796	L753-F798 HydrophobicContact CB-CD1 3.73Å; L753-F798 HydrophobicContact CB-CE1 3.92Å; L753-F798 HydrophobicContact CD1-CD1 4.5Å; L753-F798 HydrophobicContact CD1-CE1 4.02Å; L753-F798 HydrophobicContact CD1-CZ 4.33Å; L753-F798 CarbonylContact O-C 3.57Å; L753-F798 VanDerWaalsContact O-CA 3.23Å; L753-F798 WeakPolarHBondContact O-CA 3.49Å; H755-F798 HydrophobicContact CB-CB 3.97Å; A777-F798 CarbonylContact C-O 3.58Å; A777-F798 VanDerWaalsContact CA-O 3.28Å; A777-F798 WeakPolarHBondContact CA-O 3.5Å; V778-F798 HydrophobicContact CG2-CB 3.94Å; V778-F798 PolarHBondContact N-O 3.43Å; V778-F798 PolarHBondContact O-N 3.37Å; Y783-F798 HydrophobicContact CD2-CE2 4.49Å; R796-F798 HydrophobicContact CB-CE2 4.33Å
799	M	89.7	Confident	72.3	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	131.8	176.4	-60.4	-178.6	-68.4	0	0	111.4	V710 Y736 L752 L753 I754 H755 L772 F774 V802	V710-M799 HydrophobicContact CB-SD 4.43Å; V710-M799 HydrophobicContact CG1-SD 4.09Å; V710-M799 HydrophobicContact CG2-CE 3.97Å; V710-M799 HydrophobicContact CG2-SD 3.57Å; V710-M799 VanDerWaalsContact CG2-SD 3.57Å; Y736-M799 HydrophobicContact CD2-CE 3.7Å; Y736-M799 HydrophobicContact CE2-CE 4.47Å; Y736-M799 HydrophobicContact CG-CE 3.81Å; L752-M799 HydrophobicContact CB-CE 4.23Å; L752-M799 HydrophobicContact CB-CG 4.03Å; L752-M799 HydrophobicContact CB-SD 3.92Å; L752-M799 HydrophobicContact CD1-SD 4.46Å; L752-M799 HydrophobicContact CD2-CG 4.13Å; L753-M799 PolarHBondContact O-N 3.46Å; I754-M799 HydrophobicContact CG1-CE 4.03Å; H755-M799 WeakPolarHBondContact CB-O 3.35Å; H755-M799 PolarHBondContact N-O 3.48Å; L772-M799 HydrophobicContact CD1-CE 4.25Å; F774-M799 HydrophobicContact CB-CB 3.81Å; F774-M799 HydrophobicContact CB-CG 4.16Å; F774-M799 HydrophobicContact CB-SD 4.22Å; F774-M799 HydrophobicContact CD1-CG 3.96Å; F774-M799 HydrophobicContact CD1-SD 3.5Å; F774-M799 WeakPolarHBondContact CD1-SD 3.4Å; F774-M799 HydrophobicContact CD2-CG 4.46Å; F774-M799 HydrophobicContact CE1-CG 4.48Å; F774-M799 HydrophobicContact CE1-SD 4.1Å; F774-M799 HydrophobicContact CG-CB 4.1Å; F774-M799 HydrophobicContact CG-CG 3.94Å; F774-M799 HydrophobicContact CG-SD 4.01Å; M799-V802 HydrophobicContact CB-CG2 3.76Å; M799-V802 WeakPolarHBondContact O-CG2 3.4Å
800	R	89.2	Confident	74.3	Confident	44 Å²	44	65.5 Å²	65.5	17%	0.166	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	155.7	175.2	-72	-173.9	173	161	8.9	111.2	H755 I775 E776 V778 E782 V802	H755-R800 HydrophobicContact CB-CG 3.87Å; H755-R800 PolarHBondContact CE1-NE 3.21Å; H755-R800 PolarHBondContact NE2-NE 2.89Å; H755-R800 PolarHBondContact NE2-NH2 3.35Å; I775-R800 PolarHBondContact N-O 3.44Å; E776-R800 HydrophobicContact CB-CB 4.23Å; E776-R800 PolarHBondContact N-O 2.98Å; E776-R800 PolarHBondContact O-N 3.09Å; V778-R800 HydrophobicContact CG2-CG 4.32Å; E782-R800 IonicContact OE2-CZ 2.73Å; E782-R800 IonicContact OE2-NH1 3.48Å; E782-R800 IonicContact OE2-NH2 3.55Å; E782-R800 PolarHBondContact OE2-NH2 3.09Å; R800-V802 VanDerWaalsContact C-N 3.33Å; R800-V802 PolarHBondContact O-N 2.93Å
801	H	92.4	Very high	75.8	Confident	28 Å²	28	64 Å²	64	13%	0.13	32%	0.32	C	S	.	.	S	Bend	trans	58.1	45.7	-179.4	-54.1	-52.7	0	0	0	112.6	L568 C571 D597 L598 I775	L568-H801 HydrophobicContact CD2-CB 4.05Å; L568-H801 VanDerWaalsContact CD2-CG 3.46Å; C571-H801 VanDerWaalsContact SG-CE1 3.6Å; D597-H801 WeakPolarHBondContact OD2-CA 3.47Å; D597-H801 PolarHBondContact OD2-N 2.86Å; L598-H801 HydrophobicContact CD2-CB 4.5Å; I775-H801 HydrophobicContact CB-CB 3.95Å; I775-H801 HydrophobicContact CG1-CB 4.02Å
802	V	94.7	Very high	77	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.301	C	S	.	.			trans	-78.1	135.9	-171.6	-175.4	0	0	0	0	110.4	G596 D597 I754 L760 L772 L773 F774 M799 R800	G596-V802 CarbonylContact C-O 3.6Å; G596-V802 WeakPolarHBondContact CA-O 3.34Å; D597-V802 WeakPolarHBondContact CB-O 3.13Å; D597-V802 PolarHBondContact N-O 3.01Å; D597-V802 PolarHBondContact OD2-N 3.46Å; I754-V802 HydrophobicContact CG2-CG2 4.49Å; L760-V802 HydrophobicContact CD1-CB 4.27Å; L760-V802 HydrophobicContact CD1-CG1 3.89Å; L772-V802 HydrophobicContact CB-CG1 3.97Å; L772-V802 HydrophobicContact CD1-CG1 3.75Å; L772-V802 HydrophobicContact CD2-CG1 3.81Å; L772-V802 HydrophobicContact CG-CG1 4.07Å; L773-V802 CarbonylContact O-C 3.46Å; L773-V802 VanDerWaalsContact O-CA 3.27Å; L773-V802 WeakPolarHBondContact O-CA 3.46Å; F774-V802 HydrophobicContact CB-CG2 4.34Å; M799-V802 HydrophobicContact CB-CG2 3.76Å; M799-V802 WeakPolarHBondContact O-CG2 3.4Å; R800-V802 VanDerWaalsContact C-N 3.33Å; R800-V802 PolarHBondContact O-N 2.93Å
803	S	95.3	Very high	78.1	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	146.2	173.3	-57.8	0	0	0	0	110.9	S595 L598 L772 L773	S595-S803 WeakPolarHBondContact O-CA 3.44Å; L598-S803 WeakPolarHBondContact CD1-OG 3.12Å; L598-S803 VanDerWaalsContact CG-OG 3.27Å; L598-S803 WeakPolarHBondContact CG-OG 3.42Å; L772-S803 WeakPolarHBondContact CA-O 3.39Å; L773-S803 PolarHBondContact N-O 3.5Å; L773-S803 PolarHBondContact O-N 3.49Å
804	I	94.5	Very high	78.6	Confident	58 Å²	58	54.4 Å²	54.4	30%	0.297	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	136.9	177.5	-55.4	179.1	0	0	0	109	P594 S595 L760 P769 L772	P594-I804 VanDerWaalsContact O-CD1 3.31Å; P594-I804 WeakPolarHBondContact O-CD1 3.23Å; S595-I804 PolarHBondContact O-N 3.01Å; L760-I804 HydrophobicContact CD1-CG1 3.84Å; L760-I804 HydrophobicContact CD2-CD1 4.12Å; L760-I804 HydrophobicContact CD2-CG1 4.32Å; P769-I804 HydrophobicContact CB-CD1 4.1Å; P769-I804 HydrophobicContact CB-CG1 4Å; P769-I804 HydrophobicContact CB-CG2 4.16Å; P769-I804 HydrophobicContact CG-CD1 3.7Å; P769-I804 HydrophobicContact CG-CG1 3.88Å; L772-I804 HydrophobicContact CD2-CG1 4.04Å
805	I	90.6	Very high	78.1	Confident	3 Å²	3	52.6 Å²	52.6	2%	0.015	27%	0.265	C	S	.	.			trans	-115.6	138.5	173.6	-44.8	179.7	0	0	0	108.3	V697 L701 V709 C771 L773 W809	V697-I805 HydrophobicContact CG1-CG1 4.26Å; L701-I805 HydrophobicContact CD1-CD1 4.28Å; L701-I805 HydrophobicContact CD2-CG2 4.18Å; V709-I805 HydrophobicContact CB-CD1 4.38Å; V709-I805 HydrophobicContact CG1-CD1 3.92Å; V709-I805 HydrophobicContact CG2-CD1 3.72Å; C771-I805 PolarHBondContact O-N 3.23Å; L773-I805 HydrophobicContact CB-CD1 3.51Å; L773-I805 HydrophobicContact CB-CG1 3.73Å; L773-I805 HydrophobicContact CD1-CD1 4.34Å; L773-I805 HydrophobicContact CG-CD1 4.45Å; I805-W809 HydrophobicContact CG2-CB 4.28Å; I805-W809 HydrophobicContact CG2-CD2 4.3Å; I805-W809 HydrophobicContact CG2-CE3 3.54Å; I805-W809 HydrophobicContact CG2-CZ3 4.17Å
806	D	86.4	Confident	77.3	Confident	85 Å²	85	52 Å²	52	46%	0.455	26%	0.261	S	S	.	.			trans	-72.1	129.5	162.7	-167.5	-49.4	0	0	0	109.9	S808 W809	D806-S808 PolarHBondContact O-N 3.05Å; D806-S808 VanDerWaalsContact OD1-CB 3.25Å; D806-S808 WeakPolarHBondContact OD1-CB 3.31Å; D806-S808 PolarHBondContact OD1-N 3.18Å; D806-S808 PolarHBondContact OD1-OG 3.25Å; D806-W809 HydrophobicContact CB-CD2 3.93Å; D806-W809 HydrophobicContact CB-CG 4.12Å; D806-W809 HydrophobicContact CB-CZ2 4.04Å; D806-W809 WeakPolarHBondContact O-CB 3.37Å; D806-W809 PolarHBondContact O-N 3.09Å
807	Q	80.4	Confident	75.6	Confident	119 Å²	119	49.9 Å²	49.9	56%	0.556	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.6	-178.5	-168	170.8	-0.6	0	0	112.5	W809 L810	Q807-W809 PolarHBondContact O-N 3.34Å; Q807-L810 HydrophobicContact CG-CD1 4.27Å; Q807-L810 WeakPolarHBondContact O-CB 3.41Å; Q807-L810 PolarHBondContact O-N 3.29Å; Q807-L810 VanDerWaalsContact O-N 3.08Å
808	S	82.3	Confident	73.8	Confident	64 Å²	64	58.1 Å²	58.1	45%	0.448	30%	0.297	S	S	.	.	H	α-helix	trans	-61.6	-22.8	173.6	66	0	0	0	0	113	D806 L810 S811	D806-S808 PolarHBondContact O-N 3.05Å; D806-S808 VanDerWaalsContact OD1-CB 3.25Å; D806-S808 WeakPolarHBondContact OD1-CB 3.31Å; D806-S808 PolarHBondContact OD1-N 3.18Å; D806-S808 PolarHBondContact OD1-OG 3.25Å; S808-L810 PolarHBondContact O-N 3.43Å; S808-S811 PolarHBondContact O-N 2.91Å; S808-S811 PolarHBondContact O-OG 3.46Å
809	W	82.9	Confident	71.2	Confident	24 Å²	24	60.6 Å²	60.6	9%	0.091	32%	0.318	C	S	.	.	H	α-helix	trans	-74.3	-15	177.1	-57.6	-8.1	0	0	0	113	E694 V697 Q698 L701 I805 D806 Q807 L812 I813	E694-W809 HydrophobicContact CB-CH2 3.62Å; E694-W809 HydrophobicContact CB-CZ2 3.69Å; E694-W809 HydrophobicContact CG-CH2 3.82Å; E694-W809 HydrophobicContact CG-CZ2 3.79Å; V697-W809 HydrophobicContact CB-CZ3 3.97Å; V697-W809 HydrophobicContact CG1-CZ3 3.92Å; Q698-W809 HydrophobicContact CG-CD2 4.06Å; Q698-W809 HydrophobicContact CG-CE3 3.88Å; Q698-W809 HydrophobicContact CG-CH2 4.42Å; Q698-W809 HydrophobicContact CG-CZ3 4.08Å; L701-W809 HydrophobicContact CD2-CB 3.93Å; I805-W809 HydrophobicContact CG2-CB 4.28Å; I805-W809 HydrophobicContact CG2-CD2 4.3Å; I805-W809 HydrophobicContact CG2-CE3 3.54Å; I805-W809 HydrophobicContact CG2-CZ3 4.17Å; D806-W809 HydrophobicContact CB-CD2 3.93Å; D806-W809 HydrophobicContact CB-CG 4.12Å; D806-W809 HydrophobicContact CB-CZ2 4.04Å; D806-W809 WeakPolarHBondContact O-CB 3.37Å; D806-W809 PolarHBondContact O-N 3.09Å; Q807-W809 PolarHBondContact O-N 3.34Å; W809-L812 HydrophobicContact CB-CD1 4.37Å; W809-L812 HydrophobicContact CG-CD1 4.41Å; W809-L812 WeakPolarHBondContact O-CB 3.46Å; W809-L812 PolarHBondContact O-N 3.34Å; W809-I813 WeakPolarHBondContact O-CG1 3.38Å
810	L	74.4	Confident	68.8	Low	45 Å²	45	63.3 Å²	63.3	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-71.4	-34	176.7	-58.7	-179.8	0	0	0	111.5	V709 Q807 S808 L812 I813	V709-L810 HydrophobicContact CG1-CD2 4.06Å; V709-L810 HydrophobicContact CG2-CD2 4.47Å; Q807-L810 HydrophobicContact CG-CD1 4.27Å; Q807-L810 WeakPolarHBondContact O-CB 3.41Å; Q807-L810 PolarHBondContact O-N 3.29Å; Q807-L810 VanDerWaalsContact O-N 3.08Å; S808-L810 PolarHBondContact O-N 3.43Å; L810-L812 VanDerWaalsContact C-N 3.32Å; L810-L812 PolarHBondContact O-N 3.41Å; L810-I813 HydrophobicContact CD2-CD1 3.88Å; L810-I813 WeakPolarHBondContact O-CB 3.45Å; L810-I813 PolarHBondContact O-N 2.96Å
811	S	69.3	Low	66.4	Low	61 Å²	61	64.1 Å²	64.1	43%	0.427	34%	0.338	S	S	.	.	H	α-helix	trans	-71.6	-27.9	174.1	65.5	0	0	0	0	112.4	S808 I813 E814 N815	S808-S811 PolarHBondContact O-N 2.91Å; S808-S811 PolarHBondContact O-OG 3.46Å; S811-I813 PolarHBondContact O-N 2.86Å; S811-E814 PolarHBondContact O-N 3.15Å; S811-N815 PolarHBondContact O-N 2.66Å; S811-N815 PolarHBondContact O-ND2 3.45Å
812	L	60.3	Low	63.7	Low	77 Å²	77	67.9 Å²	67.9	40%	0.403	36%	0.359	S	S	.	.	H	α-helix	trans	-60	-31.1	171.1	-72.6	169.5	0	0	0	111.5	W809 L810 I816	W809-L812 HydrophobicContact CB-CD1 4.37Å; W809-L812 HydrophobicContact CG-CD1 4.41Å; W809-L812 WeakPolarHBondContact O-CB 3.46Å; W809-L812 PolarHBondContact O-N 3.34Å; L810-L812 VanDerWaalsContact C-N 3.32Å; L810-L812 PolarHBondContact O-N 3.41Å; L812-I816 WeakPolarHBondContact O-CG1 3.47Å; L812-I816 PolarHBondContact O-N 3.15Å
813	I	60.7	Low	60.9	Low	28 Å²	28	70.6 Å²	70.6	14%	0.144	38%	0.376	C	S	.	.	H	α-helix	trans	-72.1	-41.7	-179.2	-60.9	164.1	0	0	0	111.3	L701 Q706 W809 L810 S811 N815 I816	L701-I813 HydrophobicContact CD1-CD1 3.62Å; L701-I813 HydrophobicContact CD2-CD1 3.72Å; L701-I813 HydrophobicContact CD2-CG1 4.22Å; L701-I813 HydrophobicContact CG-CD1 3.56Å; L701-I813 HydrophobicContact CG-CG1 4.16Å; Q706-I813 VanDerWaalsContact CD-CG2 3.46Å; Q706-I813 HydrophobicContact CG-CD1 4.27Å; Q706-I813 HydrophobicContact CG-CG2 4.17Å; W809-I813 WeakPolarHBondContact O-CG1 3.38Å; L810-I813 HydrophobicContact CD2-CD1 3.88Å; L810-I813 WeakPolarHBondContact O-CB 3.45Å; L810-I813 PolarHBondContact O-N 2.96Å; S811-I813 PolarHBondContact O-N 2.86Å; I813-N815 PolarHBondContact O-N 3.15Å; I813-I816 PolarHBondContact O-N 3.27Å
814	E	52.6	Low	58	Low	170 Å²	170	76.3 Å²	76.3	79%	0.794	41%	0.407	S	S	*	.	H	α-helix	trans	-67.4	-29.6	179.3	-66.1	-177.5	165.6	0	0	111.7	S811	S811-E814 PolarHBondContact O-N 3.15Å
815	N	41.8	Very low	55	Low	108 Å²	108	77.3 Å²	77.3	58%	0.578	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	4.4	-178.4	-71.9	-45.9	0	0	0	115	S811 I813 P817	S811-N815 PolarHBondContact O-N 2.66Å; S811-N815 PolarHBondContact O-ND2 3.45Å; I813-N815 PolarHBondContact O-N 3.15Å; N815-P817 WeakPolarHBondContact O-CD 3.19Å; N815-P817 VanDerWaalsContact O-N 3.12Å
816	I	47.2	Very low	52.4	Low	38 Å²	38	85.1 Å²	85.1	20%	0.195	45%	0.449	C	S	.	.	S	Bend	trans	-67.3	113.4	172	-53.7	177.6	0	0	0	107	L702 L812 I813 K818 I820	L702-I816 HydrophobicContact CD2-CD1 3.31Å; L702-I816 HydrophobicContact CD2-CG1 4.48Å; L812-I816 WeakPolarHBondContact O-CG1 3.47Å; L812-I816 PolarHBondContact O-N 3.15Å; I813-I816 PolarHBondContact O-N 3.27Å; I816-K818 PolarHBondContact O-N 2.99Å; I816-I820 HydrophobicContact CG2-CB 3.97Å; I816-I820 HydrophobicContact CG2-CD1 4.42Å; I816-I820 HydrophobicContact CG2-CG2 4.34Å
817	P	35.7	Very low	49.9	Very low	66 Å²	66	85.5 Å²	85.5	43%	0.429	45%	0.451	S	S	.	.			trans	-55.7	132	177.3	-23.6	35.8	0	0	0	108.5	N815 S819 I820	N815-P817 WeakPolarHBondContact O-CD 3.19Å; N815-P817 VanDerWaalsContact O-N 3.12Å; P817-S819 WeakPolarHBondContact CB-OG 3.33Å; P817-S819 PolarHBondContact O-N 3.23Å; P817-I820 HydrophobicContact CG-CD1 4.38Å; P817-I820 HydrophobicContact CG-CG1 4.48Å; P817-I820 PolarHBondContact O-N 3.42Å
818	K	42.5	Very low	47.5	Very low	176 Å²	176	84.8 Å²	84.8	77%	0.765	46%	0.456	S	S	*	.	H	α-helix	trans	-50.5	-21.9	171.5	-70.3	179.9	-179.9	175.1	0	111.6	I816 I820 M821 N822	I816-K818 PolarHBondContact O-N 2.99Å; K818-I820 PolarHBondContact O-N 3.43Å; K818-M821 CarbonylContact O-C 3.57Å; K818-M821 WeakPolarHBondContact O-CB 3.09Å; K818-M821 PolarHBondContact O-N 2.91Å; K818-M821 VanDerWaalsContact O-N 3.15Å; K818-N822 WeakPolarHBondContact O-CB 3.22Å; K818-N822 PolarHBondContact O-N 2.89Å
819	S	33.2	Very low	44.9	Very low	79 Å²	79	88.3 Å²	88.3	55%	0.552	47%	0.47	S	S	*	.	H	α-helix	trans	-65.3	-27.1	172.3	63.2	0	0	0	0	115.2	P817 N822 T823	P817-S819 WeakPolarHBondContact CB-OG 3.33Å; P817-S819 PolarHBondContact O-N 3.23Å; S819-N822 CarbonylContact O-C 3.32Å; S819-N822 VanDerWaalsContact O-C 3.32Å; S819-N822 PolarHBondContact O-N 3.47Å; S819-T823 WeakPolarHBondContact O-CG2 3.44Å; S819-T823 PolarHBondContact O-N 3.45Å
820	I	38.8	Very low	42.4	Very low	56 Å²	56	95.8 Å²	95.8	29%	0.287	51%	0.506	S	S	.	.	H	α-helix	trans	-75.7	-27.4	170.8	-58.9	-176.5	0	0	0	110.8	I816 P817 K818 T823	I816-I820 HydrophobicContact CG2-CB 3.97Å; I816-I820 HydrophobicContact CG2-CD1 4.42Å; I816-I820 HydrophobicContact CG2-CG2 4.34Å; P817-I820 HydrophobicContact CG-CD1 4.38Å; P817-I820 HydrophobicContact CG-CG1 4.48Å; P817-I820 PolarHBondContact O-N 3.42Å; K818-I820 PolarHBondContact O-N 3.43Å; I820-T823 WeakPolarHBondContact O-CG2 3.44Å
821	M	39.3	Very low	40.4	Very low	61 Å²	61	98 Å²	98	30%	0.3	52%	0.522	S	S	.	.	H	α-helix	trans	-76.3	-26.5	169.2	-60	-150.6	-149.9	0	0	112.3	K818	K818-M821 CarbonylContact O-C 3.57Å; K818-M821 WeakPolarHBondContact O-CB 3.09Å; K818-M821 PolarHBondContact O-N 2.91Å; K818-M821 VanDerWaalsContact O-N 3.15Å
822	N	35.6	Very low	38.5	Very low	108 Å²	108	102.4 Å²	102.4	58%	0.578	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	35.8	178.6	-81	-10.4	0	0	0	113.8	K818 S819 N824	K818-N822 WeakPolarHBondContact O-CB 3.22Å; K818-N822 PolarHBondContact O-N 2.89Å; S819-N822 CarbonylContact O-C 3.32Å; S819-N822 VanDerWaalsContact O-C 3.32Å; S819-N822 PolarHBondContact O-N 3.47Å; N822-N824 VanDerWaalsContact C-N 3.33Å; N822-N824 PolarHBondContact O-N 2.78Å
823	T	35.3	Very low	36.9	Very low	56 Å²	56	109.6 Å²	109.6	34%	0.344	56%	0.562	S	S	.	*			trans	-74.2	82.4	-177.2	56.5	0	0	0	0	112.6	S819 I820	S819-T823 WeakPolarHBondContact O-CG2 3.44Å; S819-T823 PolarHBondContact O-N 3.45Å; I820-T823 WeakPolarHBondContact O-CG2 3.44Å
824	N	35.2	Very low	35.3	Very low	121 Å²	121	118 Å²	118	65%	0.647	60%	0.598	S	S	*	*	S	Bend	trans	-78.4	-3.8	156.4	-83.3	-24.9	0	0	0	112.3	N822	N822-N824 VanDerWaalsContact C-N 3.33Å; N822-N824 PolarHBondContact O-N 2.78Å
825	S	31.3	Very low	34.1	Very low	79 Å²	79	115.3 Å²	115.3	55%	0.552	59%	0.588	S	S	*	*	S	Bend	trans	-116.2	1.3	-161.4	50	0	0	0	0	117.9
826	Y	35	Very low	33.4	Very low	167 Å²	167	114.2 Å²	114.2	66%	0.655	59%	0.589	S	S	*	*	S	Bend	trans	-131.7	17.9	-174.1	-69.4	-78.5	0	0	0	116.6	I918	Y826-I918 HydrophobicContact CE1-CG2 4.36Å
827	L	34.5	Very low	32.6	Very low	92 Å²	92	116 Å²	116	48%	0.482	60%	0.598	S	S	.	*	S	Bend	trans	-114.5	145.3	159.3	-85.4	112.7	0	0	0	109.3	N829	L827-N829 PolarHBondContact O-N 3.27Å; L827-N829 VanDerWaalsContact O-N 3.16Å
828	P	28.8	Very low	32.2	Very low	104 Å²	104	121.6 Å²	121.6	68%	0.675	62%	0.616	S	S	*	*			trans	-57.5	122.8	-172.3	-13.6	22.1	0	0	0	111.6	Q830	P828-Q830 PolarHBondContact O-N 3.42Å
829	N	29.7	Very low	31.5	Very low	138 Å²	138	116.1 Å²	116.1	74%	0.738	59%	0.594	S	S	*	*	S	Bend	trans	-67.5	46.9	178.5	-99.6	-23.5	0	0	0	113.9	L827	L827-N829 PolarHBondContact O-N 3.27Å; L827-N829 VanDerWaalsContact O-N 3.16Å
830	Q	29	Very low	31.2	Very low	181 Å²	181	118.7 Å²	118.7	85%	0.846	60%	0.595	S	S	*	*			trans	-110	7.9	175.5	-75.8	-162.4	7.5	0	0	115.1	P828	P828-Q830 PolarHBondContact O-N 3.42Å
831	T	32.4	Very low	30.8	Very low	92 Å²	92	121.1 Å²	121.1	56%	0.564	61%	0.608	S	S	*	*			trans	-107.4	10.2	-174.8	51.3	0	0	0	0	115.8	R833 L835	T831-R833 PolarHBondContact O-N 3.4Å; T831-L835 VanDerWaalsContact CB-CD1 3.47Å; T831-L835 HydrophobicContact CG2-CD1 3.65Å
832	N	28.8	Very low	30.2	Very low	153 Å²	153	119.8 Å²	119.8	82%	0.818	60%	0.603	S	S	*	*			trans	-74.5	4.5	174.7	-93.8	-19.4	0	0	0	115.3	K834	N832-K834 PolarHBondContact O-N 2.8Å
833	R	26.7	Very low	30.1	Very low	228 Å²	228	116.9 Å²	116.9	86%	0.86	59%	0.591	S	S	*	*	S	Bend	trans	-85.6	103.1	165.4	-77.6	-176.6	175.7	170.8	0.2	109.2	T831 L835	T831-R833 PolarHBondContact O-N 3.4Å; R833-L835 VanDerWaalsContact C-N 3.29Å; R833-L835 PolarHBondContact O-N 3.18Å
834	K	28.2	Very low	29.7	Very low	206 Å²	206	118 Å²	118	90%	0.896	60%	0.601	S	S	*	*			trans	11	74.6	164.8	-80.3	-177.6	176.3	175.9	0	111.8	N832 S836	N832-K834 PolarHBondContact O-N 2.8Å; K834-S836 PolarHBondContact O-N 3.09Å
835	L	28.1	Very low	29.4	Very low	113 Å²	113	118.8 Å²	118.8	59%	0.592	61%	0.605	S	S	*	*			trans	-73.4	76.7	171.3	-114.6	133	0	0	0	105.5	T831 R833 L837	T831-L835 VanDerWaalsContact CB-CD1 3.47Å; T831-L835 HydrophobicContact CG2-CD1 3.65Å; R833-L835 VanDerWaalsContact C-N 3.29Å; R833-L835 PolarHBondContact O-N 3.18Å; L835-L837 PolarHBondContact O-N 3.4Å
836	S	27.1	Very low	29.2	Very low	84 Å²	84	121.4 Å²	121.4	59%	0.587	61%	0.607	S	S	*	*			trans	-59.6	100.8	155.9	66.6	0	0	0	0	104	K834 K838	K834-S836 PolarHBondContact O-N 3.09Å; S836-K838 PolarHBondContact O-N 3.23Å
837	L	30.4	Very low	28.7	Very low	76 Å²	76	122.2 Å²	122.2	40%	0.398	62%	0.617	S	S	.	*			trans	-63.4	68.2	161.3	-96.5	148.2	0	0	0	106.9	L153 L835 M839	L153-L837 HydrophobicContact CD2-CB 4.48Å; L835-L837 PolarHBondContact O-N 3.4Å; L837-M839 HydrophobicContact CD2-CG 4.15Å; L837-M839 PolarHBondContact O-N 3.24Å
838	K	26.6	Very low	28.2	Very low	184 Å²	184	127 Å²	127	80%	0.8	64%	0.637	S	S	*	*			trans	-71.7	71.3	153	-81.8	-170.4	174.6	-176	0	105.3	S836 K840	S836-K838 PolarHBondContact O-N 3.23Å; K838-K840 PolarHBondContact O-N 3.43Å
839	M	27.9	Very low	28	Very low	61 Å²	61	128.2 Å²	128.2	30%	0.3	64%	0.642	S	S	.	*			trans	-59.6	95.1	150.6	-95	-162.9	177.8	0	0	105.2	L153 S679 L837 I841	L153-M839 HydrophobicContact CD1-CB 4.39Å; S679-M839 WeakPolarHBondContact OG-CE 3.3Å; L837-M839 HydrophobicContact CD2-CG 4.15Å; L837-M839 PolarHBondContact O-N 3.24Å; M839-I841 HydrophobicContact CB-CG1 4.28Å; M839-I841 PolarHBondContact O-N 3.2Å; M839-I841 HydrophobicContact SD-CG1 4.37Å
840	K	27.3	Very low	27.8	Very low	133 Å²	133	128 Å²	128	58%	0.578	65%	0.648	S	S	*	*			trans	-65	87.2	150.1	-99.2	-173.5	169.1	-171.1	0	104.7	K838 T842	K838-K840 PolarHBondContact O-N 3.43Å; K840-T842 HydrophobicContact CB-CG2 3.9Å; K840-T842 HydrophobicContact CD-CG2 3.65Å; K840-T842 HydrophobicContact CG-CG2 3.8Å; K840-T842 PolarHBondContact O-N 3.14Å
841	I	29.4	Very low	27.8	Very low	107 Å²	107	125 Å²	125	55%	0.549	65%	0.648	S	S	.	*			trans	-69.1	69.6	146.5	-53.5	175.6	0	0	0	104.2	M839	M839-I841 HydrophobicContact CB-CG1 4.28Å; M839-I841 PolarHBondContact O-N 3.2Å; M839-I841 HydrophobicContact SD-CG1 4.37Å
842	T	26.5	Very low	27.5	Very low	33 Å²	33	127.8 Å²	127.8	20%	0.202	66%	0.659	C	S	.	*			trans	-71.9	128.8	161.9	39.5	0	0	0	0	105.2	K840 S844	K840-T842 HydrophobicContact CB-CG2 3.9Å; K840-T842 HydrophobicContact CD-CG2 3.65Å; K840-T842 HydrophobicContact CG-CG2 3.8Å; K840-T842 PolarHBondContact O-N 3.14Å; T842-S844 PolarHBondContact O-N 2.83Å; T842-S844 PolarHBondContact OG1-OG 3.41Å
843	S	33.1	Very low	27.4	Very low	46 Å²	46	129.2 Å²	129.2	32%	0.322	66%	0.658	S	S	.	*	G	3₁₀ helix	trans	-51.5	-1.2	171.9	29.3	0	0	0	0	114.7	S132	S132-S843 WeakPolarHBondContact O-CB 3.19Å; S132-S843 PolarHBondContact O-OG 2.99Å
844	S	28.2	Very low	27.6	Very low	79 Å²	79	128.8 Å²	128.8	55%	0.552	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-84.6	1.3	-177.1	67.9	0	0	0	0	116.8	T842	T842-S844 PolarHBondContact O-N 2.83Å; T842-S844 PolarHBondContact OG1-OG 3.41Å
845	N	27.5	Very low	27.6	Very low	139 Å²	139	130.8 Å²	130.8	74%	0.743	66%	0.664	S	S	*	*	G	3₁₀ helix	trans	-104	16.9	177.1	-74	-5.9	0	0	0	113.4
846	F	28.3	Very low	27.4	Very low	133 Å²	133	136.6 Å²	136.6	58%	0.583	68%	0.678	S	S	*	*			trans	-110.4	7.2	-174.7	-90.7	-85.3	0	0	0	115.1	Q848	F846-Q848 PolarHBondContact O-N 2.8Å
847	E	24	Very low	27.5	Very low	184 Å²	184	139.6 Å²	139.6	86%	0.86	69%	0.693	S	S	*	*			trans	-81.7	97	175.6	-75.9	-174.6	161.2	0	0	111.9
848	Q	23.6	Very low	27.3	Very low	194 Å²	194	142.6 Å²	142.6	91%	0.907	71%	0.708	S	S	*	*			trans	-162.7	84	141.2	-106.6	177.8	31	0	0	109.8	F846	F846-Q848 PolarHBondContact O-N 2.8Å
849	T	24.9	Very low	27.6	Very low	128 Å²	128	141.4 Å²	141.4	79%	0.785	71%	0.71	S	S	*	*			trans	-125.9	134.9	154.5	45.1	0	0	0	0	108.2	S851	T849-S851 PolarHBondContact O-N 3.49Å; T849-S851 VanDerWaalsContact O-N 3.17Å
850	P	25.1	Very low	27.5	Very low	133 Å²	133	145.9 Å²	145.9	86%	0.864	74%	0.736	S	S	*	*			trans	-77.3	108.3	-174	30.6	-30.9	0	0	0	109.7
851	S	29.1	Very low	27.8	Very low	120 Å²	120	145.2 Å²	145.2	84%	0.839	75%	0.748	S	S	*	*			trans	-86	121.5	165.6	57.5	0	0	0	0	109.3	T849	T849-S851 PolarHBondContact O-N 3.49Å; T849-S851 VanDerWaalsContact O-N 3.17Å
852	N	26.7	Very low	27.7	Very low	150 Å²	150	146.8 Å²	146.8	80%	0.802	76%	0.758	S	S	*	*			trans	-88.5	141.1	173.9	-107.6	-41.6	0	0	0	109.5
853	K	26.5	Very low	28	Very low	182 Å²	182	153.4 Å²	153.4	79%	0.791	79%	0.792	S	S	*	*			trans	79.9	102.5	161.1	-59.9	177.9	176.5	-174.4	0	117.7
854	K	30.6	Very low	27.7	Very low	219 Å²	219	158.1 Å²	158.1	95%	0.952	81%	0.813	S	S	*	*				-149.5	149.7	125.5	-105.4	175.6	-174.6	-176.1	0	110.6
855	R	28.3	Very low	27.8	Very low	248 Å²	248	163.5 Å²	163.5	94%	0.936	83%	0.829	S	S	*	*			trans	-60.5	151.5	-164.3	-87.1	168.7	159.2	165.5	-8.6	115
856	R	23.4	Very low	27.7	Very low	235 Å²	235	163.7 Å²	163.7	89%	0.887	83%	0.83	S	S	*	*			trans	-33	138.3	167.6	-70.7	171	165.1	164.7	-5.9	115.9
857	T	30.7	Very low	27.8	Very low	148 Å²	148	163.2 Å²	163.2	91%	0.908	84%	0.838	S	S	*	*				-150.5	143.3	120.5	25.6	0	0	0	0	109
858	I	26.7	Very low	27.9	Very low	138 Å²	138	161 Å²	161	71%	0.708	83%	0.832	S	S	*	*			trans	-83.9	137.6	-164.6	-66.8	155.6	0	0	0	109.9
859	N	31.9	Very low	28	Very low	159 Å²	159	158.9 Å²	158.9	85%	0.85	83%	0.827	S	S	*	*				-173.7	127.7	129.3	-91.4	-12.9	0	0	0	110.8
860	N	26.3	Very low	28.1	Very low	155 Å²	155	160.2 Å²	160.2	83%	0.829	83%	0.829	S	S	*	*			trans	-75	139.4	178.2	-69.5	-23.9	0	0	0	110.8
861	S	33.1	Very low	28.3	Very low	120 Å²	120	158.6 Å²	158.6	84%	0.839	82%	0.821	S	S	*	*			trans	-161.3	135	130.1	49.1	0	0	0	0	109.6
862	D	28	Very low	28.2	Very low	140 Å²	140	160 Å²	160	75%	0.749	82%	0.82	S	S	*	*			trans	-64.9	145	-170.6	-60.5	-68.3	0	0	0	113.8
863	D	31.3	Very low	28.4	Very low	172 Å²	172	158.6 Å²	158.6	92%	0.92	81%	0.812	S	S	*	*			trans	-161.9	107.8	140	-98.4	-26.2	0	0	0	110.6
864	N	26.9	Very low	28.6	Very low	145 Å²	145	159.4 Å²	159.4	78%	0.775	82%	0.815	S	S	*	*			trans	-76.9	119.5	177.5	-87.6	-45.2	0	0	0	111.1
865	H	31.5	Very low	28.7	Very low	191 Å²	191	153.8 Å²	153.8	88%	0.884	80%	0.795	S	S	*	*			trans	-142.9	97.3	151.6	-95.3	-49.9	0	0	0	111.3
866	N	25.6	Very low	28.7	Very low	144 Å²	144	147 Å²	147	77%	0.77	78%	0.782	S	S	*	*			trans	-68.4	125.9	165	-93.1	-30.4	0	0	0	110.3
867	V	28.9	Very low	28.9	Very low	123 Å²	123	140.5 Å²	140.5	75%	0.745	77%	0.772	S	S	*	*			trans	-121.4	101.3	159.8	180	0	0	0	0	107.5	D869	V867-D869 PolarHBondContact O-N 2.88Å
868	N	26	Very low	28.9	Very low	137 Å²	137	140.6 Å²	140.6	73%	0.733	76%	0.76	S	S	*	*			trans	-78.3	103.6	169.9	-86.8	-28.8	0	0	0	109.2	N870	N868-N870 PolarHBondContact O-N 3.35Å
869	D	27.5	Very low	28.8	Very low	150 Å²	150	141.7 Å²	141.7	80%	0.802	76%	0.762	S	S	*	*			trans	-86.2	81.7	163.9	-91.5	-23.3	0	0	0	109.7	V867	V867-D869 PolarHBondContact O-N 2.88Å
870	N	25.4	Very low	28.5	Very low	155 Å²	155	140.4 Å²	140.4	83%	0.829	76%	0.763	S	S	*	*			trans	-99.9	103	161.2	-93.3	-20.5	0	0	0	108.1	N868	N868-N870 PolarHBondContact O-N 3.35Å
871	S	29.9	Very low	28.6	Very low	100 Å²	100	139.2 Å²	139.2	70%	0.699	76%	0.761	S	S	*	*			trans	-146.8	108.6	161.2	48.7	0	0	0	0	112
872	N	27.8	Very low	28.2	Very low	150 Å²	150	138.5 Å²	138.5	80%	0.802	76%	0.756	S	S	*	*			trans	60.6	73	148.3	-58.7	-20.7	0	0	0	120
873	D	31.1	Very low	28.3	Very low	119 Å²	119	139.3 Å²	139.3	64%	0.636	76%	0.76	S	S	*	*			trans	-121.4	72	150.3	-101	-8.1	0	0	0	107.7	K613 L875	K613-D873 IonicContact NZ-OD2 2.75Å; D873-L875 PolarHBondContact O-N 2.93Å
874	K	30.5	Very low	28	Very low	199 Å²	199	138.1 Å²	138.1	87%	0.865	75%	0.754	S	S	*	*			trans	-72.3	95.9	167.7	-83.5	-172.4	178.3	-178.1	0	107.9	T876	K874-T876 PolarHBondContact O-N 3.33Å
875	L	31.3	Very low	28	Very low	102 Å²	102	137.8 Å²	137.8	53%	0.534	76%	0.757	S	S	.	*			trans	-65.7	106.6	166.8	-90.7	102.3	0	0	0	108.7	D873 S877	D873-L875 PolarHBondContact O-N 2.93Å; L875-S877 PolarHBondContact O-N 3.09Å
876	T	29.1	Very low	27.6	Very low	106 Å²	106	135.2 Å²	135.2	65%	0.65	76%	0.755	S	S	*	*			trans	-73.4	122.1	162.6	45.9	0	0	0	0	108.6	K874	K874-T876 PolarHBondContact O-N 3.33Å
877	S	28.3	Very low	27.7	Very low	98 Å²	98	134.3 Å²	134.3	69%	0.685	76%	0.757	S	S	*	*			trans	-77.8	117.3	176.6	51.1	0	0	0	0	110.2	L875	L875-S877 PolarHBondContact O-N 3.09Å
878	F	29.7	Very low	27.6	Very low	149 Å²	149	135.5 Å²	135.5	65%	0.654	76%	0.76	S	S	*	*			trans	-86	111.8	154	-87.7	-89.3	0	0	0	107.6	T691	T691-F878 HydrophobicContact CG2-CE2 3.92Å; T691-F878 HydrophobicContact CG2-CZ 3.76Å
879	Q	24.6	Very low	27.8	Very low	162 Å²	162	135.8 Å²	135.8	76%	0.757	76%	0.761	S	S	*	*			trans	-97.7	132.2	157.6	-77.4	-158.4	-45.9	0	0	107.7	T881	Q879-T881 PolarHBondContact O-N 2.97Å
880	P	26.6	Very low	28	Very low	132 Å²	132	134.5 Å²	134.5	86%	0.857	75%	0.754	S	S	*	*			trans	-78	111.4	167.9	30.5	-26.8	0	0	0	108
881	T	26.9	Very low	28.1	Very low	130 Å²	130	133.7 Å²	133.7	80%	0.798	75%	0.75	S	S	*	*			trans	-92.6	109.6	164.2	49.1	0	0	0	0	108.1	Q879	Q879-T881 PolarHBondContact O-N 2.97Å
882	S	25.5	Very low	28	Very low	104 Å²	104	137.3 Å²	137.3	73%	0.727	76%	0.758	S	S	*	*			trans	-73.2	122.7	155.5	49.3	0	0	0	0	108.2
883	N	29.1	Very low	28.1	Very low	158 Å²	158	136.4 Å²	136.4	85%	0.845	75%	0.753	S	S	*	*			trans	-169.2	132.5	143.5	-93.1	-8.9	0	0	0	109.6
884	D	24.7	Very low	27.8	Very low	147 Å²	147	138 Å²	138	79%	0.786	76%	0.761	S	S	*	*			trans	-56.6	148.2	-179.1	-60.6	-60.6	0	0	0	113.8
885	T	28.6	Very low	27.7	Very low	138 Å²	138	133.9 Å²	133.9	85%	0.847	76%	0.758	S	S	*	*				176	118.3	120.6	27	0	0	0	0	110.5
886	T	23.2	Very low	27.2	Very low	137 Å²	137	134.7 Å²	134.7	84%	0.84	77%	0.772	S	S	*	*			trans	-63.4	157.1	164.4	45.1	0	0	0	0	111.3
887	P	27.6	Very low	27	Very low	125 Å²	125	135.5 Å²	135.5	81%	0.812	78%	0.777	S	S	*	*				-140.9	150.2	109.1	32.9	-17.4	0	0	0	115.6
888	N	25.4	Very low	26.7	Very low	148 Å²	148	137.2 Å²	137.2	79%	0.791	78%	0.783	S	S	*	*			trans	-43	143.1	165.9	-83.9	-27.1	0	0	0	114.7
889	N	31.6	Very low	26.5	Very low	143 Å²	143	136.5 Å²	136.5	77%	0.765	79%	0.785	S	S	*	*				-165.8	114.7	118.4	-108.6	-13.9	0	0	0	113.4
890	N	30.7	Very low	26.3	Very low	123 Å²	123	137.3 Å²	137.3	66%	0.658	79%	0.789	S	S	*	*				57.7	115.5	128.6	-64.3	-13.1	0	0	0	122.6
891	N	27.3	Very low	26.3	Very low	138 Å²	138	137.8 Å²	137.8	74%	0.738	78%	0.782	S	S	*	*				59.1	113.7	126.4	-68.7	-12.5	0	0	0	120.1
892	M	28.6	Very low	26.2	Very low	176 Å²	176	138.9 Å²	138.9	87%	0.867	78%	0.783	S	S	*	*				-176.4	115.1	95	-94.2	-159	172.8	0	0	112.9
893	N	29.3	Very low	26.2	Very low	131 Å²	131	141.3 Å²	141.3	70%	0.701	79%	0.788	S	S	*	*			trans	34.3	122.9	133.2	-63.2	-11.7	0	0	0	123.3
894	N	25.7	Very low	25.9	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	78%	0.784	S	S	*	*				47.2	121.5	125.8	-63.4	-10.8	0	0	0	120.8
895	S	27	Very low	25.8	Very low	113 Å²	113	139.6 Å²	139.6	79%	0.79	78%	0.783	S	S	*	*				176	134.7	101.1	55	0	0	0	0	112.2
896	S	21.6	Very low	25.7	Very low	119 Å²	119	142.8 Å²	142.8	83%	0.832	79%	0.785	S	S	*	*			trans	-64.9	137	172.9	-46.5	0	0	0	0	112.7
897	T	24.8	Very low	25.8	Very low	123 Å²	123	141.9 Å²	141.9	76%	0.755	78%	0.78	S	S	*	*			trans	-154.9	115.3	156	3.9	0	0	0	0	112
898	T	22.4	Very low	25.7	Very low	134 Å²	134	142.7 Å²	142.7	82%	0.822	78%	0.777	S	S	*	*			trans	-65	125.4	165.2	-39.1	0	0	0	0	109.4
899	I	24.4	Very low	25.7	Very low	135 Å²	135	141 Å²	141	69%	0.692	78%	0.776	S	S	*	*			trans	-138.6	108.8	168.1	-62.4	-176.8	0	0	0	109.7	I901	I899-I901 HydrophobicContact CG2-CD1 3.75Å
900	H	22.2	Very low	25.5	Very low	179 Å²	179	142.3 Å²	142.3	83%	0.829	78%	0.783	S	S	*	*			trans	-62.2	138.4	152.3	-86.8	-87.7	0	0	0	109.6
901	I	26.4	Very low	25.3	Very low	142 Å²	142	139.8 Å²	139.8	73%	0.728	79%	0.785	S	S	*	*			trans	-174.6	106.4	150.5	-87.8	139.1	0	0	0	105.5	I899	I899-I901 HydrophobicContact CG2-CD1 3.75Å
902	N	25.2	Very low	25.4	Very low	152 Å²	152	140.6 Å²	140.6	81%	0.813	79%	0.789	S	S	*	*				64.8	121.5	89.1	-86	-12.2	0	0	0	115.5	T904	N902-T904 PolarHBondContact O-N 3.25Å
903	N	23.8	Very low	25.5	Very low	155 Å²	155	137 Å²	137	83%	0.829	77%	0.773	S	S	*	*			trans	-45	126.2	171.7	-73.7	-32.7	0	0	0	112.5
904	T	23.7	Very low	25.4	Very low	125 Å²	125	138.6 Å²	138.6	77%	0.767	77%	0.773	S	S	*	*			trans	161.1	147.5	132.2	36.4	0	0	0	0	108.6	N902	N902-T904 PolarHBondContact O-N 3.25Å
905	L	23.3	Very low	25.7	Very low	145 Å²	145	135.7 Å²	135.7	76%	0.759	76%	0.764	S	S	*	*			trans	80.3	101.5	173.6	-55.5	147.3	0	0	0	115.7
906	F	25.6	Very low	25.9	Very low	205 Å²	205	136.1 Å²	136.1	90%	0.899	75%	0.754	S	S	*	*			trans	-153.8	85.3	141.2	-97.8	-70.3	0	0	0	110.6
907	T	25.1	Very low	26.5	Very low	118 Å²	118	139 Å²	139	72%	0.724	75%	0.748	S	S	*	*			trans	-66.2	150.3	141.3	38.8	0	0	0	0	108.7
908	N	25	Very low	26.8	Very low	142 Å²	142	136.9 Å²	136.9	76%	0.759	73%	0.731	S	S	*	*			trans	78.3	95.3	176.8	-66.2	-24.6	0	0	0	118.6
909	C	26	Very low	27.1	Very low	113 Å²	113	135.7 Å²	135.7	76%	0.764	72%	0.72	S	S	*	*			trans	-148.6	64.7	149.3	-91.5	0	0	0	0	111.4	G911	C909-G911 VanDerWaalsContact C-N 3.25Å; C909-G911 PolarHBondContact O-N 2.81Å
910	N	26.8	Very low	27.5	Very low	170 Å²	170	138.4 Å²	138.4	91%	0.909	72%	0.721	S	S	*	*			trans	-87.4	33.8	168.6	-89.8	-26.3	0	0	0	112.4
911	G	27.1	Very low	27.8	Very low	69 Å²	69	136.3 Å²	136.3	71%	0.711	72%	0.716	S	S	*	*			trans	-103.6	-10.6	-160.4	0	0	0	0	0	118.7	C909	C909-G911 VanDerWaalsContact C-N 3.25Å; C909-G911 PolarHBondContact O-N 2.81Å
912	L	29.6	Very low	28	Very low	155 Å²	155	133.9 Å²	133.9	81%	0.812	71%	0.711	S	S	*	*	S	Bend	trans	-130.8	14.2	-171	-83.4	164.8	0	0	0	115.8
913	I	30.7	Very low	28.2	Very low	102 Å²	102	134.6 Å²	134.6	52%	0.523	71%	0.709	S	S	.	*	S	Bend	trans	-126.4	96.6	167.3	-58	175.3	0	0	0	106.1	S915 I918	I913-S915 PolarHBondContact O-N 2.99Å; I913-I918 HydrophobicContact CG2-CD1 4.18Å
914	K	28.2	Very low	28.4	Very low	164 Å²	164	136.6 Å²	136.6	71%	0.713	71%	0.711	S	S	*	*			trans	-55.5	115.1	169.2	-84	-169.9	174.3	-169.7	0	108	E916 Y917	K914-E916 PolarHBondContact O-N 3.02Å; K914-Y917 PolarHBondContact O-N 2.85Å
915	S	30.3	Very low	28.5	Very low	89 Å²	89	136.5 Å²	136.5	62%	0.622	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	-8.2	173	48.1	0	0	0	0	113.9	I913	I913-S915 PolarHBondContact O-N 2.99Å
916	E	32	Very low	28.7	Very low	123 Å²	123	137.8 Å²	137.8	58%	0.575	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	-11.2	174.3	-69.8	-177.4	132.4	0	0	115.3	K914	K914-E916 PolarHBondContact O-N 3.02Å
917	Y	33	Very low	28.7	Very low	180 Å²	180	133 Å²	133	71%	0.706	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.6	-22.1	177.4	-118.1	-94	0	0	0	113.9	K914	K914-Y917 PolarHBondContact O-N 2.85Å
918	I	32.2	Very low	29	Very low	78 Å²	78	133.6 Å²	133.6	40%	0.4	71%	0.714	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.9	-26.9	179	-64.7	176.7	0	0	0	110.9	Y826 I913	Y826-I918 HydrophobicContact CE1-CG2 4.36Å; I913-I918 HydrophobicContact CG2-CD1 4.18Å
919	N	29.6	Very low	29.3	Very low	109 Å²	109	135 Å²	135	58%	0.583	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-87.9	-10.5	176.2	-71.3	-17.4	0	0	0	114.8	L921 S922	N919-L921 VanDerWaalsContact C-N 3.3Å; N919-S922 PolarHBondContact O-OG 3.19Å; N919-S922 VanDerWaalsContact O-OG 3.06Å
920	R	30.9	Very low	29.9	Very low	191 Å²	191	134 Å²	134	72%	0.721	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-80.9	-9.8	170.2	-77.4	-172.7	-167.9	-163.7	3.4	113.7
921	L	29.6	Very low	30.5	Very low	136 Å²	136	128.3 Å²	128.3	71%	0.712	68%	0.676	S	S	*	*	G	3₁₀ helix	trans	-87.7	-5.5	179.4	-78.2	156.9	0	0	0	113.2	N919	N919-L921 VanDerWaalsContact C-N 3.3Å
922	S	30.6	Very low	31.2	Very low	90 Å²	90	135.9 Å²	135.9	63%	0.629	68%	0.683	S	S	*	*	S	Bend	trans	-100.9	-8.7	179.2	50	0	0	0	0	115.5	N919	N919-S922 PolarHBondContact O-OG 3.19Å; N919-S922 VanDerWaalsContact O-OG 3.06Å
923	E	28.4	Very low	31.9	Very low	167 Å²	167	131.9 Å²	131.9	78%	0.78	67%	0.668	S	S	*	*	S	Bend	trans	-125.7	13.6	-166.2	-73.5	-171.9	160.6	0	0	117.5
924	K	28.4	Very low	32.5	Very low	198 Å²	198	131.5 Å²	131.5	86%	0.861	66%	0.664	S	S	*	*			trans	-134.3	70.5	172.3	-72	-172.8	179.1	-180	0	113.4	M926	K924-M926 PolarHBondContact O-N 2.93Å
925	S	27	Very low	33.4	Very low	122 Å²	122	129.7 Å²	129.7	85%	0.853	66%	0.656	S	S	*	*			trans	-83.5	79.3	164.9	60	0	0	0	0	110.6	C927	S925-C927 PolarHBondContact O-N 3.11Å
926	M	26.6	Very low	34.1	Very low	173 Å²	173	134.7 Å²	134.7	85%	0.852	66%	0.661	S	S	*	*			trans	-76.2	108.5	167.5	-93.5	-162.8	83.4	0	0	110.6	K924 T928	K924-M926 PolarHBondContact O-N 2.93Å; M926-T928 PolarHBondContact O-N 3.2Å
927	C	25	Very low	34.8	Very low	104 Å²	104	138.1 Å²	138.1	70%	0.703	67%	0.669	S	S	*	*			trans	-59.6	104.2	167.7	-169.8	0	0	0	0	111	S925	S925-C927 PolarHBondContact O-N 3.11Å
928	T	31.6	Very low	35.4	Very low	131 Å²	131	134.5 Å²	134.5	80%	0.804	66%	0.661	S	S	*	*			trans	-95.1	100.3	161.4	44.4	0	0	0	0	109.9	M926 L930	M926-T928 PolarHBondContact O-N 3.2Å; T928-L930 PolarHBondContact O-N 3.46Å
929	Q	32.2	Very low	35.9	Very low	172 Å²	172	133.5 Å²	133.5	80%	0.804	66%	0.664	S	S	*	*			trans	-64.6	114.6	172.7	-67.7	-169.3	-2.6	0	0	110.9	S931	Q929-S931 PolarHBondContact O-N 3.36Å
930	L	38.6	Very low	36.5	Very low	90 Å²	90	135.6 Å²	135.6	47%	0.471	67%	0.668	S	S	.	*			trans	-57.3	127.1	162.2	-80.3	161.7	0	0	0	109.7	T928 Q934 K935	T928-L930 PolarHBondContact O-N 3.46Å; L930-Q934 HydrophobicContact CD2-CB 4.14Å; L930-K935 HydrophobicContact CB-CG 4.11Å; L930-K935 WeakPolarHBondContact O-CE 3.35Å
931	S	39.8	Very low	36.9	Very low	51 Å²	51	135.7 Å²	135.7	36%	0.357	67%	0.669	S	S	.	*			trans	-62	152.4	-179.8	85.7	0	0	0	0	111.6	Q929 S933 Q934 K935	Q929-S931 PolarHBondContact O-N 3.36Å; S931-S933 PolarHBondContact O-N 3.16Å; S931-S933 VanDerWaalsContact O-N 3.09Å; S931-S933 PolarHBondContact OG-N 3.04Å; S931-S933 PolarHBondContact OG-OG 2.78Å; S931-S933 VanDerWaalsContact OG-OG 3.12Å; S931-Q934 VanDerWaalsContact N-OE1 3.1Å; S931-Q934 PolarHBondContact O-N 2.99Å; S931-Q934 WeakPolarHBondContact OG-CG 3.48Å; S931-Q934 PolarHBondContact OG-N 3.23Å; S931-K935 PolarHBondContact O-N 3.04Å
932	R	41.7	Very low	37.2	Very low	228 Å²	228	139 Å²	139	86%	0.86	67%	0.672	S	S	*	*	H	α-helix	trans	-54.2	-28.8	175.4	-80	179.7	171.3	174.1	-2.7	112.2	R936	R932-R936 WeakPolarHBondContact O-CB 3.47Å; R932-R936 WeakPolarHBondContact O-CG 3.34Å; R932-R936 PolarHBondContact O-N 3.49Å; R932-R936 VanDerWaalsContact O-N 3.08Å
933	S	42.7	Very low	37.6	Very low	71 Å²	71	143.4 Å²	143.4	50%	0.497	68%	0.68	S	S	.	*	H	α-helix	trans	-75.5	-36.9	177.4	86.5	0	0	0	0	112.8	S931 R936 R937	S931-S933 PolarHBondContact O-N 3.16Å; S931-S933 VanDerWaalsContact O-N 3.09Å; S931-S933 PolarHBondContact OG-N 3.04Å; S931-S933 PolarHBondContact OG-OG 2.78Å; S931-S933 VanDerWaalsContact OG-OG 3.12Å; S933-R936 PolarHBondContact O-N 2.99Å; S933-R937 PolarHBondContact O-N 3.38Å
934	Q	45.4	Very low	37.9	Very low	95 Å²	95	145.1 Å²	145.1	44%	0.444	68%	0.679	S	S	.	*	H	α-helix	trans	-69	-41.3	175.7	-71.2	169.6	-26	0	0	111.3	L930 S931 R937 L938	L930-Q934 HydrophobicContact CD2-CB 4.14Å; S931-Q934 VanDerWaalsContact N-OE1 3.1Å; S931-Q934 PolarHBondContact O-N 2.99Å; S931-Q934 WeakPolarHBondContact OG-CG 3.48Å; S931-Q934 PolarHBondContact OG-N 3.23Å; Q934-R937 PolarHBondContact O-N 3.06Å; Q934-L938 PolarHBondContact O-N 3.22Å
935	K	45.5	Very low	38.2	Very low	126 Å²	126	140.7 Å²	140.7	55%	0.548	67%	0.665	S	S	.	*	H	α-helix	trans	-62.5	-40.7	171.9	-70	180	-177.7	175.2	0	111.9	L930 S931 L938 A939	L930-K935 HydrophobicContact CB-CG 4.11Å; L930-K935 WeakPolarHBondContact O-CE 3.35Å; S931-K935 PolarHBondContact O-N 3.04Å; K935-L938 PolarHBondContact O-N 2.76Å; K935-A939 WeakPolarHBondContact O-CB 3.47Å; K935-A939 PolarHBondContact O-N 3.15Å
936	R	45.9	Very low	38.4	Very low	193 Å²	193	142.2 Å²	142.2	73%	0.728	66%	0.663	S	S	*	*	H	α-helix	trans	-67	-36.4	175.1	-83.1	179	167.9	-179.2	-3	113.3	R932 S933 K940	R932-R936 WeakPolarHBondContact O-CB 3.47Å; R932-R936 WeakPolarHBondContact O-CG 3.34Å; R932-R936 PolarHBondContact O-N 3.49Å; R932-R936 VanDerWaalsContact O-N 3.08Å; S933-R936 PolarHBondContact O-N 2.99Å; R936-K940 WeakPolarHBondContact O-CB 3.38Å; R936-K940 PolarHBondContact O-N 3.27Å
937	R	46	Very low	38.5	Very low	196 Å²	196	139.2 Å²	139.2	74%	0.74	65%	0.654	S	S	*	*	H	α-helix	trans	-68.8	-38.5	175.4	-85	-178.9	170.8	167.3	-1.7	112.7	S933 Q934 R941	S933-R937 PolarHBondContact O-N 3.38Å; Q934-R937 PolarHBondContact O-N 3.06Å; R937-R941 PolarHBondContact O-N 3.43Å; R937-R941 VanDerWaalsContact O-N 3.15Å
938	L	46.5	Very low	38.8	Very low	104 Å²	104	142.3 Å²	142.3	55%	0.545	66%	0.663	S	S	.	*	H	α-helix	trans	-69.3	-37.2	173.8	-83.7	154.5	0	0	0	112.5	Q934 K935 R941 R942	Q934-L938 PolarHBondContact O-N 3.22Å; K935-L938 PolarHBondContact O-N 2.76Å; L938-R941 PolarHBondContact O-N 3.24Å; L938-R942 PolarHBondContact O-N 3.21Å; L938-R942 VanDerWaalsContact O-N 3.14Å
939	A	42.1	Very low	38.7	Very low	56 Å²	56	141.3 Å²	141.3	46%	0.463	66%	0.658	S	S	.	*	H	α-helix	trans	-69.5	-40.5	174.6	0	0	0	0	0	113	K935 R941 R942 K943	K935-A939 WeakPolarHBondContact O-CB 3.47Å; K935-A939 PolarHBondContact O-N 3.15Å; A939-R941 VanDerWaalsContact C-N 3.29Å; A939-R941 PolarHBondContact O-N 2.97Å; A939-R942 PolarHBondContact O-N 3.49Å; A939-K943 PolarHBondContact O-N 2.72Å; A939-K943 VanDerWaalsContact O-N 3.09Å
940	K	42.1	Very low	38.4	Very low	153 Å²	153	142.4 Å²	142.4	67%	0.665	66%	0.661	S	S	*	*	H	α-helix	trans	-65.3	-28.5	172.8	-85.7	-176.1	173.9	-178.6	0	112.9	R936	R936-K940 WeakPolarHBondContact O-CB 3.38Å; R936-K940 PolarHBondContact O-N 3.27Å
941	R	38.6	Very low	38	Very low	194 Å²	194	143.9 Å²	143.9	73%	0.732	67%	0.673	S	S	*	*	H	α-helix	trans	-77.6	-26.3	173.3	-92.5	-179.3	164.9	177.6	-3.9	113.8	R937 L938 A939 N945	R937-R941 PolarHBondContact O-N 3.43Å; R937-R941 VanDerWaalsContact O-N 3.15Å; L938-R941 PolarHBondContact O-N 3.24Å; A939-R941 VanDerWaalsContact C-N 3.29Å; A939-R941 PolarHBondContact O-N 2.97Å; R941-N945 PolarHBondContact O-ND2 3.28Å
942	R	37.7	Very low	37.3	Very low	206 Å²	206	147.5 Å²	147.5	78%	0.777	69%	0.689	S	S	*	*	H	α-helix	trans	-79.7	-36	174.2	-84.9	-178.3	164.2	170.6	-4.1	113.1	L938 A939 R944	L938-R942 PolarHBondContact O-N 3.21Å; L938-R942 VanDerWaalsContact O-N 3.14Å; A939-R942 PolarHBondContact O-N 3.49Å; R942-R944 VanDerWaalsContact C-N 3.32Å; R942-R944 PolarHBondContact O-N 3.42Å
943	K	38	Very low	36.8	Very low	182 Å²	182	143.4 Å²	143.4	79%	0.791	68%	0.684	S	S	*	*	H	α-helix	trans	-72.3	-15	176	-92.1	-173.5	173.1	-173.9	0	115.1	A939	A939-K943 PolarHBondContact O-N 2.72Å; A939-K943 VanDerWaalsContact O-N 3.09Å
944	R	34.6	Very low	36	Very low	202 Å²	202	146.6 Å²	146.6	76%	0.762	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-1.4	179.8	-81.4	-179	174.4	166.8	-2.7	115.5	R942	R942-R944 VanDerWaalsContact C-N 3.32Å; R942-R944 PolarHBondContact O-N 3.42Å
945	N	34.6	Very low	35.4	Very low	106 Å²	106	148.9 Å²	148.9	57%	0.567	71%	0.711	S	S	*	*	S	Bend	trans	-107.4	25	178.4	-63.5	-57.3	0	0	0	112.9	R941	R941-N945 PolarHBondContact O-ND2 3.28Å
946	L	31	Very low	34.6	Very low	154 Å²	154	148.9 Å²	148.9	81%	0.806	72%	0.721	S	S	*	*	S	Bend	trans	-133	18.4	-178.9	-93.2	159.8	0	0	0	113
947	T	28.6	Very low	34	Very low	109 Å²	109	147.1 Å²	147.1	67%	0.669	73%	0.726	S	S	*	*			trans	-141.4	99.2	-179.2	50.7	0	0	0	0	109.9
948	L	32	Very low	33.2	Very low	169 Å²	169	143.6 Å²	143.6	89%	0.885	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-75.2	128.8	153.2	-83.2	158.7	0	0	0	106.6
949	P	28.9	Very low	32.6	Very low	110 Å²	110	144.8 Å²	144.8	71%	0.714	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-75.1	128.3	173.8	30.3	-28.9	0	0	0	109.2	V951	P949-V951 PolarHBondContact O-N 2.98Å
950	F	25.6	Very low	32.2	Very low	195 Å²	195	147.5 Å²	147.5	86%	0.855	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-57.8	126.5	159.1	-93.2	-99.3	0	0	0	108.4
951	V	30.7	Very low	31.8	Very low	121 Å²	121	146.4 Å²	146.4	73%	0.733	75%	0.751	S	S	*	*			trans	-109.8	97.4	158.8	178.3	0	0	0	0	106.1	P949	P949-V951 PolarHBondContact O-N 2.98Å
952	N	25.7	Very low	31.7	Very low	127 Å²	127	142.9 Å²	142.9	68%	0.679	75%	0.747	S	S	*	*			trans	-66.7	122.3	160.8	-90.2	-7.9	0	0	0	107.6
953	N	30.2	Very low	31.6	Very low	142 Å²	142	139.4 Å²	139.4	76%	0.759	74%	0.743	S	S	*	*			trans	-120.1	78.2	159.3	-107.5	4.1	0	0	0	107.6
954	N	27	Very low	31.5	Very low	139 Å²	139	136 Å²	136	74%	0.743	74%	0.738	S	S	*	*			trans	-83.3	107.6	151.9	-79.2	-9.2	0	0	0	105.8
955	N	32.2	Very low	31.6	Very low	143 Å²	143	131.5 Å²	131.5	77%	0.765	73%	0.733	S	S	*	*			trans	-136.6	82.7	158.1	-95.3	-11.3	0	0	0	107.3
956	T	28.1	Very low	31.7	Very low	125 Å²	125	132.6 Å²	132.6	77%	0.767	74%	0.739	S	S	*	*			trans	-70	113.4	154.3	44.7	0	0	0	0	107.7
957	N	34.2	Very low	31.9	Very low	156 Å²	156	130.9 Å²	130.9	83%	0.834	73%	0.731	S	S	*	*			trans	-112.4	106.8	158	-89.9	-8.7	0	0	0	108.1
958	T	28.8	Very low	32.4	Very low	122 Å²	122	131.4 Å²	131.4	75%	0.748	73%	0.729	S	S	*	*			trans	-65	135.5	164.4	40.2	0	0	0	0	111.4
959	T	34.6	Very low	32.6	Very low	129 Å²	129	130 Å²	130	79%	0.791	72%	0.723	S	S	*	*			trans	164.2	133.1	151.1	27.4	0	0	0	0	106.2
960	T	32.6	Very low	33	Very low	113 Å²	113	129.1 Å²	129.1	69%	0.693	72%	0.719	S	S	*	*			cis	-173.5	144.9	-5.2	9	0	0	0	0	105.4
961	N	34.3	Very low	33.4	Very low	130 Å²	130	124.2 Å²	124.2	70%	0.695	71%	0.709	S	S	*	*			trans	77.1	112.6	144.1	-67.6	0.4	0	0	0	122.4
962	N	36.2	Very low	33.6	Very low	120 Å²	120	124.7 Å²	124.7	64%	0.642	71%	0.708	S	S	*	*				103.5	109.2	120.5	-68.5	-2.8	0	0	0	119.4
963	N	35.9	Very low	34	Very low	133 Å²	133	125 Å²	125	71%	0.711	71%	0.709	S	S	*	*				71.2	134.6	126	-62.4	-4.6	0	0	0	117.4
964	T	36.5	Very low	34.1	Very low	110 Å²	110	123.8 Å²	123.8	68%	0.675	71%	0.707	S	S	*	*			cis	-173.4	142.9	5.8	13.9	0	0	0	0	106.5
965	T	35.2	Very low	34.3	Very low	109 Å²	109	129.7 Å²	129.7	67%	0.669	73%	0.73	S	S	*	*			trans	60.3	114.4	139.1	58.6	0	0	0	0	121.8
966	D	36.7	Very low	34.4	Very low	128 Å²	128	129.1 Å²	129.1	68%	0.684	73%	0.728	S	S	*	*				114.1	112.1	109.2	-77.4	8.8	0	0	0	119.7
967	N	37.2	Very low	34.8	Very low	119 Å²	119	129.3 Å²	129.3	64%	0.636	73%	0.726	S	S	*	*				90.4	110.5	121.1	-73.6	-19.3	0	0	0	120
968	N	37.8	Very low	34.8	Very low	119 Å²	119	127.8 Å²	127.8	64%	0.636	72%	0.72	S	S	*	*				109.8	121.2	113.7	-80.1	-13.8	0	0	0	118
969	N	37.2	Very low	35.2	Very low	139 Å²	139	128.1 Å²	128.1	74%	0.743	72%	0.719	S	S	*	*			trans	69.1	141.3	135.9	-63.9	-14.8	0	0	0	117.1
970	S	36	Very low	35.2	Very low	92 Å²	92	128.1 Å²	128.1	64%	0.643	71%	0.714	S	S	*	*			cis	-179	136.3	-4.5	44.3	0	0	0	0	105.4
971	S	35	Very low	35.4	Very low	92 Å²	92	129.1 Å²	129.1	64%	0.643	72%	0.715	S	S	*	*			trans	73.5	128.1	130.2	70.7	0	0	0	0	121
972	N	35.2	Very low	35.5	Very low	132 Å²	132	129 Å²	129	71%	0.706	72%	0.717	S	S	*	*			trans	94.3	108.6	134.8	-65.8	-10.5	0	0	0	119.6
973	N	32.6	Very low	35.4	Very low	133 Å²	133	129.7 Å²	129.7	71%	0.711	72%	0.723	S	S	*	*				92.4	121.3	120.5	-74	-11.4	0	0	0	119.4
974	T	33.2	Very low	35.4	Very low	117 Å²	117	129.4 Å²	129.4	72%	0.718	72%	0.724	S	S	*	*			trans	68.5	96.7	138.5	55.2	0	0	0	0	117.8
975	H	31.7	Very low	35.3	Very low	263 Å²	263	131.2 Å²	131.2	100%	1.218	73%	0.728	S	S	*	*				-165.9	0	109	-106	-56.2	0	0	0	113

Retrieved 975 of 975 residues in 417.5 ms (Link to these results)

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