A0A077Z360_TRITR Loading...

G patch domain-containing protein 11

AlphaFold DB , UniProt , Accession A0A077Z360, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 821 aa.

						>A0A077Z360_TRITR|A0A077Z360
MSEDEDYMSDRILSQWYVEVIFESVCKSFFSPDVRPGVVGPSVAKRYRMDKKREEANVKNRQLKTGELERSTLQSGLKTALPEDNKGYALLKKMGFKPGCSIGKRASELEKLGLSKGPLKEPLPITLKADRFGLGHSEEVARKAKAELEDMVALTRSSQTDFIERKRAAEAYRTLTKDLRMARKACYDLDCTAGVQTPVMTSFWPKGALKSADEEELNASDDQNLTVQAKLSAEEITSLLKSLIEYLRKTYFYCLWCSVRYEDQLLGRKERLSSCLVPIKKLNFRGVCGDVLGNFVNLWVRMEQVLRKITNFEMMLVCGEFFGSDMTENLRITKGELRCPLPTYILGPVKPEAARYYCNVAGGEIGHNLIYLGKKGMFTSASGLTVAYLSGFESEYEDEFHFSEDTVDRLIASVTSRPSFSGIDILLTSQWPQGVEHLSPVAPDVYEEEDLRSSMLVTKLAAALRPRYHFSANTGCHFERPPYRNSPLVARQPGNTTRFVGLSRCGNPSKLKYLFAFNIIPFKYLAPGQATEESAVTTEFPYTETLQELEIRKEQKKQKKPNDNIKGKQFFFDFASVEASSATDNEQGSSFRKRNRREHGGQEKKANYGPCWFCLSSPEVEKHLIVSISDNAYLSLTKGGLCDDHFLISSIGHVQSISAADGEIKEEVEQYKSCLKSYFEDQGKCVVFFERNYRTQHMQVHAVPLPADKAVNIRACFLQTAANHGFELMEVAEDVEISEVVNPGCPYFFAELPYGQKLLVLRMRQFPVHFAREALTHRDLLNCPEKVDWHNCALTVEEETQLALKFRDSFSKYDFNQVLLP
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	42.9	Very low	212 Å²	212	138.1 Å²	138.1	100%	1.044	68%	0.68	S	S	*	*				0	116.8	0	-63.6	-107.1	-67.7	0	0	105.1
2	S	41.8	Very low	42.8	Very low	74 Å²	74	130.7 Å²	130.7	52%	0.517	65%	0.645	S	S	.	*			trans	-60.5	148.4	-162	38.3	0	0	0	0	113.2	D4 E5	S2-D4 PolarHBondContact O-N 3.24Å; S2-E5 PolarHBondContact O-N 3.21Å
3	E	41.8	Very low	42.5	Very low	191 Å²	191	128.3 Å²	128.3	89%	0.893	64%	0.635	S	S	*	*	G	3₁₀ helix	trans	-59.5	-3.9	179	-66.8	175.9	157.2	0	0	114.1
4	D	43	Very low	42.4	Very low	155 Å²	155	123.9 Å²	123.9	83%	0.829	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-90.6	-2.1	179.4	-64.2	-44.8	0	0	0	114.8	S2	S2-D4 PolarHBondContact O-N 3.24Å
5	E	42	Very low	42.1	Very low	134 Å²	134	125.1 Å²	125.1	63%	0.626	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-98.4	13.6	176.8	-67.3	-172.8	162.8	0	0	113.6	S2 Y7	S2-E5 PolarHBondContact O-N 3.21Å; E5-Y7 PolarHBondContact O-N 2.79Å; E5-Y7 VanDerWaalsContact O-N 3.1Å
6	D	45	Very low	41.8	Very low	105 Å²	105	126.8 Å²	126.8	56%	0.561	62%	0.623	S	S	*	*			trans	-74.6	104.8	176.2	-157.1	-11.5	0	0	0	110.6	M8 S9	D6-M8 PolarHBondContact O-N 3.32Å; D6-M8 PolarHBondContact OD1-N 2.75Å; D6-S9 PolarHBondContact O-N 3.41Å; D6-S9 PolarHBondContact O-OG 2.97Å
7	Y	48.6	Very low	41.6	Very low	111 Å²	111	131.8 Å²	131.8	44%	0.435	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.7	-4	175.4	173	-111.1	0	0	0	113.5	E5 I12 K510	E5-Y7 PolarHBondContact O-N 2.79Å; E5-Y7 VanDerWaalsContact O-N 3.1Å; Y7-I12 HydrophobicContact CD2-CD1 4.35Å; Y7-K510 VanDerWaalsContact CD1-NZ 3.28Å; Y7-K510 HydrophobicContact CD2-CD 4.26Å; Y7-K510 HydrophobicContact CE1-CD 3.75Å; Y7-K510 HydrophobicContact CE1-CG 4.03Å; Y7-K510 HydrophobicContact CE2-CD 3.44Å; Y7-K510 VanDerWaalsContact CE2-CD 3.44Å; Y7-K510 VanDerWaalsContact CE2-CE 3.42Å; Y7-K510 HydrophobicContact CE2-CG 4.34Å; Y7-K510 VanDerWaalsContact CZ-NZ 3.29Å; Y7-K510 WeakPolarHBondContact OH-CB 3.25Å; Y7-K510 WeakPolarHBondContact OH-CD 3.17Å; Y7-K510 WeakPolarHBondContact OH-CG 3.4Å
8	M	46.1	Very low	41.1	Very low	141 Å²	141	129.8 Å²	129.8	70%	0.695	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.5	13.4	174.4	-61.8	-147.2	69.4	0	0	115.1	D6	D6-M8 PolarHBondContact O-N 3.32Å; D6-M8 PolarHBondContact OD1-N 2.75Å
9	S	43.8	Very low	40.5	Very low	54 Å²	54	132.4 Å²	132.4	38%	0.378	64%	0.643	S	S	.	*			trans	-66.4	137.4	175.1	64.5	0	0	0	0	112.9	D6 R11 I12	D6-S9 PolarHBondContact O-N 3.41Å; D6-S9 PolarHBondContact O-OG 2.97Å; S9-R11 PolarHBondContact O-N 2.97Å; S9-I12 PolarHBondContact O-N 2.89Å
10	D	38.4	Very low	40.2	Very low	137 Å²	137	132.6 Å²	132.6	73%	0.733	65%	0.652	S	S	*	*	H	α-helix	trans	-54.7	-15.7	179	-78.7	-31.4	0	0	0	113.9	S14	D10-S14 PolarHBondContact O-N 3.23Å; D10-S14 PolarHBondContact O-OG 2.84Å
11	R	42.6	Very low	40.1	Very low	205 Å²	205	133.7 Å²	133.7	77%	0.774	66%	0.659	S	S	*	*	H	α-helix	trans	-74.1	-31.4	178.5	-152.1	177.5	-172.7	179.3	1.3	113.3	S9 S14	S9-R11 PolarHBondContact O-N 2.97Å; R11-S14 WeakPolarHBondContact CA-OG 3.43Å; R11-S14 PolarHBondContact O-OG 2.63Å
12	I	42	Very low	39.8	Very low	49 Å²	49	131.5 Å²	131.5	25%	0.251	64%	0.644	S	S	.	*	H	α-helix	trans	-78.2	-42.3	173.9	-67	169.8	0	0	0	108.9	Y7 S9 S14 Q15 W16	Y7-I12 HydrophobicContact CD2-CD1 4.35Å; S9-I12 PolarHBondContact O-N 2.89Å; I12-S14 PolarHBondContact O-N 2.82Å; I12-S14 VanDerWaalsContact O-N 3.17Å; I12-Q15 WeakPolarHBondContact O-CB 3.44Å; I12-Q15 PolarHBondContact O-N 2.96Å; I12-W16 PolarHBondContact O-N 3.42Å
13	L	39.2	Very low	39.4	Very low	100 Å²	100	134 Å²	134	52%	0.524	65%	0.648	S	S	.	*	H	α-helix	trans	-63.6	-22.3	179.5	-67.8	173.1	0	0	0	114.2
14	S	40.9	Very low	39	Very low	67 Å²	67	130.5 Å²	130.5	47%	0.469	64%	0.644	S	S	.	*	H	α-helix	trans	-80.9	-22.9	172	39.8	0	0	0	0	113.5	D10 R11 I12	D10-S14 PolarHBondContact O-N 3.23Å; D10-S14 PolarHBondContact O-OG 2.84Å; R11-S14 WeakPolarHBondContact CA-OG 3.43Å; R11-S14 PolarHBondContact O-OG 2.63Å; I12-S14 PolarHBondContact O-N 2.82Å; I12-S14 VanDerWaalsContact O-N 3.17Å
15	Q	37.5	Very low	38.8	Very low	141 Å²	141	128.1 Å²	128.1	66%	0.659	64%	0.635	S	S	*	*	H	α-helix	trans	-75.8	-28.2	174.9	-78.8	174.3	-21.9	0	0	113.2	I12 Y17	I12-Q15 WeakPolarHBondContact O-CB 3.44Å; I12-Q15 PolarHBondContact O-N 2.96Å; Q15-Y17 VanDerWaalsContact C-N 3.27Å; Q15-Y17 PolarHBondContact O-N 3.41Å
16	W	37.2	Very low	38.5	Very low	152 Å²	152	124.4 Å²	124.4	58%	0.576	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-7.8	178.2	-69.1	85.4	0	0	0	114.5	I12 K512	I12-W16 PolarHBondContact O-N 3.42Å; W16-K512 HydrophobicContact CZ3-CG 4.44Å
17	Y	38.6	Very low	37.8	Very low	213 Å²	213	126.6 Å²	126.6	84%	0.835	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-0.3	178.9	-105.2	-91.6	0	0	0	113.5	Q15	Q15-Y17 VanDerWaalsContact C-N 3.27Å; Q15-Y17 PolarHBondContact O-N 3.41Å
18	V	32.5	Very low	37.1	Very low	96 Å²	96	125.3 Å²	125.3	58%	0.582	63%	0.634	S	S	*	*			trans	-131.6	85.2	-170.5	-173.2	0	0	0	0	108.7
19	E	30.5	Very low	36.4	Very low	179 Å²	179	125.3 Å²	125.3	84%	0.836	63%	0.631	S	S	*	*	S	Bend	trans	-178.5	131.4	150.7	-101.5	161.4	-157.7	0	0	108.5
20	V	34.6	Very low	35.6	Very low	136 Å²	136	133 Å²	133	82%	0.824	66%	0.658	S	S	*	*	S	Bend	trans	82.9	94	178.5	-158	0	0	0	0	115.8
21	I	37	Very low	35.5	Very low	156 Å²	156	130.9 Å²	130.9	80%	0.8	65%	0.654	S	S	*	*	S	Bend	trans	120.2	-19.9	167.1	-62.5	160	0	0	0	114.9
22	F	33.5	Very low	35.2	Very low	165 Å²	165	126.4 Å²	126.4	72%	0.724	65%	0.651	S	S	*	*	S	Bend	trans	-94.7	-6.7	-174.9	-140.2	-100.1	0	0	0	116.2	C26	F22-C26 HydrophobicContact CD1-CB 3.99Å; F22-C26 HydrophobicContact CE1-CB 3.78Å; F22-C26 VanDerWaalsContact CE1-SG 3.58Å
23	E	33.5	Very low	34.9	Very low	128 Å²	128	129.4 Å²	129.4	60%	0.598	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-13.6	-162.8	-110.3	-161.7	130.8	0	0	117.7	K27	E23-K27 IonicContact OE1-NZ 3.58Å; E23-K27 PolarHBondContact OE1-NZ 3.01Å
24	S	33.6	Very low	35	Very low	117 Å²	117	130.3 Å²	130.3	82%	0.818	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.6	-8.8	-179.8	74.3	0	0	0	0	115.1
25	V	38.2	Very low	35.4	Very low	104 Å²	104	136.1 Å²	136.1	63%	0.63	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	-19.9	-176.1	-177.5	0	0	0	0	112.6
26	C	34.5	Very low	35.7	Very low	56 Å²	56	132.6 Å²	132.6	38%	0.378	68%	0.678	S	S	.	*	S	Bend	trans	-110.3	9.5	-168.2	-61.4	0	0	0	0	115.7	F22 S28	F22-C26 HydrophobicContact CD1-CB 3.99Å; F22-C26 HydrophobicContact CE1-CB 3.78Å; F22-C26 VanDerWaalsContact CE1-SG 3.58Å; C26-S28 VanDerWaalsContact C-N 3.32Å; C26-S28 PolarHBondContact O-N 3.45Å
27	K	31.4	Very low	36.5	Very low	152 Å²	152	127.6 Å²	127.6	66%	0.661	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	2.7	-176.9	-84.4	177.5	179.2	164.6	0	115.2	E23	E23-K27 IonicContact OE1-NZ 3.58Å; E23-K27 PolarHBondContact OE1-NZ 3.01Å
28	S	32.9	Very low	37.3	Very low	83 Å²	83	122.5 Å²	122.5	58%	0.58	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.7	-4.4	178.7	47.6	0	0	0	0	115.5	C26	C26-S28 VanDerWaalsContact C-N 3.32Å; C26-S28 PolarHBondContact O-N 3.45Å
29	F	31.5	Very low	38.2	Very low	141 Å²	141	124 Å²	124	62%	0.618	67%	0.674	S	S	*	*			trans	-119.7	57.4	-173.3	-89.6	-97.8	0	0	0	113.5	S31 E262	F29-S31 VanDerWaalsContact C-N 3.31Å; F29-S31 PolarHBondContact O-N 2.98Å; F29-S31 VanDerWaalsContact O-N 3.16Å; F29-E262 WeakPolarHBondContact CD2-OE1 3.48Å; F29-E262 HydrophobicContact CE2-CG 3.66Å; F29-E262 WeakPolarHBondContact CE2-OE1 3.04Å; F29-E262 HydrophobicContact CZ-CG 3.91Å
30	F	28.3	Very low	39.4	Very low	216 Å²	216	117.3 Å²	117.3	95%	0.947	65%	0.653	S	S	*	*			trans	-78.3	85.5	157.3	-95.3	-88.7	0	0	0	109.1
31	S	34.7	Very low	40.4	Very low	92 Å²	92	116.8 Å²	116.8	64%	0.643	65%	0.652	S	S	*	*	S	Bend	trans	-136.1	136.3	157.7	176.3	0	0	0	0	107.4	F29 D33	F29-S31 VanDerWaalsContact C-N 3.31Å; F29-S31 PolarHBondContact O-N 2.98Å; F29-S31 VanDerWaalsContact O-N 3.16Å; S31-D33 PolarHBondContact O-N 2.81Å
32	P	37.1	Very low	41.4	Very low	111 Å²	111	113.6 Å²	113.6	72%	0.721	64%	0.644	S	S	*	*			trans	-55.5	132.6	-175	20	-31.4	0	0	0	112.3	V34	P32-V34 VanDerWaalsContact C-N 3.35Å; P32-V34 PolarHBondContact O-N 3Å
33	D	36.7	Very low	42.6	Very low	113 Å²	113	110.2 Å²	110.2	60%	0.604	64%	0.637	S	S	*	*			trans	-65.1	85.2	177.2	-176.2	17.1	0	0	0	110.5	S31 R35	S31-D33 PolarHBondContact O-N 2.81Å; D33-R35 WeakPolarHBondContact OD1-CG 3.5Å; D33-R35 IonicContact OD1-NE 3.72Å; D33-R35 PolarHBondContact OD1-NE 3.4Å; D33-R35 IonicContact OD2-CZ 2.68Å; D33-R35 VanDerWaalsContact OD2-CZ 3.25Å; D33-R35 IonicContact OD2-NE 2.79Å; D33-R35 PolarHBondContact OD2-NE 2.94Å; D33-R35 IonicContact OD2-NH2 3.26Å; D33-R35 PolarHBondContact OD2-NH2 3Å
34	V	41.2	Very low	43.6	Very low	118 Å²	118	106.7 Å²	106.7	72%	0.715	63%	0.63	S	S	*	*			trans	-96.8	87.8	170.5	-170.7	0	0	0	0	107.6	P32 P36	P32-V34 VanDerWaalsContact C-N 3.35Å; P32-V34 PolarHBondContact O-N 3Å; V34-P36 WeakPolarHBondContact O-CD 3.29Å
35	R	49.3	Very low	45.2	Very low	189 Å²	189	108 Å²	108	71%	0.713	62%	0.62	S	S	*	*			trans	-74.3	105.5	176	-56.4	-176.8	-149.5	170.2	10.2	110.5	D33 G37	D33-R35 WeakPolarHBondContact OD1-CG 3.5Å; D33-R35 IonicContact OD1-NE 3.72Å; D33-R35 PolarHBondContact OD1-NE 3.4Å; D33-R35 IonicContact OD2-CZ 2.68Å; D33-R35 VanDerWaalsContact OD2-CZ 3.25Å; D33-R35 IonicContact OD2-NE 2.79Å; D33-R35 PolarHBondContact OD2-NE 2.94Å; D33-R35 IonicContact OD2-NH2 3.26Å; D33-R35 PolarHBondContact OD2-NH2 3Å; R35-G37 PolarHBondContact O-N 3.43Å
36	P	43.5	Very low	46.8	Very low	67 Å²	67	111.5 Å²	111.5	44%	0.435	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.3	123.2	177.9	-9.6	30.4	0	0	0	108.5	V34 D188	V34-P36 WeakPolarHBondContact O-CD 3.29Å; P36-D188 HydrophobicContact CB-CB 4.13Å; P36-D188 WeakPolarHBondContact CB-OD2 3.12Å
37	G	52.5	Low	48.1	Very low	48 Å²	48	117.6 Å²	117.6	50%	0.495	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	104.4	2.7	155.8	0	0	0	0	0	120.5	R35	R35-G37 PolarHBondContact O-N 3.43Å
38	V	56.6	Low	50	Low	105 Å²	105	119.4 Å²	119.4	64%	0.636	64%	0.641	S	S	*	*	S	Bend	trans	-108.5	-23.7	-167.3	-174.9	0	0	0	0	116.5
39	V	50.7	Low	51.9	Low	128 Å²	128	121 Å²	121	78%	0.776	64%	0.641	S	S	*	*			trans	-147.8	110.5	177.9	-163.6	0	0	0	0	112.1
40	G	55.9	Low	53.9	Low	38 Å²	38	118.1 Å²	118.1	39%	0.392	63%	0.632	S	S	.	*			trans	-90.8	152.2	170.5	0	0	0	0	0	112.2	S42 V43	G40-S42 PolarHBondContact O-N 2.73Å; G40-V43 PolarHBondContact O-N 3.25Å
41	P	55.3	Low	56	Low	125 Å²	125	113.7 Å²	113.7	81%	0.812	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	-20.1	175.3	-26	33.3	0	0	0	115.2	V43	P41-V43 PolarHBondContact O-N 3.33Å
42	S	58.6	Low	58	Low	90 Å²	90	116.9 Å²	116.9	63%	0.629	62%	0.615	S	S	*	*	H	α-helix	trans	-60	-35.6	178.2	155.5	0	0	0	0	114	G40 K45 R46	G40-S42 PolarHBondContact O-N 2.73Å; S42-K45 PolarHBondContact O-N 3.12Å; S42-R46 PolarHBondContact O-N 3.42Å; S42-R46 VanDerWaalsContact O-N 3.12Å
43	V	58.1	Low	59.8	Low	94 Å²	94	120 Å²	120	57%	0.57	61%	0.612	S	S	*	*	H	α-helix	trans	-70.4	-40.1	-173.5	-176.4	0	0	0	0	111.7	G40 P41 K45 R46 Y47	G40-V43 PolarHBondContact O-N 3.25Å; P41-V43 PolarHBondContact O-N 3.33Å; V43-K45 VanDerWaalsContact C-N 3.32Å; V43-K45 PolarHBondContact O-N 3.49Å; V43-R46 PolarHBondContact O-N 2.84Å; V43-Y47 PolarHBondContact O-N 3.43Å
44	A	54.5	Low	61.3	Low	54 Å²	54	121.1 Å²	121.1	45%	0.446	61%	0.613	S	S	.	*	H	α-helix	trans	-65.2	-34.7	175.7	0	0	0	0	0	112.4	R48	A44-R48 WeakPolarHBondContact O-CG 3.23Å; A44-R48 PolarHBondContact O-N 2.92Å
45	K	68.1	Low	63	Low	143 Å²	143	120.3 Å²	120.3	62%	0.622	60%	0.602	S	S	*	*	H	α-helix	trans	-66.8	-41.9	175.4	-172.5	177.5	179.3	-179.6	0	111.5	S42 V43 R48 M49	S42-K45 PolarHBondContact O-N 3.12Å; V43-K45 VanDerWaalsContact C-N 3.32Å; V43-K45 PolarHBondContact O-N 3.49Å; K45-R48 PolarHBondContact O-N 3.46Å; K45-M49 PolarHBondContact O-N 2.89Å
46	R	70.3	Confident	64.4	Low	178 Å²	178	113.4 Å²	113.4	67%	0.672	59%	0.585	S	S	*	*	H	α-helix	trans	-61.8	-46	179.2	-159.1	175.5	-170	163.1	4.2	111.8	S42 V43 R48 M49 D50	S42-R46 PolarHBondContact O-N 3.42Å; S42-R46 VanDerWaalsContact O-N 3.12Å; V43-R46 PolarHBondContact O-N 2.84Å; R46-R48 VanDerWaalsContact C-N 3.31Å; R46-R48 PolarHBondContact O-N 3.34Å; R46-M49 PolarHBondContact O-N 2.9Å; R46-D50 PolarHBondContact O-N 3.38Å
47	Y	61.9	Low	65.9	Low	185 Å²	185	115.4 Å²	115.4	73%	0.725	59%	0.593	S	S	*	*	H	α-helix	trans	-60.9	-37.4	178.3	-154.8	-93	0	0	0	113	V43 K51	V43-Y47 PolarHBondContact O-N 3.43Å; Y47-K51 PolarHBondContact O-N 3.01Å
48	R	72.6	Confident	66.8	Low	190 Å²	190	118.9 Å²	118.9	72%	0.717	60%	0.604	S	S	*	*	H	α-helix	trans	-67	-33.5	175.1	-69.3	178.2	-163.4	167.7	4.3	112.9	A44 K45 R46 K52	A44-R48 WeakPolarHBondContact O-CG 3.23Å; A44-R48 PolarHBondContact O-N 2.92Å; K45-R48 PolarHBondContact O-N 3.46Å; R46-R48 VanDerWaalsContact C-N 3.31Å; R46-R48 PolarHBondContact O-N 3.34Å; R48-K52 PolarHBondContact O-N 3.26Å
49	M	72.6	Confident	67.6	Low	115 Å²	115	122.5 Å²	122.5	57%	0.567	61%	0.611	S	S	*	*	H	α-helix	trans	-74.5	-41.9	178.5	-67.3	-160.9	-53.4	0	0	112.1	K45 R46 K51 K52 R53	K45-M49 PolarHBondContact O-N 2.89Å; R46-M49 PolarHBondContact O-N 2.9Å; M49-K51 PolarHBondContact O-N 2.85Å; M49-K52 PolarHBondContact O-N 3.36Å; M49-R53 PolarHBondContact O-N 3.22Å; M49-R53 VanDerWaalsContact O-N 3.15Å
50	D	73	Confident	68.6	Low	81 Å²	81	122.7 Å²	122.7	43%	0.433	61%	0.607	S	S	.	*	H	α-helix	trans	-63.3	-42.5	179.7	-71.2	-26.8	0	0	0	111.4	R46 K52 R53 E54	R46-D50 PolarHBondContact O-N 3.38Å; D50-K52 PolarHBondContact O-N 2.73Å; D50-R53 WeakPolarHBondContact O-CB 3.37Å; D50-R53 PolarHBondContact O-N 3.22Å; D50-R53 VanDerWaalsContact O-N 3.09Å; D50-E54 PolarHBondContact O-N 2.78Å; D50-E54 VanDerWaalsContact O-N 3.08Å
51	K	73	Confident	69.1	Low	124 Å²	124	130 Å²	130	54%	0.539	62%	0.623	S	S	.	*	H	α-helix	trans	-59	-43.5	175.3	-170	179.2	179.3	-176.1	0	113.1	Y47 M49 R53 E54 E55	Y47-K51 PolarHBondContact O-N 3.01Å; M49-K51 PolarHBondContact O-N 2.85Å; K51-R53 VanDerWaalsContact C-N 3.28Å; K51-R53 PolarHBondContact O-N 3.45Å; K51-E54 PolarHBondContact O-N 2.83Å; K51-E55 WeakPolarHBondContact CE-OE1 3.47Å; K51-E55 WeakPolarHBondContact O-CG 3.36Å; K51-E55 PolarHBondContact O-N 3.19Å; K51-E55 VanDerWaalsContact O-N 3.15Å
52	K	76.5	Confident	69.6	Low	158 Å²	158	132.4 Å²	132.4	69%	0.687	62%	0.624	S	S	*	*	H	α-helix	trans	-62.8	-34.3	175.9	-86.6	-173.7	173.7	-175.7	0	112.4	R48 M49 D50 A56	R48-K52 PolarHBondContact O-N 3.26Å; M49-K52 PolarHBondContact O-N 3.36Å; D50-K52 PolarHBondContact O-N 2.73Å; K52-A56 PolarHBondContact O-N 3.07Å
53	R	74.4	Confident	69.9	Low	178 Å²	178	133.4 Å²	133.4	67%	0.672	62%	0.622	S	S	*	*	H	α-helix	trans	-70.5	-39.9	179	-166.8	179.6	178.9	-175.1	-0.4	111.7	M49 D50 K51 A56 N57	M49-R53 PolarHBondContact O-N 3.22Å; M49-R53 VanDerWaalsContact O-N 3.15Å; D50-R53 WeakPolarHBondContact O-CB 3.37Å; D50-R53 PolarHBondContact O-N 3.22Å; D50-R53 VanDerWaalsContact O-N 3.09Å; K51-R53 VanDerWaalsContact C-N 3.28Å; K51-R53 PolarHBondContact O-N 3.45Å; R53-A56 PolarHBondContact O-N 3.38Å; R53-N57 PolarHBondContact O-N 2.88Å; R53-N57 VanDerWaalsContact O-N 3.1Å
54	E	69	Low	70.6	Confident	135 Å²	135	136.8 Å²	136.8	63%	0.631	63%	0.628	S	S	*	*	H	α-helix	trans	-63.6	-45.9	174.8	-72.6	-179.5	165.9	0	0	112	D50 K51 A56 N57 V58	D50-E54 PolarHBondContact O-N 2.78Å; D50-E54 VanDerWaalsContact O-N 3.08Å; K51-E54 PolarHBondContact O-N 2.83Å; E54-A56 VanDerWaalsContact C-N 3.31Å; E54-A56 PolarHBondContact O-N 2.91Å; E54-N57 PolarHBondContact O-N 3.3Å; E54-V58 WeakPolarHBondContact O-CG2 3.48Å; E54-V58 PolarHBondContact O-N 2.71Å
55	E	76.4	Confident	71.4	Confident	101 Å²	101	139.5 Å²	139.5	47%	0.472	64%	0.64	S	S	.	*	H	α-helix	trans	-61.4	-37.1	177.9	-70.9	172.1	-175.6	0	0	112.7	K51 K59	K51-E55 WeakPolarHBondContact CE-OE1 3.47Å; K51-E55 WeakPolarHBondContact O-CG 3.36Å; K51-E55 PolarHBondContact O-N 3.19Å; K51-E55 VanDerWaalsContact O-N 3.15Å; E55-K59 PolarHBondContact O-N 3.21Å
56	A	78.2	Confident	71.7	Confident	44 Å²	44	134.6 Å²	134.6	36%	0.364	63%	0.629	S	S	.	*	H	α-helix	trans	-70.2	-38.6	176.3	0	0	0	0	0	112.8	K52 R53 E54 V58 K59 N60	K52-A56 PolarHBondContact O-N 3.07Å; R53-A56 PolarHBondContact O-N 3.38Å; E54-A56 VanDerWaalsContact C-N 3.31Å; E54-A56 PolarHBondContact O-N 2.91Å; A56-V58 VanDerWaalsContact C-N 3.33Å; A56-V58 PolarHBondContact O-N 3.27Å; A56-K59 PolarHBondContact O-N 3.49Å; A56-N60 PolarHBondContact O-N 2.93Å
57	N	76	Confident	71.7	Confident	110 Å²	110	130.2 Å²	130.2	59%	0.588	62%	0.617	S	S	*	*	H	α-helix	trans	-65	-35.6	177.7	-78.5	-9.8	0	0	0	112.3	R53 E54	R53-N57 PolarHBondContact O-N 2.88Å; R53-N57 VanDerWaalsContact O-N 3.1Å; E54-N57 PolarHBondContact O-N 3.3Å
58	V	71.4	Confident	72.3	Confident	120 Å²	120	126.1 Å²	126.1	73%	0.727	61%	0.607	S	S	*	*	H	α-helix	trans	-68	-40.9	176.9	175.5	0	0	0	0	111.4	E54 A56	E54-V58 WeakPolarHBondContact O-CG2 3.48Å; E54-V58 PolarHBondContact O-N 2.71Å; A56-V58 VanDerWaalsContact C-N 3.33Å; A56-V58 PolarHBondContact O-N 3.27Å
59	K	73.6	Confident	72.4	Confident	182 Å²	182	123.5 Å²	123.5	79%	0.791	60%	0.603	S	S	*	*	H	α-helix	trans	-71	-29.4	-178.7	-73.8	-179	178.7	178.8	0	114.1	E55 A56	E55-K59 PolarHBondContact O-N 3.21Å; A56-K59 PolarHBondContact O-N 3.49Å
60	N	71.2	Confident	72.4	Confident	131 Å²	131	126.9 Å²	126.9	70%	0.701	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	15.8	-173.9	-70.1	-21.9	0	0	0	114.5	A56 Q62	A56-N60 PolarHBondContact O-N 2.93Å; N60-Q62 PolarHBondContact O-N 3.43Å
61	R	66.4	Low	72.4	Confident	191 Å²	191	126.9 Å²	126.9	72%	0.721	62%	0.615	S	S	*	*			trans	-73.4	108	-177.8	-173.3	179.8	175.3	-160.1	-4.6	111.5
62	Q	66.3	Low	72.6	Confident	176 Å²	176	125.5 Å²	125.5	82%	0.822	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-84.8	137.8	167	-66.2	179.5	-7.7	0	0	110.5	N60	N60-Q62 PolarHBondContact O-N 3.43Å
63	L	65.3	Low	72.4	Confident	112 Å²	112	123.2 Å²	123.2	59%	0.586	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-64.6	140.8	174.3	-75.7	162.9	0	0	0	110	E67	L63-E67 HydrophobicContact CD2-CB 4.31Å; L63-E67 WeakPolarHBondContact CD2-OE2 3.47Å
64	K	72	Confident	72.4	Confident	164 Å²	164	120.8 Å²	120.8	71%	0.713	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-70.2	147.8	175.7	-66.7	-179	179	179.8	0	109.4	G66 E67 L68	K64-G66 PolarHBondContact O-N 3.25Å; K64-G66 VanDerWaalsContact O-N 3.11Å; K64-E67 PolarHBondContact O-N 3.36Å; K64-L68 PolarHBondContact O-N 3.33Å
65	T	71.3	Confident	72.9	Confident	112 Å²	112	117.9 Å²	117.9	69%	0.687	60%	0.603	S	S	*	*	H	α-helix	trans	-48.8	-41.6	-179.3	5.2	0	0	0	0	113.2	E67 L68 E69	T65-E67 PolarHBondContact O-N 2.84Å; T65-L68 WeakPolarHBondContact O-CB 3.46Å; T65-L68 PolarHBondContact O-N 3.21Å; T65-E69 PolarHBondContact O-N 2.79Å
66	G	74.2	Confident	73	Confident	39 Å²	39	115.3 Å²	115.3	40%	0.402	60%	0.603	S	S	.	*	H	α-helix	trans	-69.4	-26	178.4	0	0	0	0	0	115.4	K64 R70	K64-G66 PolarHBondContact O-N 3.25Å; K64-G66 VanDerWaalsContact O-N 3.11Å; G66-R70 WeakPolarHBondContact O-CG 3.27Å; G66-R70 PolarHBondContact O-N 2.68Å
67	E	70.6	Confident	72.8	Confident	86 Å²	86	119.8 Å²	119.8	40%	0.402	62%	0.621	S	S	.	*	H	α-helix	trans	-74.9	-36.3	172.1	-75.7	175.3	152.5	0	0	110.8	L63 K64 T65 S71	L63-E67 HydrophobicContact CD2-CB 4.31Å; L63-E67 WeakPolarHBondContact CD2-OE2 3.47Å; K64-E67 PolarHBondContact O-N 3.36Å; T65-E67 PolarHBondContact O-N 2.84Å; E67-S71 PolarHBondContact O-N 3.48Å; E67-S71 VanDerWaalsContact O-N 3.16Å
68	L	74	Confident	72.7	Confident	100 Å²	100	123 Å²	123	52%	0.524	63%	0.629	S	S	.	*	H	α-helix	trans	-63.7	-46.1	175.9	-150.5	94.5	0	0	0	111.3	K64 T65 R70 S71 T72	K64-L68 PolarHBondContact O-N 3.33Å; T65-L68 WeakPolarHBondContact O-CB 3.46Å; T65-L68 PolarHBondContact O-N 3.21Å; L68-R70 PolarHBondContact O-N 3.3Å; L68-S71 PolarHBondContact O-N 3.22Å; L68-T72 PolarHBondContact O-N 3.13Å; L68-T72 PolarHBondContact O-OG1 3.37Å
69	E	74	Confident	72.9	Confident	134 Å²	134	122.2 Å²	122.2	63%	0.626	63%	0.625	S	S	*	*	H	α-helix	trans	-62	-41.6	178.7	-74.5	175.3	176.5	0	0	112.7	T65 S71 T72 L73	T65-E69 PolarHBondContact O-N 2.79Å; E69-S71 PolarHBondContact O-N 3.36Å; E69-T72 PolarHBondContact O-N 2.78Å; E69-L73 WeakPolarHBondContact O-CB 3.35Å; E69-L73 PolarHBondContact O-N 3.26Å
70	R	72.9	Confident	72.9	Confident	187 Å²	187	117.7 Å²	117.7	71%	0.706	62%	0.621	S	S	*	*	H	α-helix	trans	-63.6	-40.6	175.8	-76.5	-179.5	-171.3	166.7	2.9	112.4	G66 L68 L73 Q74	G66-R70 WeakPolarHBondContact O-CG 3.27Å; G66-R70 PolarHBondContact O-N 2.68Å; L68-R70 PolarHBondContact O-N 3.3Å; R70-L73 PolarHBondContact O-N 3.08Å; R70-Q74 PolarHBondContact O-N 3.19Å
71	S	73.8	Confident	73.2	Confident	80 Å²	80	116.6 Å²	116.6	56%	0.559	62%	0.615	S	S	*	*	H	α-helix	trans	-63.4	-44.7	176.8	-172.7	0	0	0	0	111.3	E67 L68 E69 L73 Q74 S75	E67-S71 PolarHBondContact O-N 3.48Å; E67-S71 VanDerWaalsContact O-N 3.16Å; L68-S71 PolarHBondContact O-N 3.22Å; E69-S71 PolarHBondContact O-N 3.36Å; S71-L73 VanDerWaalsContact C-N 3.35Å; S71-L73 PolarHBondContact O-N 2.73Å; S71-Q74 PolarHBondContact O-N 3.45Å; S71-S75 WeakPolarHBondContact O-CB 3.22Å; S71-S75 PolarHBondContact O-N 3.42Å
72	T	76.5	Confident	73.8	Confident	96 Å²	96	111.1 Å²	111.1	59%	0.589	60%	0.604	S	S	*	*	H	α-helix	trans	-63.9	-39.2	177.4	-51	0	0	0	0	111.8	L68 E69 S75 G76	L68-T72 PolarHBondContact O-N 3.13Å; L68-T72 PolarHBondContact O-OG1 3.37Å; E69-T72 PolarHBondContact O-N 2.78Å; T72-S75 WeakPolarHBondContact O-CB 3.42Å; T72-S75 PolarHBondContact O-N 2.84Å; T72-G76 PolarHBondContact O-N 2.95Å
73	L	73.5	Confident	74.3	Confident	110 Å²	110	109.1 Å²	109.1	58%	0.576	60%	0.595	S	S	*	*	H	α-helix	trans	-65	-47.1	177	-170.9	159	0	0	0	111.9	E69 R70 S71 S75 G76 L77	E69-L73 WeakPolarHBondContact O-CB 3.35Å; E69-L73 PolarHBondContact O-N 3.26Å; R70-L73 PolarHBondContact O-N 3.08Å; S71-L73 VanDerWaalsContact C-N 3.35Å; S71-L73 PolarHBondContact O-N 2.73Å; L73-S75 VanDerWaalsContact C-N 3.28Å; L73-S75 PolarHBondContact O-N 3.34Å; L73-G76 PolarHBondContact O-N 2.81Å; L73-G76 VanDerWaalsContact O-N 3.14Å; L73-L77 HydrophobicContact CD2-CD1 3.47Å; L73-L77 VanDerWaalsContact CD2-CD1 3.47Å; L73-L77 HydrophobicContact CD2-CG 4.16Å; L73-L77 PolarHBondContact O-N 2.77Å
74	Q	74.2	Confident	75	Confident	126 Å²	126	110.3 Å²	110.3	59%	0.589	60%	0.602	S	S	*	*	H	α-helix	trans	-64	-33.8	177.4	-76.2	-170.9	-5.8	0	0	112.5	R70 S71 K78	R70-Q74 PolarHBondContact O-N 3.19Å; S71-Q74 PolarHBondContact O-N 3.45Å; Q74-K78 WeakPolarHBondContact O-CG 3.27Å; Q74-K78 PolarHBondContact O-N 2.95Å
75	S	78.4	Confident	75.5	Confident	75 Å²	75	105.5 Å²	105.5	52%	0.524	58%	0.584	S	S	.	*	H	α-helix	trans	-63.8	-44.6	171.2	173.8	0	0	0	0	111.7	S71 T72 L73 K78 T79	S71-S75 WeakPolarHBondContact O-CB 3.22Å; S71-S75 PolarHBondContact O-N 3.42Å; T72-S75 WeakPolarHBondContact O-CB 3.42Å; T72-S75 PolarHBondContact O-N 2.84Å; L73-S75 VanDerWaalsContact C-N 3.28Å; L73-S75 PolarHBondContact O-N 3.34Å; S75-K78 PolarHBondContact O-N 3.43Å; S75-T79 PolarHBondContact O-OG1 3.29Å; S75-T79 VanDerWaalsContact O-OG1 3.12Å
76	G	79.2	Confident	76.1	Confident	46 Å²	46	109 Å²	109	47%	0.474	59%	0.59	S	S	.	*	H	α-helix	trans	-63.1	-43	178.3	0	0	0	0	0	113.5	T72 L73 K78 T79	T72-G76 PolarHBondContact O-N 2.95Å; L73-G76 PolarHBondContact O-N 2.81Å; L73-G76 VanDerWaalsContact O-N 3.14Å; G76-K78 VanDerWaalsContact C-N 3.25Å; G76-K78 PolarHBondContact O-N 2.97Å; G76-T79 PolarHBondContact O-N 2.59Å
77	L	74.4	Confident	76.2	Confident	138 Å²	138	108.7 Å²	108.7	72%	0.723	59%	0.587	S	S	*	*	H	α-helix	trans	-64.9	-25	179.2	-80	170.4	0	0	0	114	L73	L73-L77 HydrophobicContact CD2-CD1 3.47Å; L73-L77 VanDerWaalsContact CD2-CD1 3.47Å; L73-L77 HydrophobicContact CD2-CG 4.16Å; L73-L77 PolarHBondContact O-N 2.77Å
78	K	73.4	Confident	76.8	Confident	178 Å²	178	106 Å²	106	77%	0.774	57%	0.573	S	S	*	*	H	α-helix	trans	-83.1	-13.3	178	-72.6	-179.4	-178.3	-178.7	0	113.5	Q74 S75 G76	Q74-K78 WeakPolarHBondContact O-CG 3.27Å; Q74-K78 PolarHBondContact O-N 2.95Å; S75-K78 PolarHBondContact O-N 3.43Å; G76-K78 VanDerWaalsContact C-N 3.25Å; G76-K78 PolarHBondContact O-N 2.97Å
79	T	75.7	Confident	77.1	Confident	103 Å²	103	103.6 Å²	103.6	63%	0.632	57%	0.567	S	S	*	*	S	Bend	trans	-89.7	121.6	-175.8	-53.2	0	0	0	0	110.2	S75 G76	S75-T79 PolarHBondContact O-OG1 3.29Å; S75-T79 VanDerWaalsContact O-OG1 3.12Å; G76-T79 PolarHBondContact O-N 2.59Å
80	A	74.4	Confident	77.4	Confident	87 Å²	87	102.3 Å²	102.3	72%	0.719	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-65.2	144.9	179.4	0	0	0	0	0	112.2
81	L	77.4	Confident	77.6	Confident	109 Å²	109	96.8 Å²	96.8	57%	0.571	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-69.5	128.7	177.6	-77.3	154.1	0	0	0	110.7	N85	L81-N85 HydrophobicContact CD2-CB 4.49Å; L81-N85 WeakPolarHBondContact CD2-ND2 3.31Å
82	P	78.7	Confident	78	Confident	75 Å²	75	99.3 Å²	99.3	49%	0.487	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-73.1	155.6	178	30.8	-35.2	0	0	0	112.2	D84 N85	P82-D84 WeakPolarHBondContact CB-OD1 3.13Å; P82-D84 WeakPolarHBondContact CG-OD1 3.44Å; P82-D84 PolarHBondContact O-N 2.93Å; P82-N85 VanDerWaalsContact O-CB 3.26Å; P82-N85 WeakPolarHBondContact O-CB 3.49Å; P82-N85 PolarHBondContact O-N 3.45Å; P82-N85 VanDerWaalsContact O-N 3.1Å
83	E	76	Confident	78.3	Confident	134 Å²	134	103.6 Å²	103.6	63%	0.626	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.2	-18.3	-171.3	-62.4	-152.4	128.8	0	0	114.7	N85 Y88	E83-N85 VanDerWaalsContact C-N 3.26Å; E83-Y88 HydrophobicContact CB-CD1 4.07Å; E83-Y88 HydrophobicContact CB-CE1 3.85Å; E83-Y88 HydrophobicContact CG-CD1 4.28Å; E83-Y88 HydrophobicContact CG-CE1 3.61Å; E83-Y88 PolarHBondContact OE1-OH 3.27Å
84	D	80.5	Confident	78.3	Confident	138 Å²	138	105.1 Å²	105.1	74%	0.738	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-9.4	175.3	63.4	-20.2	0	0	0	113	P82 K86	P82-D84 WeakPolarHBondContact CB-OD1 3.13Å; P82-D84 WeakPolarHBondContact CG-OD1 3.44Å; P82-D84 PolarHBondContact O-N 2.93Å; D84-K86 PolarHBondContact O-N 3.31Å
85	N	83.5	Confident	78.2	Confident	62 Å²	62	101.9 Å²	101.9	33%	0.332	57%	0.566	S	S	.	*			trans	-71.8	128	179.2	-166.6	-48.4	0	0	0	111.4	L81 P82 E83 G87 Y88 A89	L81-N85 HydrophobicContact CD2-CB 4.49Å; L81-N85 WeakPolarHBondContact CD2-ND2 3.31Å; P82-N85 VanDerWaalsContact O-CB 3.26Å; P82-N85 WeakPolarHBondContact O-CB 3.49Å; P82-N85 PolarHBondContact O-N 3.45Å; P82-N85 VanDerWaalsContact O-N 3.1Å; E83-N85 VanDerWaalsContact C-N 3.26Å; N85-G87 PolarHBondContact O-N 3.33Å; N85-G87 VanDerWaalsContact O-N 3.09Å; N85-G87 PolarHBondContact OD1-N 2.87Å; N85-Y88 WeakPolarHBondContact O-CA 3.37Å; N85-Y88 WeakPolarHBondContact O-CB 3.3Å; N85-Y88 PolarHBondContact O-N 2.94Å; N85-A89 PolarHBondContact O-N 3.26Å
86	K	82.8	Confident	77.9	Confident	186 Å²	186	101.4 Å²	101.4	81%	0.809	55%	0.554	S	S	*	*	H	α-helix	trans	-51.1	-35.7	176.1	-68.1	179.6	-179.7	176.5	0	113	D84 A89 L90	D84-K86 PolarHBondContact O-N 3.31Å; K86-A89 PolarHBondContact O-N 3.44Å; K86-L90 PolarHBondContact O-N 2.7Å
87	G	77.5	Confident	77.7	Confident	33 Å²	33	106.1 Å²	106.1	34%	0.34	56%	0.562	S	S	.	*	H	α-helix	trans	-67.3	-40.1	176.8	0	0	0	0	0	112.8	N85 L90 L91	N85-G87 PolarHBondContact O-N 3.33Å; N85-G87 VanDerWaalsContact O-N 3.09Å; N85-G87 PolarHBondContact OD1-N 2.87Å; G87-L90 PolarHBondContact O-N 3.11Å; G87-L91 WeakPolarHBondContact O-CG 3.39Å; G87-L91 PolarHBondContact O-N 3.19Å
88	Y	81.2	Confident	77.5	Confident	30 Å²	30	104.1 Å²	104.1	12%	0.118	56%	0.557	C	S	.	*	H	α-helix	trans	-66.7	-40.7	174.6	-174.9	-96.7	0	0	0	111.4	E83 N85 L90 L91 K92 F96 P98	E83-Y88 HydrophobicContact CB-CD1 4.07Å; E83-Y88 HydrophobicContact CB-CE1 3.85Å; E83-Y88 HydrophobicContact CG-CD1 4.28Å; E83-Y88 HydrophobicContact CG-CE1 3.61Å; E83-Y88 PolarHBondContact OE1-OH 3.27Å; N85-Y88 WeakPolarHBondContact O-CA 3.37Å; N85-Y88 WeakPolarHBondContact O-CB 3.3Å; N85-Y88 PolarHBondContact O-N 2.94Å; Y88-L90 VanDerWaalsContact C-N 3.32Å; Y88-L90 PolarHBondContact O-N 3.47Å; Y88-L91 PolarHBondContact O-N 2.92Å; Y88-K92 WeakPolarHBondContact O-CB 3.29Å; Y88-K92 PolarHBondContact O-N 3.39Å; Y88-F96 HydrophobicContact CE2-CD1 4.46Å; Y88-F96 HydrophobicContact CE2-CE1 4.11Å; Y88-P98 WeakPolarHBondContact OH-CG 3.38Å
89	A	81.7	Confident	77.3	Confident	48 Å²	48	99.8 Å²	99.8	40%	0.397	56%	0.563	S	S	.	*	H	α-helix	trans	-62.5	-36.4	174.4	0	0	0	0	0	113	N85 K86 K93	N85-A89 PolarHBondContact O-N 3.26Å; K86-A89 PolarHBondContact O-N 3.44Å; A89-K93 PolarHBondContact O-N 3.36Å
90	L	80.9	Confident	76.8	Confident	108 Å²	108	98.3 Å²	98.3	57%	0.565	56%	0.556	S	S	*	*	H	α-helix	trans	-68.7	-44.8	174.6	-167.6	77.5	0	0	0	111.6	K86 G87 Y88 K92 K93 M94	K86-L90 PolarHBondContact O-N 2.7Å; G87-L90 PolarHBondContact O-N 3.11Å; Y88-L90 VanDerWaalsContact C-N 3.32Å; Y88-L90 PolarHBondContact O-N 3.47Å; L90-K92 VanDerWaalsContact C-N 3.31Å; L90-K92 PolarHBondContact O-N 2.94Å; L90-K93 WeakPolarHBondContact O-CB 3.42Å; L90-K93 PolarHBondContact O-N 2.91Å; L90-K93 VanDerWaalsContact O-N 3.15Å; L90-M94 WeakPolarHBondContact O-CG 3.4Å; L90-M94 PolarHBondContact O-N 3.24Å
91	L	75.8	Confident	76.2	Confident	70 Å²	70	97.6 Å²	97.6	37%	0.366	55%	0.546	S	S	.	.	H	α-helix	trans	-59.8	-42.4	175.9	-75.6	167.1	0	0	0	111.4	G87 Y88 K93 M94 G95 F96 I102	G87-L91 WeakPolarHBondContact O-CG 3.39Å; G87-L91 PolarHBondContact O-N 3.19Å; Y88-L91 PolarHBondContact O-N 2.92Å; L91-K93 VanDerWaalsContact C-N 3.31Å; L91-K93 PolarHBondContact O-N 2.89Å; L91-M94 CarbonylContact O-C 3.39Å; L91-M94 WeakPolarHBondContact O-CA 3.38Å; L91-M94 PolarHBondContact O-N 3.44Å; L91-G95 PolarHBondContact O-N 2.88Å; L91-F96 HydrophobicContact CB-CB 3.87Å; L91-F96 HydrophobicContact CB-CD1 4.19Å; L91-F96 HydrophobicContact CB-CG 4.16Å; L91-F96 WeakPolarHBondContact O-CB 3.34Å; L91-F96 PolarHBondContact O-N 3.36Å; L91-I102 HydrophobicContact CD2-CD1 4.34Å
92	K	81.6	Confident	75.4	Confident	133 Å²	133	96.8 Å²	96.8	58%	0.578	54%	0.541	S	S	*	.	H	α-helix	trans	-60.4	-38.4	175.3	-166.3	172.4	-175.9	171.7	0	112.1	Y88 L90 M94 G95	Y88-K92 WeakPolarHBondContact O-CB 3.29Å; Y88-K92 PolarHBondContact O-N 3.39Å; L90-K92 VanDerWaalsContact C-N 3.31Å; L90-K92 PolarHBondContact O-N 2.94Å; K92-M94 VanDerWaalsContact C-N 3.32Å; K92-G95 PolarHBondContact O-N 2.94Å
93	K	83.7	Confident	74.6	Confident	186 Å²	186	95.8 Å²	95.8	81%	0.809	54%	0.544	S	S	*	.	H	α-helix	trans	-68	-28	173	-75.9	-178.8	177.5	-178.3	0	113.4	A89 L90 L91 G95	A89-K93 PolarHBondContact O-N 3.36Å; L90-K93 WeakPolarHBondContact O-CB 3.42Å; L90-K93 PolarHBondContact O-N 2.91Å; L90-K93 VanDerWaalsContact O-N 3.15Å; L91-K93 VanDerWaalsContact C-N 3.31Å; L91-K93 PolarHBondContact O-N 2.89Å; K93-G95 VanDerWaalsContact C-N 3.27Å; K93-G95 PolarHBondContact O-N 2.84Å
94	M	73.4	Confident	73.9	Confident	142 Å²	142	95.3 Å²	95.3	70%	0.7	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	7.5	176.3	-66.6	-71.4	-171.7	0	0	113.6	L90 L91 K92	L90-M94 WeakPolarHBondContact O-CG 3.4Å; L90-M94 PolarHBondContact O-N 3.24Å; L91-M94 CarbonylContact O-C 3.39Å; L91-M94 WeakPolarHBondContact O-CA 3.38Å; L91-M94 PolarHBondContact O-N 3.44Å; K92-M94 VanDerWaalsContact C-N 3.32Å
95	G	73	Confident	72.8	Confident	58 Å²	58	98.7 Å²	98.7	60%	0.598	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.2	12.5	177.7	0	0	0	0	0	115.2	L91 K92 K93 K97	L91-G95 PolarHBondContact O-N 2.88Å; K92-G95 PolarHBondContact O-N 2.94Å; K93-G95 VanDerWaalsContact C-N 3.27Å; K93-G95 PolarHBondContact O-N 2.84Å; G95-K97 PolarHBondContact O-N 2.82Å
96	F	70.5	Confident	71.6	Confident	65 Å²	65	99.1 Å²	99.1	29%	0.285	56%	0.555	S	S	.	*			trans	-66.9	125.6	171.2	-175.3	-109.4	0	0	0	110.8	Y88 L91 I102	Y88-F96 HydrophobicContact CE2-CD1 4.46Å; Y88-F96 HydrophobicContact CE2-CE1 4.11Å; L91-F96 HydrophobicContact CB-CB 3.87Å; L91-F96 HydrophobicContact CB-CD1 4.19Å; L91-F96 HydrophobicContact CB-CG 4.16Å; L91-F96 WeakPolarHBondContact O-CB 3.34Å; L91-F96 PolarHBondContact O-N 3.36Å; F96-I102 HydrophobicContact CB-CD1 3.92Å; F96-I102 HydrophobicContact CB-CG1 4.45Å; F96-I102 HydrophobicContact CD2-CD1 4.18Å; F96-I102 HydrophobicContact CD2-CG1 4.45Å
97	K	75	Confident	70.4	Confident	145 Å²	145	94.2 Å²	94.2	63%	0.63	54%	0.544	S	S	*	.			trans	-113.7	137.7	167	-64.2	-175.4	-177.7	-177.9	0	108.4	G95 G99 C100	G95-K97 PolarHBondContact O-N 2.82Å; K97-G99 PolarHBondContact O-N 3.22Å; K97-G99 VanDerWaalsContact O-N 3.1Å; K97-C100 HydrophobicContact CB-CB 4.08Å; K97-C100 PolarHBondContact O-N 2.92Å
98	P	70.3	Confident	69.5	Low	97 Å²	97	97.5 Å²	97.5	63%	0.63	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.1	119.7	175	-24.1	33.7	0	0	0	110.2	Y88	Y88-P98 WeakPolarHBondContact OH-CG 3.38Å
99	G	69.5	Low	68.2	Low	87 Å²	87	97.6 Å²	97.6	90%	0.897	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.3	3.6	-176.2	0	0	0	0	0	116.3	K97	K97-G99 PolarHBondContact O-N 3.22Å; K97-G99 VanDerWaalsContact O-N 3.1Å
100	C	64.5	Low	67	Low	71 Å²	71	103.4 Å²	103.4	48%	0.48	57%	0.572	S	S	.	*			trans	-117.9	135.9	175.4	-63.3	0	0	0	0	111.9	K97	K97-C100 HydrophobicContact CB-CB 4.08Å; K97-C100 PolarHBondContact O-N 2.92Å
101	S	62.4	Low	65.9	Low	72 Å²	72	107.3 Å²	107.3	50%	0.503	58%	0.584	S	S	.	*			trans	-74.5	139	171.3	53.4	0	0	0	0	111.3	G103	S101-G103 PolarHBondContact O-N 3.48Å
102	I	61.4	Low	65.2	Low	92 Å²	92	109.4 Å²	109.4	47%	0.472	60%	0.595	S	S	.	*	S	Bend	trans	-72.6	117.8	169.4	-83.2	166.6	0	0	0	109	L91 F96	L91-I102 HydrophobicContact CD2-CD1 4.34Å; F96-I102 HydrophobicContact CB-CD1 3.92Å; F96-I102 HydrophobicContact CB-CG1 4.45Å; F96-I102 HydrophobicContact CD2-CD1 4.18Å; F96-I102 HydrophobicContact CD2-CG1 4.45Å
103	G	61.7	Low	63.6	Low	54 Å²	54	106.7 Å²	106.7	56%	0.557	61%	0.605	S	S	*	*	S	Bend	trans	146.9	159.6	174.2	0	0	0	0	0	114.5	S101	S101-G103 PolarHBondContact O-N 3.48Å
104	K	60.1	Low	62.1	Low	124 Å²	124	103.3 Å²	103.3	54%	0.539	60%	0.595	S	S	.	*			trans	-66.3	146.7	175	-75.9	-177.6	171.1	-169.5	0	111	E108 L109	K104-E108 WeakPolarHBondContact CD-OE2 3.26Å; K104-E108 IonicContact NZ-OE2 3.34Å; K104-L109 HydrophobicContact CB-CD1 3.96Å
105	R	59.3	Low	61.1	Low	209 Å²	209	102.3 Å²	102.3	79%	0.789	60%	0.602	S	S	*	*			trans	-66.8	148.8	177.2	-60.7	-174.9	-159.9	159.5	5.9	110.2	S107 E108	R105-S107 PolarHBondContact O-N 3.48Å; R105-E108 PolarHBondContact O-N 2.85Å
106	A	57.8	Low	60.2	Low	71 Å²	71	107.8 Å²	107.8	59%	0.587	61%	0.61	S	S	*	*	H	α-helix	trans	-50	-33.5	-177	0	0	0	0	0	114	E108 L109 E110	A106-E108 VanDerWaalsContact C-N 3.28Å; A106-E108 PolarHBondContact O-N 3.38Å; A106-L109 PolarHBondContact O-N 3Å; A106-L109 VanDerWaalsContact O-N 3.16Å; A106-E110 PolarHBondContact O-N 3.42Å
107	S	57.9	Low	59.5	Low	84 Å²	84	106.7 Å²	106.7	59%	0.587	62%	0.616	S	S	*	*	H	α-helix	trans	-66.1	-20.7	-179.9	60.6	0	0	0	0	115.3	R105	R105-S107 PolarHBondContact O-N 3.48Å
108	E	57.9	Low	58.6	Low	102 Å²	102	102.1 Å²	102.1	48%	0.477	60%	0.601	S	S	.	*	H	α-helix	trans	-91.7	-21	174.1	-88.2	-172.6	169	0	0	113	K104 R105 A106	K104-E108 WeakPolarHBondContact CD-OE2 3.26Å; K104-E108 IonicContact NZ-OE2 3.34Å; R105-E108 PolarHBondContact O-N 2.85Å; A106-E108 VanDerWaalsContact C-N 3.28Å; A106-E108 PolarHBondContact O-N 3.38Å
109	L	54	Low	58.1	Low	32 Å²	32	102.9 Å²	102.9	17%	0.168	60%	0.599	C	S	.	*	H	α-helix	trans	-77.6	-29	-179.8	-112.2	79.1	0	0	0	112.5	K104 A106 K111 L112 G113 L114 K116	K104-L109 HydrophobicContact CB-CD1 3.96Å; A106-L109 PolarHBondContact O-N 3Å; A106-L109 VanDerWaalsContact O-N 3.16Å; L109-K111 VanDerWaalsContact C-N 3.26Å; L109-K111 PolarHBondContact O-N 2.94Å; L109-L112 PolarHBondContact O-N 3.42Å; L109-L112 VanDerWaalsContact O-N 3.08Å; L109-G113 PolarHBondContact O-N 3.5Å; L109-L114 HydrophobicContact CD2-CB 4.26Å; L109-L114 HydrophobicContact CG-CB 4.37Å; L109-K116 WeakPolarHBondContact CD2-O 3.05Å
110	E	56.2	Low	57.5	Low	169 Å²	169	108.3 Å²	108.3	79%	0.79	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-63.7	-30.9	177.8	-133.7	170.9	-165.8	0	0	112.4	A106 L112	A106-E110 PolarHBondContact O-N 3.42Å; E110-L112 VanDerWaalsContact C-N 3.26Å; E110-L112 PolarHBondContact O-N 3.16Å
111	K	59	Low	57.1	Low	191 Å²	191	112.5 Å²	112.5	83%	0.83	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-74.2	-13.2	175	-70.3	-175.1	179.3	-179.6	0	114.1	L109	L109-K111 VanDerWaalsContact C-N 3.26Å; L109-K111 PolarHBondContact O-N 2.94Å
112	L	59.2	Low	56.9	Low	113 Å²	113	114.9 Å²	114.9	59%	0.592	63%	0.625	S	S	*	*	G	3₁₀ helix	trans	-115.3	4.8	-174.5	-78.1	159.4	0	0	0	113.2	L109 E110 L114	L109-L112 PolarHBondContact O-N 3.42Å; L109-L112 VanDerWaalsContact O-N 3.08Å; E110-L112 VanDerWaalsContact C-N 3.26Å; E110-L112 PolarHBondContact O-N 3.16Å; L112-L114 HydrophobicContact CB-CD1 4.04Å; L112-L114 PolarHBondContact O-N 2.73Å
113	G	48.6	Very low	56.8	Low	76 Å²	76	117.1 Å²	117.1	78%	0.784	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.9	18.4	175.4	0	0	0	0	0	115.1	L109	L109-G113 PolarHBondContact O-N 3.5Å
114	L	52.8	Low	56.4	Low	116 Å²	116	120 Å²	120	61%	0.607	65%	0.646	S	S	*	*			trans	-99.6	122.8	179.2	-80.2	124.2	0	0	0	111	L109 L112 K116	L109-L114 HydrophobicContact CD2-CB 4.26Å; L109-L114 HydrophobicContact CG-CB 4.37Å; L112-L114 HydrophobicContact CB-CD1 4.04Å; L112-L114 PolarHBondContact O-N 2.73Å; L114-K116 PolarHBondContact O-N 2.91Å
115	S	51.9	Low	56.5	Low	121 Å²	121	121.1 Å²	121.1	85%	0.846	66%	0.656	S	S	*	*			trans	-83.7	2.6	-171.9	54.8	0	0	0	0	115.7
116	K	54.4	Low	56.4	Low	173 Å²	173	117.6 Å²	117.6	75%	0.752	66%	0.658	S	S	*	*			trans	-118.6	102.3	-174.2	-70.7	-171.3	178.8	-179	0	112.5	L109 L114	L109-K116 WeakPolarHBondContact CD2-O 3.05Å; L114-K116 PolarHBondContact O-N 2.91Å
117	G	55.8	Low	56.2	Low	41 Å²	41	121.5 Å²	121.5	42%	0.423	67%	0.668	S	S	.	*			trans	-62.1	174.6	169.2	0	0	0	0	0	113.6	L119	G117-L119 PolarHBondContact O-N 3.1Å
118	P	56.2	Low	56.1	Low	49 Å²	49	123.4 Å²	123.4	32%	0.318	67%	0.666	S	S	.	*			trans	-58.9	129.3	-177.3	22.4	-31.7	0	0	0	112	K120	P118-K120 PolarHBondContact O-N 3.42Å
119	L	58.7	Low	56.3	Low	113 Å²	113	123.1 Å²	123.1	59%	0.592	68%	0.681	S	S	*	*			trans	-63.2	124.6	175.7	-89.9	84.2	0	0	0	110.1	G117 L123	G117-L119 PolarHBondContact O-N 3.1Å; L119-L123 HydrophobicContact CD2-CD2 4.08Å; L119-L123 HydrophobicContact CD2-CG 4.26Å
120	K	58.8	Low	56.3	Low	202 Å²	202	126.7 Å²	126.7	88%	0.878	70%	0.7	S	S	*	*	S	Bend	trans	-83.4	-17.7	173	-83.3	-179.6	174.9	178.1	0	113.5	P118	P118-K120 PolarHBondContact O-N 3.42Å
121	E	54.4	Low	56.4	Low	159 Å²	159	130.9 Å²	130.9	74%	0.743	71%	0.709	S	S	*	*	S	Bend	trans	-125.3	139.4	-173.5	-65.3	-177.8	178.9	0	0	111
122	P	59.6	Low	56.5	Low	121 Å²	121	128 Å²	128	79%	0.786	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-64.1	141	179.3	26	-32.4	0	0	0	111
123	L	58.7	Low	56.5	Low	140 Å²	140	125 Å²	125	73%	0.733	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-58.3	125.8	173.9	-73.2	166.1	0	0	0	109.5	L119 I125	L119-L123 HydrophobicContact CD2-CD2 4.08Å; L119-L123 HydrophobicContact CD2-CG 4.26Å; L123-I125 PolarHBondContact O-N 2.91Å; L123-I125 VanDerWaalsContact O-N 3.13Å
124	P	53.5	Low	56.7	Low	115 Å²	115	129.8 Å²	129.8	75%	0.747	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-63.6	117.7	179.6	23	-30.6	0	0	0	109.9	T126	P124-T126 PolarHBondContact O-N 3.45Å
125	I	61.5	Low	57	Low	147 Å²	147	126.2 Å²	126.2	75%	0.754	69%	0.691	S	S	*	*			trans	-80.9	106.9	175.3	-56.5	174	0	0	0	108	L123 L127	L123-I125 PolarHBondContact O-N 2.91Å; L123-I125 VanDerWaalsContact O-N 3.13Å; I125-L127 HydrophobicContact CG2-CD2 4.02Å; I125-L127 HydrophobicContact CG2-CG 3.96Å; I125-L127 PolarHBondContact O-N 3.12Å
126	T	58.2	Low	57.2	Low	135 Å²	135	125.1 Å²	125.1	83%	0.828	67%	0.672	S	S	*	*			trans	-87.2	94.1	171.3	-29	0	0	0	0	109	P124 K128	P124-T126 PolarHBondContact O-N 3.45Å; T126-K128 PolarHBondContact O-N 2.55Å
127	L	53	Low	57.4	Low	152 Å²	152	120.9 Å²	120.9	80%	0.796	67%	0.665	S	S	*	*			trans	-74.2	107.6	174.3	-70.7	171.2	0	0	0	109.6	I125 A129	I125-L127 HydrophobicContact CG2-CD2 4.02Å; I125-L127 HydrophobicContact CG2-CG 3.96Å; I125-L127 PolarHBondContact O-N 3.12Å; L127-A129 PolarHBondContact O-N 3.4Å
128	K	56.9	Low	57.5	Low	124 Å²	124	126.1 Å²	126.1	54%	0.539	68%	0.678	S	S	.	*			trans	-71.5	107.8	169.6	-171.2	179.3	175.4	-170.9	0	108.4	T126 D130 F132	T126-K128 PolarHBondContact O-N 2.55Å; K128-D130 PolarHBondContact O-N 2.81Å; K128-F132 PolarHBondContact NZ-O 3.26Å
129	A	61	Low	57.8	Low	97 Å²	97	127.3 Å²	127.3	80%	0.802	68%	0.679	S	S	*	*			trans	-79.8	-1.4	-177.8	0	0	0	0	0	114.2	L127	L127-A129 PolarHBondContact O-N 3.4Å
130	D	54.5	Low	58.1	Low	106 Å²	106	125.8 Å²	125.8	57%	0.567	68%	0.675	S	S	*	*			trans	-107.4	134.6	-168.2	-62.1	-31	0	0	0	113	K128 F132	K128-D130 PolarHBondContact O-N 2.81Å; D130-F132 HydrophobicContact CB-CD2 4.15Å; D130-F132 PolarHBondContact O-N 2.93Å
131	R	57.5	Low	58.4	Low	257 Å²	257	118.9 Å²	118.9	97%	0.97	66%	0.656	S	S	*	*			trans	-75.5	7.3	177.5	-63.5	-175	-174.2	-175.2	2.1	114.3
132	F	61	Low	59.3	Low	131 Å²	131	118.9 Å²	118.9	58%	0.575	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-86.3	134.9	-176.6	-63.4	-73.1	0	0	0	111.8	K128 D130 H136	K128-F132 PolarHBondContact NZ-O 3.26Å; D130-F132 HydrophobicContact CB-CD2 4.15Å; D130-F132 PolarHBondContact O-N 2.93Å; F132-H136 HydrophobicContact CB-CB 4.41Å; F132-H136 AromaticContact CD1-CD2 3.69Å
133	G	58.7	Low	60	Low	51 Å²	51	119.5 Å²	119.5	53%	0.526	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-54.2	147.4	178.3	0	0	0	0	0	112.6	G135 H136	G133-G135 PolarHBondContact O-N 3.4Å; G133-H136 PolarHBondContact O-N 3.11Å; G133-H136 VanDerWaalsContact O-N 3.14Å
134	L	53.4	Low	60.5	Low	175 Å²	175	115.2 Å²	115.2	92%	0.916	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	120.7	170	-83.9	122	0	0	0	108.7
135	G	59.1	Low	61.5	Low	41 Å²	41	115 Å²	115	42%	0.423	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	109.8	-19.3	-176.2	0	0	0	0	0	115	G133 S137 E138	G133-G135 PolarHBondContact O-N 3.4Å; G135-S137 VanDerWaalsContact C-N 3.3Å; G135-S137 PolarHBondContact O-N 3.44Å; G135-E138 PolarHBondContact O-N 3.28Å
136	H	56.7	Low	62.1	Low	98 Å²	98	110.2 Å²	110.2	45%	0.454	59%	0.594	S	S	.	*	H	α-helix	trans	-73.2	-25.1	178.3	-154.8	46.4	0	0	0	112.7	F132 G133 E138 E139 V140	F132-H136 HydrophobicContact CB-CB 4.41Å; F132-H136 AromaticContact CD1-CD2 3.69Å; G133-H136 PolarHBondContact O-N 3.11Å; G133-H136 VanDerWaalsContact O-N 3.14Å; H136-E138 VanDerWaalsContact C-N 3.33Å; H136-E138 PolarHBondContact O-N 2.85Å; H136-E139 PolarHBondContact O-N 3.19Å; H136-V140 WeakPolarHBondContact O-CB 3.16Å; H136-V140 VanDerWaalsContact O-CG2 3.29Å; H136-V140 WeakPolarHBondContact O-CG2 3.43Å; H136-V140 PolarHBondContact O-N 3.31Å
137	S	57.5	Low	62.8	Low	85 Å²	85	110.4 Å²	110.4	59%	0.594	59%	0.585	S	S	*	*	H	α-helix	trans	-65.6	-32.8	175	53.8	0	0	0	0	112.9	G135 A141	G135-S137 VanDerWaalsContact C-N 3.3Å; G135-S137 PolarHBondContact O-N 3.44Å; S137-A141 WeakPolarHBondContact O-CB 3.43Å; S137-A141 PolarHBondContact O-N 3.07Å
138	E	59.1	Low	63.8	Low	151 Å²	151	107.9 Å²	107.9	71%	0.706	57%	0.572	S	S	*	*	H	α-helix	trans	-73.5	-41.1	177.6	-92.7	177.5	155.5	0	0	111.8	G135 H136 A141 R142	G135-E138 PolarHBondContact O-N 3.28Å; H136-E138 VanDerWaalsContact C-N 3.33Å; H136-E138 PolarHBondContact O-N 2.85Å; E138-A141 PolarHBondContact O-N 3.15Å; E138-R142 WeakPolarHBondContact O-CB 3.13Å; E138-R142 PolarHBondContact O-N 2.84Å
139	E	62.2	Low	64.4	Low	73 Å²	73	107 Å²	107	34%	0.341	57%	0.57	S	S	.	*	H	α-helix	trans	-69.1	-40.9	178.8	-166.7	63.3	-154.7	0	0	111.6	H136 R142 K143	H136-E139 PolarHBondContact O-N 3.19Å; E139-R142 PolarHBondContact O-N 3.49Å; E139-R142 IonicContact OE1-CZ 3.65Å; E139-R142 IonicContact OE1-NE 3.81Å; E139-R142 IonicContact OE1-NH2 3.66Å; E139-R142 PolarHBondContact OE1-NH2 3.4Å; E139-R142 IonicContact OE2-CZ 2.63Å; E139-R142 IonicContact OE2-NE 2.81Å; E139-R142 IonicContact OE2-NH2 3.57Å; E139-R142 PolarHBondContact OE2-NH2 2.95Å; E139-K143 PolarHBondContact O-N 2.91Å
140	V	65.3	Low	65	Low	81 Å²	81	108.5 Å²	108.5	49%	0.491	56%	0.564	S	S	.	*	H	α-helix	trans	-67.4	-41.2	173.8	175.2	0	0	0	0	110.9	H136 R142 K143 A144	H136-V140 WeakPolarHBondContact O-CB 3.16Å; H136-V140 VanDerWaalsContact O-CG2 3.29Å; H136-V140 WeakPolarHBondContact O-CG2 3.43Å; H136-V140 PolarHBondContact O-N 3.31Å; V140-R142 VanDerWaalsContact C-N 3.34Å; V140-R142 PolarHBondContact O-N 2.97Å; V140-K143 PolarHBondContact O-N 3.37Å; V140-A144 WeakPolarHBondContact O-CB 3.29Å; V140-A144 PolarHBondContact O-N 3.12Å
141	A	65.3	Low	65.5	Low	58 Å²	58	109 Å²	109	48%	0.479	57%	0.565	S	S	.	*	H	α-helix	trans	-66.1	-35.1	175	0	0	0	0	0	112.3	S137 E138 K145	S137-A141 WeakPolarHBondContact O-CB 3.43Å; S137-A141 PolarHBondContact O-N 3.07Å; E138-A141 PolarHBondContact O-N 3.15Å; A141-K145 WeakPolarHBondContact O-CB 3.19Å; A141-K145 PolarHBondContact O-N 3.43Å
142	R	72.2	Confident	65.9	Low	158 Å²	158	99.7 Å²	99.7	60%	0.596	54%	0.537	S	S	*	.	H	α-helix	trans	-68.5	-45.1	176.4	-170.8	-179.6	71	150.1	1.6	111.4	E138 E139 V140 K145 A146	E138-R142 WeakPolarHBondContact O-CB 3.13Å; E138-R142 PolarHBondContact O-N 2.84Å; E139-R142 PolarHBondContact O-N 3.49Å; E139-R142 IonicContact OE1-CZ 3.65Å; E139-R142 IonicContact OE1-NE 3.81Å; E139-R142 IonicContact OE1-NH2 3.66Å; E139-R142 PolarHBondContact OE1-NH2 3.4Å; E139-R142 IonicContact OE2-CZ 2.63Å; E139-R142 IonicContact OE2-NE 2.81Å; E139-R142 IonicContact OE2-NH2 3.57Å; E139-R142 PolarHBondContact OE2-NH2 2.95Å; V140-R142 VanDerWaalsContact C-N 3.34Å; V140-R142 PolarHBondContact O-N 2.97Å; R142-K145 PolarHBondContact O-N 3.5Å; R142-A146 WeakPolarHBondContact O-CB 3.15Å; R142-A146 PolarHBondContact O-N 3.38Å
143	K	73.9	Confident	66	Low	134 Å²	134	96.2 Å²	96.2	58%	0.583	53%	0.532	S	S	*	.	H	α-helix	trans	-64.5	-44	174.3	-76	-175.5	176.8	-176.7	0	112	E139 V140 K145 A146 E147	E139-K143 PolarHBondContact O-N 2.91Å; V140-K143 PolarHBondContact O-N 3.37Å; K143-K145 VanDerWaalsContact C-N 3.32Å; K143-K145 PolarHBondContact O-N 2.85Å; K143-A146 PolarHBondContact O-N 3Å; K143-E147 PolarHBondContact O-N 2.93Å
144	A	70.5	Confident	66.2	Low	50 Å²	50	100 Å²	100	41%	0.413	54%	0.539	S	S	.	.	H	α-helix	trans	-64.7	-35	175.7	0	0	0	0	0	112.4	V140 L148	V140-A144 WeakPolarHBondContact O-CB 3.29Å; V140-A144 PolarHBondContact O-N 3.12Å; A144-L148 WeakPolarHBondContact O-CB 3.21Å; A144-L148 PolarHBondContact O-N 3.4Å
145	K	73.7	Confident	66.1	Low	110 Å²	110	94.3 Å²	94.3	48%	0.478	51%	0.512	S	S	.	.	H	α-helix	trans	-67.9	-43.6	174.5	-170.1	-176.6	-177	-165.3	0	111.4	A141 R142 K143 L148 E149	A141-K145 WeakPolarHBondContact O-CB 3.19Å; A141-K145 PolarHBondContact O-N 3.43Å; R142-K145 PolarHBondContact O-N 3.5Å; K143-K145 VanDerWaalsContact C-N 3.32Å; K143-K145 PolarHBondContact O-N 2.85Å; K145-L148 PolarHBondContact O-N 3.4Å; K145-E149 WeakPolarHBondContact CE-OE1 3.31Å; K145-E149 IonicContact NZ-OE1 2.95Å; K145-E149 WeakPolarHBondContact O-CB 3.49Å; K145-E149 WeakPolarHBondContact O-CG 3.21Å; K145-E149 PolarHBondContact O-N 2.99Å
146	A	75.3	Confident	65.9	Low	48 Å²	48	97.7 Å²	97.7	40%	0.397	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-44.6	176.6	0	0	0	0	0	112.1	R142 K143 L148 E149 D150	R142-A146 WeakPolarHBondContact O-CB 3.15Å; R142-A146 PolarHBondContact O-N 3.38Å; K143-A146 PolarHBondContact O-N 3Å; A146-L148 VanDerWaalsContact C-N 3.32Å; A146-L148 PolarHBondContact O-N 2.92Å; A146-E149 PolarHBondContact O-N 3.36Å; A146-D150 PolarHBondContact O-N 3.02Å
147	E	72.1	Confident	65.9	Low	138 Å²	138	96.6 Å²	96.6	65%	0.645	52%	0.515	S	S	*	.	H	α-helix	trans	-64.5	-36	174.3	-75	179.3	171.6	0	0	112.1	K143 M151	K143-E147 PolarHBondContact O-N 2.93Å; E147-M151 WeakPolarHBondContact O-CB 3.11Å; E147-M151 PolarHBondContact O-N 3.11Å
148	L	73.2	Confident	65.6	Low	100 Å²	100	95.8 Å²	95.8	52%	0.524	51%	0.51	S	S	.	.	H	α-helix	trans	-69.2	-38	174.3	-173.2	68.1	0	0	0	111.7	A144 K145 A146 M151 V152	A144-L148 WeakPolarHBondContact O-CB 3.21Å; A144-L148 PolarHBondContact O-N 3.4Å; K145-L148 PolarHBondContact O-N 3.4Å; A146-L148 VanDerWaalsContact C-N 3.32Å; A146-L148 PolarHBondContact O-N 2.92Å; L148-M151 PolarHBondContact O-N 2.78Å; L148-V152 HydrophobicContact CD1-CG2 4.38Å; L148-V152 HydrophobicContact CG-CG2 4.28Å; L148-V152 WeakPolarHBondContact O-CB 3.33Å; L148-V152 WeakPolarHBondContact O-CG2 3.36Å; L148-V152 PolarHBondContact O-N 3.42Å
149	E	70.7	Confident	65.2	Low	106 Å²	106	93.8 Å²	93.8	50%	0.495	50%	0.5	S	S	.	.	H	α-helix	trans	-65.4	-44.7	175.8	-79.3	171.9	179.3	0	0	111.4	K145 A146 V152 A153	K145-E149 WeakPolarHBondContact CE-OE1 3.31Å; K145-E149 IonicContact NZ-OE1 2.95Å; K145-E149 WeakPolarHBondContact O-CB 3.49Å; K145-E149 WeakPolarHBondContact O-CG 3.21Å; K145-E149 PolarHBondContact O-N 2.99Å; A146-E149 PolarHBondContact O-N 3.36Å; E149-V152 PolarHBondContact O-N 3.28Å; E149-A153 WeakPolarHBondContact O-CB 3.41Å; E149-A153 PolarHBondContact O-N 3.24Å
150	D	72.3	Confident	64.7	Low	127 Å²	127	94.6 Å²	94.6	68%	0.679	51%	0.51	S	S	*	.	H	α-helix	trans	-63.1	-42.1	173.5	-89	-8	0	0	0	111.6	A146 A153 L154	A146-D150 PolarHBondContact O-N 3.02Å; D150-A153 PolarHBondContact O-N 3.2Å; D150-L154 WeakPolarHBondContact O-CB 3.35Å; D150-L154 PolarHBondContact O-N 3.27Å
151	M	66.1	Low	64.5	Low	116 Å²	116	94 Å²	94	57%	0.571	51%	0.505	S	S	*	.	H	α-helix	trans	-67	-36.9	176.6	-156.7	-169.9	-37.9	0	0	111.6	E147 L148 T155	E147-M151 WeakPolarHBondContact O-CB 3.11Å; E147-M151 PolarHBondContact O-N 3.11Å; L148-M151 PolarHBondContact O-N 2.78Å; M151-T155 WeakPolarHBondContact O-CB 3.49Å; M151-T155 PolarHBondContact O-N 2.74Å; M151-T155 PolarHBondContact O-OG1 2.9Å
152	V	65.7	Low	64.5	Low	63 Å²	63	96.7 Å²	96.7	38%	0.382	51%	0.505	S	S	.	.	H	α-helix	trans	-71.3	-35	175.3	167.5	0	0	0	0	111.2	L148 E149 T155 R156	L148-V152 HydrophobicContact CD1-CG2 4.38Å; L148-V152 HydrophobicContact CG-CG2 4.28Å; L148-V152 WeakPolarHBondContact O-CB 3.33Å; L148-V152 WeakPolarHBondContact O-CG2 3.36Å; L148-V152 PolarHBondContact O-N 3.42Å; E149-V152 PolarHBondContact O-N 3.28Å; V152-T155 CarbonylContact O-C 3.52Å; V152-T155 PolarHBondContact O-N 3.43Å; V152-R156 VanDerWaalsContact O-CB 3.29Å; V152-R156 WeakPolarHBondContact O-CB 3.45Å; V152-R156 WeakPolarHBondContact O-CG 3.25Å; V152-R156 PolarHBondContact O-N 3.1Å
153	A	63.7	Low	64.3	Low	57 Å²	57	93.4 Å²	93.4	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-67.4	-46.3	174.7	0	0	0	0	0	111.4	E149 D150 T155 R156 S157	E149-A153 WeakPolarHBondContact O-CB 3.41Å; E149-A153 PolarHBondContact O-N 3.24Å; D150-A153 PolarHBondContact O-N 3.2Å; A153-T155 VanDerWaalsContact C-N 3.3Å; A153-T155 PolarHBondContact O-N 3.14Å; A153-R156 PolarHBondContact O-N 3.16Å; A153-S157 PolarHBondContact O-N 3.22Å
154	L	62.7	Low	64	Low	131 Å²	131	93.4 Å²	93.4	69%	0.686	50%	0.501	S	S	*	.	H	α-helix	trans	-62.9	-39.9	173.4	-156.6	78.8	0	0	0	110.9	D150 S157 S158	D150-L154 WeakPolarHBondContact O-CB 3.35Å; D150-L154 PolarHBondContact O-N 3.27Å; L154-S157 PolarHBondContact O-OG 3.4Å; L154-S158 VanDerWaalsContact O-CB 3.29Å; L154-S158 WeakPolarHBondContact O-CB 3.23Å; L154-S158 PolarHBondContact O-N 3.23Å; L154-S158 VanDerWaalsContact O-N 3.08Å
155	T	51.7	Low	64.2	Low	55 Å²	55	99.1 Å²	99.1	34%	0.337	51%	0.512	S	S	.	.	H	α-helix	trans	-69.6	-31.6	176	-57.8	0	0	0	0	112.1	M151 V152 A153 S158 Q159	M151-T155 WeakPolarHBondContact O-CB 3.49Å; M151-T155 PolarHBondContact O-N 2.74Å; M151-T155 PolarHBondContact O-OG1 2.9Å; V152-T155 CarbonylContact O-C 3.52Å; V152-T155 PolarHBondContact O-N 3.43Å; A153-T155 VanDerWaalsContact C-N 3.3Å; A153-T155 PolarHBondContact O-N 3.14Å; T155-S158 CarbonylContact O-C 3.5Å; T155-S158 PolarHBondContact O-N 3.38Å; T155-Q159 HydrophobicContact CG2-CG 3.84Å; T155-Q159 WeakPolarHBondContact O-CA 3.14Å; T155-Q159 WeakPolarHBondContact O-CB 3.23Å; T155-Q159 WeakPolarHBondContact O-CG 3.4Å; T155-Q159 PolarHBondContact O-N 3.31Å
156	R	54.7	Low	64.1	Low	112 Å²	112	100 Å²	100	42%	0.423	52%	0.516	S	S	.	.	H	α-helix	trans	-68.2	-44.9	177	-95.1	178.8	169.6	167.9	-2.7	111.9	V152 A153 S158 Q159 T160	V152-R156 VanDerWaalsContact O-CB 3.29Å; V152-R156 WeakPolarHBondContact O-CB 3.45Å; V152-R156 WeakPolarHBondContact O-CG 3.25Å; V152-R156 PolarHBondContact O-N 3.1Å; A153-R156 PolarHBondContact O-N 3.16Å; R156-S158 PolarHBondContact O-N 3.27Å; R156-Q159 PolarHBondContact O-N 3.4Å; R156-T160 PolarHBondContact O-N 2.97Å
157	S	55.2	Low	64.1	Low	75 Å²	75	106.6 Å²	106.6	52%	0.524	53%	0.53	S	S	.	.	H	α-helix	trans	-64.1	-33.4	172.1	72.7	0	0	0	0	111.8	A153 L154 T160	A153-S157 PolarHBondContact O-N 3.22Å; L154-S157 PolarHBondContact O-OG 3.4Å; S157-T160 PolarHBondContact O-OG1 3.15Å
158	S	52.8	Low	64.3	Low	69 Å²	69	103 Å²	103	48%	0.483	52%	0.524	S	S	.	.	H	α-helix	trans	-75.6	-26.4	174.2	-174.9	0	0	0	0	113.6	L154 T155 R156 D161 F162	L154-S158 VanDerWaalsContact O-CB 3.29Å; L154-S158 WeakPolarHBondContact O-CB 3.23Å; L154-S158 PolarHBondContact O-N 3.23Å; L154-S158 VanDerWaalsContact O-N 3.08Å; T155-S158 CarbonylContact O-C 3.5Å; T155-S158 PolarHBondContact O-N 3.38Å; R156-S158 PolarHBondContact O-N 3.27Å; S158-D161 WeakPolarHBondContact O-CB 3.37Å; S158-F162 WeakPolarHBondContact O-CB 3.47Å; S158-F162 PolarHBondContact O-N 3.42Å
159	Q	50.2	Low	64.5	Low	108 Å²	108	100.2 Å²	100.2	51%	0.505	52%	0.515	S	S	.	.	H	α-helix	trans	-81.1	-37.5	-174.6	-90.7	-179.5	5.6	0	0	112.8	T155 R156 D161 F162 I163	T155-Q159 HydrophobicContact CG2-CG 3.84Å; T155-Q159 WeakPolarHBondContact O-CA 3.14Å; T155-Q159 WeakPolarHBondContact O-CB 3.23Å; T155-Q159 WeakPolarHBondContact O-CG 3.4Å; T155-Q159 PolarHBondContact O-N 3.31Å; R156-Q159 PolarHBondContact O-N 3.4Å; Q159-D161 VanDerWaalsContact C-N 3.35Å; Q159-F162 PolarHBondContact O-N 3.29Å; Q159-I163 WeakPolarHBondContact O-CG1 3.29Å; Q159-I163 PolarHBondContact O-N 3.47Å
160	T	50.4	Low	64.8	Low	90 Å²	90	100 Å²	100	55%	0.552	51%	0.514	S	S	*	.	H	α-helix	trans	-62.7	-46.9	170.4	48.9	0	0	0	0	109.8	R156 S157 F162 I163 E164	R156-T160 PolarHBondContact O-N 2.97Å; S157-T160 PolarHBondContact O-OG1 3.15Å; T160-F162 VanDerWaalsContact C-N 3.3Å; T160-F162 PolarHBondContact O-N 3.11Å; T160-I163 PolarHBondContact O-N 3.2Å; T160-E164 PolarHBondContact O-N 2.88Å; T160-E164 VanDerWaalsContact O-N 3.13Å
161	D	62.2	Low	65.1	Low	70 Å²	70	96.4 Å²	96.4	37%	0.374	50%	0.503	S	S	.	.	H	α-helix	trans	-57.3	-40.4	171.3	-97.1	31.1	0	0	0	112.3	S158 Q159 R165	S158-D161 WeakPolarHBondContact O-CB 3.37Å; Q159-D161 VanDerWaalsContact C-N 3.35Å; D161-R165 WeakPolarHBondContact O-CB 3.28Å; D161-R165 WeakPolarHBondContact O-CD 3.49Å; D161-R165 WeakPolarHBondContact O-CG 3.2Å; D161-R165 PolarHBondContact O-N 2.81Å; D161-R165 IonicContact OD2-CZ 3.9Å; D161-R165 IonicContact OD2-NE 3.22Å; D161-R165 IonicContact OD2-NH2 3.49Å; D161-R165 PolarHBondContact OD2-NH2 3.5Å
162	F	65.6	Low	66	Low	113 Å²	113	94.3 Å²	94.3	50%	0.496	49%	0.489	S	S	.	.	H	α-helix	trans	-70	-41.6	-178.6	-179.3	-99.9	0	0	0	112.6	S158 Q159 T160 R165 K166	S158-F162 WeakPolarHBondContact O-CB 3.47Å; S158-F162 PolarHBondContact O-N 3.42Å; Q159-F162 PolarHBondContact O-N 3.29Å; T160-F162 VanDerWaalsContact C-N 3.3Å; T160-F162 PolarHBondContact O-N 3.11Å; F162-R165 PolarHBondContact O-N 3.31Å; F162-K166 HydrophobicContact CD1-CG 4.21Å; F162-K166 HydrophobicContact CE1-CD 4.17Å; F162-K166 HydrophobicContact CE1-CG 3.91Å; F162-K166 HydrophobicContact CE2-CG 4.37Å; F162-K166 HydrophobicContact CZ-CD 4.2Å; F162-K166 HydrophobicContact CZ-CG 4.03Å; F162-K166 VanDerWaalsContact O-CB 3.28Å; F162-K166 WeakPolarHBondContact O-CB 3.34Å; F162-K166 WeakPolarHBondContact O-CG 3.27Å; F162-K166 PolarHBondContact O-N 2.92Å
163	I	66.7	Low	66.9	Low	90 Å²	90	99 Å²	99	46%	0.462	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-45.9	177.3	-69.2	163.2	0	0	0	109.8	Q159 T160 K166 R167	Q159-I163 WeakPolarHBondContact O-CG1 3.29Å; Q159-I163 PolarHBondContact O-N 3.47Å; T160-I163 PolarHBondContact O-N 3.2Å; I163-K166 PolarHBondContact O-N 2.89Å; I163-R167 WeakPolarHBondContact O-CG 3.4Å; I163-R167 PolarHBondContact O-N 2.95Å
164	E	69.4	Low	67.8	Low	133 Å²	133	99.5 Å²	99.5	62%	0.621	50%	0.497	S	S	*	.	H	α-helix	trans	-64.4	-44.9	176.3	-71.8	-172.3	170.4	0	0	111.9	T160 K166 R167 A168	T160-E164 PolarHBondContact O-N 2.88Å; T160-E164 VanDerWaalsContact O-N 3.13Å; E164-K166 VanDerWaalsContact C-N 3.3Å; E164-K166 PolarHBondContact O-N 3.29Å; E164-R167 PolarHBondContact O-N 2.95Å; E164-A168 VanDerWaalsContact O-CB 3.26Å; E164-A168 WeakPolarHBondContact O-CB 3.42Å; E164-A168 PolarHBondContact O-N 2.97Å
165	R	73.2	Confident	68.9	Low	171 Å²	171	95.1 Å²	95.1	65%	0.645	47%	0.474	S	S	*	.	H	α-helix	trans	-60	-38.2	173.8	-74.6	171.5	-162.4	-166	10.4	112.1	D161 F162 A169	D161-R165 WeakPolarHBondContact O-CB 3.28Å; D161-R165 WeakPolarHBondContact O-CD 3.49Å; D161-R165 WeakPolarHBondContact O-CG 3.2Å; D161-R165 PolarHBondContact O-N 2.81Å; D161-R165 IonicContact OD2-CZ 3.9Å; D161-R165 IonicContact OD2-NE 3.22Å; D161-R165 IonicContact OD2-NH2 3.49Å; D161-R165 PolarHBondContact OD2-NH2 3.5Å; F162-R165 PolarHBondContact O-N 3.31Å; R165-A169 WeakPolarHBondContact O-CB 3.45Å; R165-A169 PolarHBondContact O-N 3.49Å
166	K	72.9	Confident	70.5	Confident	129 Å²	129	95.2 Å²	95.2	56%	0.561	48%	0.475	S	S	*	.	H	α-helix	trans	-67.2	-45.5	175.2	-85.8	-118.6	-176.7	171.8	0	112	F162 I163 E164 A169 E170	F162-K166 HydrophobicContact CD1-CG 4.21Å; F162-K166 HydrophobicContact CE1-CD 4.17Å; F162-K166 HydrophobicContact CE1-CG 3.91Å; F162-K166 HydrophobicContact CE2-CG 4.37Å; F162-K166 HydrophobicContact CZ-CD 4.2Å; F162-K166 HydrophobicContact CZ-CG 4.03Å; F162-K166 VanDerWaalsContact O-CB 3.28Å; F162-K166 WeakPolarHBondContact O-CB 3.34Å; F162-K166 WeakPolarHBondContact O-CG 3.27Å; F162-K166 PolarHBondContact O-N 2.92Å; I163-K166 PolarHBondContact O-N 2.89Å; E164-K166 VanDerWaalsContact C-N 3.3Å; E164-K166 PolarHBondContact O-N 3.29Å; K166-A169 PolarHBondContact O-N 3.41Å; K166-E170 WeakPolarHBondContact O-CB 3.41Å; K166-E170 PolarHBondContact O-N 3.49Å
167	R	74.5	Confident	72	Confident	186 Å²	186	96.3 Å²	96.3	70%	0.702	48%	0.482	S	S	*	.	H	α-helix	trans	-62.1	-46.8	175.9	-73.8	179	179.6	178.9	1.2	110.9	I163 E164 A169 E170 A171	I163-R167 WeakPolarHBondContact O-CG 3.4Å; I163-R167 PolarHBondContact O-N 2.95Å; E164-R167 PolarHBondContact O-N 2.95Å; R167-A169 PolarHBondContact O-N 3.37Å; R167-E170 PolarHBondContact O-N 2.82Å; R167-A171 WeakPolarHBondContact O-CB 3.34Å; R167-A171 PolarHBondContact O-N 3.47Å
168	A	76	Confident	73.6	Confident	61 Å²	61	94 Å²	94	50%	0.504	46%	0.464	S	S	.	.	H	α-helix	trans	-61.9	-40.6	175.7	0	0	0	0	0	112	E164 Y172	E164-A168 VanDerWaalsContact O-CB 3.26Å; E164-A168 WeakPolarHBondContact O-CB 3.42Å; E164-A168 PolarHBondContact O-N 2.97Å; A168-Y172 VanDerWaalsContact O-CB 3.25Å; A168-Y172 WeakPolarHBondContact O-CB 3.49Å; A168-Y172 PolarHBondContact O-N 3.23Å
169	A	77.7	Confident	75.3	Confident	42 Å²	42	91 Å²	91	35%	0.347	44%	0.442	S	S	.	.	H	α-helix	trans	-65.2	-40.3	175.6	0	0	0	0	0	112.6	R165 K166 R167 R173	R165-A169 WeakPolarHBondContact O-CB 3.45Å; R165-A169 PolarHBondContact O-N 3.49Å; K166-A169 PolarHBondContact O-N 3.41Å; R167-A169 PolarHBondContact O-N 3.37Å; A169-R173 WeakPolarHBondContact O-CB 3.47Å; A169-R173 VanDerWaalsContact O-CG 3.23Å; A169-R173 WeakPolarHBondContact O-CG 3.34Å; A169-R173 PolarHBondContact O-N 2.78Å
170	E	76.7	Confident	77.1	Confident	102 Å²	102	95.4 Å²	95.4	48%	0.477	45%	0.454	S	S	.	.	H	α-helix	trans	-71.6	-38.8	177.9	-163.1	63.8	-163.3	0	0	112	K166 R167 R173 T174	K166-E170 WeakPolarHBondContact O-CB 3.41Å; K166-E170 PolarHBondContact O-N 3.49Å; R167-E170 PolarHBondContact O-N 2.82Å; E170-R173 PolarHBondContact O-N 3.41Å; E170-R173 IonicContact OE2-NH1 3.64Å; E170-R173 PolarHBondContact OE2-NH1 3.15Å; E170-R173 VanDerWaalsContact OE2-NH1 3.1Å; E170-T174 PolarHBondContact O-N 2.9Å; E170-T174 PolarHBondContact O-OG1 2.95Å
171	A	79.3	Confident	78.8	Confident	52 Å²	52	94.9 Å²	94.9	43%	0.43	45%	0.447	S	S	.	.	H	α-helix	trans	-61.4	-46.3	171.5	0	0	0	0	0	111.2	R167 R173 T174 L175	R167-A171 WeakPolarHBondContact O-CB 3.34Å; R167-A171 PolarHBondContact O-N 3.47Å; A171-R173 PolarHBondContact O-N 3.07Å; A171-T174 PolarHBondContact O-N 3.02Å; A171-L175 WeakPolarHBondContact O-CB 3.17Å; A171-L175 WeakPolarHBondContact O-CG 3.35Å; A171-L175 PolarHBondContact O-N 3.44Å
172	Y	85.3	Confident	80.2	Confident	72 Å²	72	91.5 Å²	91.5	28%	0.282	43%	0.429	S	S	.	.	H	α-helix	trans	-61.4	-40.6	176	-176	-87.5	0	0	0	112.3	A168 T176 L231 A233 I236	A168-Y172 VanDerWaalsContact O-CB 3.25Å; A168-Y172 WeakPolarHBondContact O-CB 3.49Å; A168-Y172 PolarHBondContact O-N 3.23Å; Y172-T176 WeakPolarHBondContact CE1-OG1 3.44Å; Y172-T176 WeakPolarHBondContact O-CB 3.44Å; Y172-T176 PolarHBondContact O-N 2.94Å; Y172-T176 PolarHBondContact O-OG1 3.06Å; Y172-L231 VanDerWaalsContact CE2-O 3.31Å; Y172-L231 WeakPolarHBondContact CE2-O 3.13Å; Y172-L231 PolarHBondContact OH-O 3.31Å; Y172-A233 HydrophobicContact CD2-CB 4.48Å; Y172-I236 HydrophobicContact CD2-CD1 4.31Å; Y172-I236 HydrophobicContact CE2-CD1 3.7Å
173	R	83.1	Confident	81.4	Confident	162 Å²	162	88.2 Å²	88.2	61%	0.611	41%	0.413	S	S	*	.	H	α-helix	trans	-61.8	-45	174.3	-77.5	168.7	179.9	-179.9	-2.1	111.9	A169 E170 A171 T176 K177	A169-R173 WeakPolarHBondContact O-CB 3.47Å; A169-R173 VanDerWaalsContact O-CG 3.23Å; A169-R173 WeakPolarHBondContact O-CG 3.34Å; A169-R173 PolarHBondContact O-N 2.78Å; E170-R173 PolarHBondContact O-N 3.41Å; E170-R173 IonicContact OE2-NH1 3.64Å; E170-R173 PolarHBondContact OE2-NH1 3.15Å; E170-R173 VanDerWaalsContact OE2-NH1 3.1Å; A171-R173 PolarHBondContact O-N 3.07Å; R173-T176 PolarHBondContact O-N 2.85Å; R173-K177 WeakPolarHBondContact O-CB 3.34Å; R173-K177 PolarHBondContact O-N 2.83Å
174	T	82.7	Confident	82.4	Confident	67 Å²	67	88.6 Å²	88.6	41%	0.411	41%	0.411	S	S	.	.	H	α-helix	trans	-63.7	-48.7	178.6	-55.5	0	0	0	0	110.6	E170 A171 T176 K177 D178	E170-T174 PolarHBondContact O-N 2.9Å; E170-T174 PolarHBondContact O-OG1 2.95Å; A171-T174 PolarHBondContact O-N 3.02Å; T174-T176 VanDerWaalsContact C-N 3.34Å; T174-T176 PolarHBondContact O-N 3.15Å; T174-K177 WeakPolarHBondContact O-CB 3.36Å; T174-K177 PolarHBondContact O-N 3.37Å; T174-K177 VanDerWaalsContact O-N 3.15Å; T174-D178 PolarHBondContact O-N 2.89Å
175	L	86.9	Confident	83.3	Confident	38 Å²	38	82.8 Å²	82.8	20%	0.199	39%	0.386	C	S	.	.	H	α-helix	trans	-57.6	-43.9	175.5	-76.6	173.3	0	0	0	112.5	A171 K177 D178 L179 A233 I236	A171-L175 WeakPolarHBondContact O-CB 3.17Å; A171-L175 WeakPolarHBondContact O-CG 3.35Å; A171-L175 PolarHBondContact O-N 3.44Å; L175-K177 PolarHBondContact O-N 3.36Å; L175-D178 PolarHBondContact O-N 3.1Å; L175-L179 WeakPolarHBondContact O-CB 3.45Å; L175-L179 PolarHBondContact O-N 3.33Å; L175-A233 HydrophobicContact CD1-CB 4.23Å; L175-I236 HydrophobicContact CB-CG2 3.83Å
176	T	86.2	Confident	84.1	Confident	58 Å²	58	74.6 Å²	74.6	36%	0.356	36%	0.355	S	S	.	.	H	α-helix	trans	-65.8	-38.6	178.1	-55.1	0	0	0	0	111.6	Y172 R173 T174 R180	Y172-T176 WeakPolarHBondContact CE1-OG1 3.44Å; Y172-T176 WeakPolarHBondContact O-CB 3.44Å; Y172-T176 PolarHBondContact O-N 2.94Å; Y172-T176 PolarHBondContact O-OG1 3.06Å; R173-T176 PolarHBondContact O-N 2.85Å; T174-T176 VanDerWaalsContact C-N 3.34Å; T174-T176 PolarHBondContact O-N 3.15Å; T176-R180 WeakPolarHBondContact O-CB 3.27Å; T176-R180 PolarHBondContact O-N 3.27Å
177	K	85.7	Confident	84.9	Confident	134 Å²	134	72.2 Å²	72.2	58%	0.583	34%	0.343	S	S	*	.	H	α-helix	trans	-64.8	-46.9	175.7	-175.9	-171.7	174.1	-172.3	0	111	R173 T174 L175 R180 M181	R173-K177 WeakPolarHBondContact O-CB 3.34Å; R173-K177 PolarHBondContact O-N 2.83Å; T174-K177 WeakPolarHBondContact O-CB 3.36Å; T174-K177 PolarHBondContact O-N 3.37Å; T174-K177 VanDerWaalsContact O-N 3.15Å; L175-K177 PolarHBondContact O-N 3.36Å; K177-R180 WeakPolarHBondContact O-CB 3.24Å; K177-R180 PolarHBondContact O-N 2.92Å; K177-R180 VanDerWaalsContact O-N 3.16Å; K177-M181 HydrophobicContact CG-CE 4.26Å; K177-M181 WeakPolarHBondContact O-CG 3.44Å; K177-M181 PolarHBondContact O-N 3.39Å
178	D	87.3	Confident	85.4	Confident	28 Å²	28	65 Å²	65	15%	0.15	32%	0.319	C	S	.	.	H	α-helix	trans	-62.9	-42.5	178.7	-71.7	-7.2	0	0	0	111.2	T174 L175 R180 M181 A182 L240	T174-D178 PolarHBondContact O-N 2.89Å; L175-D178 PolarHBondContact O-N 3.1Å; D178-R180 VanDerWaalsContact C-N 3.32Å; D178-R180 PolarHBondContact O-N 2.93Å; D178-M181 PolarHBondContact O-N 3Å; D178-M181 WeakPolarHBondContact OD1-CE 3.5Å; D178-A182 VanDerWaalsContact O-CB 3.27Å; D178-A182 WeakPolarHBondContact O-CB 3.5Å; D178-A182 PolarHBondContact O-N 2.96Å; D178-L240 HydrophobicContact CB-CD1 4.27Å; D178-L240 HydrophobicContact CB-CD2 3.96Å
179	L	90.1	Very high	86	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.021	30%	0.298	C	S	.	.	H	α-helix	trans	-61	-40.7	173.3	-178.4	64.6	0	0	0	112	L175 A182 R183 I236 L239 L240 L243	L175-L179 WeakPolarHBondContact O-CB 3.45Å; L175-L179 PolarHBondContact O-N 3.33Å; L179-A182 PolarHBondContact O-N 2.86Å; L179-R183 HydrophobicContact CD1-CG 4.27Å; L179-R183 HydrophobicContact CG-CG 4.49Å; L179-R183 WeakPolarHBondContact O-CB 3.35Å; L179-R183 VanDerWaalsContact O-CG 3.29Å; L179-R183 WeakPolarHBondContact O-CG 3.26Å; L179-R183 PolarHBondContact O-N 2.87Å; L179-I236 HydrophobicContact CB-CG2 4.11Å; L179-I236 HydrophobicContact CD2-CG1 4.33Å; L179-I236 HydrophobicContact CD2-CG2 4.05Å; L179-L239 HydrophobicContact CD1-CB 4.48Å; L179-L239 HydrophobicContact CD1-CD2 3.79Å; L179-L239 HydrophobicContact CD1-CG 3.92Å; L179-L239 HydrophobicContact CD2-CD2 4.12Å; L179-L240 HydrophobicContact CB-CD1 4.43Å; L179-L243 HydrophobicContact CD1-CD2 4.21Å
180	R	87.5	Confident	86.6	Confident	201 Å²	201	60.9 Å²	60.9	76%	0.758	28%	0.282	S	S	*	.	H	α-helix	trans	-64.3	-44	176.5	-173.8	178.9	-177	155.1	2.3	111.8	T176 K177 D178 K184	T176-R180 WeakPolarHBondContact O-CB 3.27Å; T176-R180 PolarHBondContact O-N 3.27Å; K177-R180 WeakPolarHBondContact O-CB 3.24Å; K177-R180 PolarHBondContact O-N 2.92Å; K177-R180 VanDerWaalsContact O-N 3.16Å; D178-R180 VanDerWaalsContact C-N 3.32Å; D178-R180 PolarHBondContact O-N 2.93Å; R180-K184 WeakPolarHBondContact O-CB 3.46Å; R180-K184 PolarHBondContact O-N 3.09Å; R180-K184 VanDerWaalsContact O-N 3.09Å
181	M	87	Confident	87	Confident	79 Å²	79	58.6 Å²	58.6	39%	0.389	28%	0.277	S	S	.	.	H	α-helix	trans	-64.6	-44.5	177	-68.5	-172.7	-57.9	0	0	111	K177 D178 K184 A185 L255	K177-M181 HydrophobicContact CG-CE 4.26Å; K177-M181 WeakPolarHBondContact O-CG 3.44Å; K177-M181 PolarHBondContact O-N 3.39Å; D178-M181 PolarHBondContact O-N 3Å; D178-M181 WeakPolarHBondContact OD1-CE 3.5Å; M181-K184 PolarHBondContact O-N 3.49Å; M181-A185 WeakPolarHBondContact O-CB 3.45Å; M181-A185 PolarHBondContact O-N 3.41Å; M181-L255 HydrophobicContact CB-CD1 4.16Å
182	A	90	Very high	87.3	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-44.5	178.6	0	0	0	0	0	112.2	D178 L179 K184 A185 C186 L240 L243 L255	D178-A182 VanDerWaalsContact O-CB 3.27Å; D178-A182 WeakPolarHBondContact O-CB 3.5Å; D178-A182 PolarHBondContact O-N 2.96Å; L179-A182 PolarHBondContact O-N 2.86Å; A182-K184 VanDerWaalsContact C-N 3.33Å; A182-K184 PolarHBondContact O-N 2.65Å; A182-A185 PolarHBondContact O-N 3.03Å; A182-C186 WeakPolarHBondContact O-CB 3.32Å; A182-C186 PolarHBondContact O-N 3.48Å; A182-L240 HydrophobicContact CB-CD1 3.75Å; A182-L243 HydrophobicContact CB-CD2 3.37Å; A182-L243 HydrophobicContact CB-CG 4Å; A182-L255 HydrophobicContact CB-CD1 4.13Å; A182-L255 HydrophobicContact CB-CD2 3.67Å
183	R	91.2	Very high	87.4	Confident	44 Å²	44	60.6 Å²	60.6	17%	0.166	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-41.2	177.6	-76.4	178.9	165.1	150.8	-3.8	111.7	L179 C186 Y187 S202 F203 P205 L243	L179-R183 HydrophobicContact CD1-CG 4.27Å; L179-R183 HydrophobicContact CG-CG 4.49Å; L179-R183 WeakPolarHBondContact O-CB 3.35Å; L179-R183 VanDerWaalsContact O-CG 3.29Å; L179-R183 WeakPolarHBondContact O-CG 3.26Å; L179-R183 PolarHBondContact O-N 2.87Å; R183-C186 PolarHBondContact O-N 3.41Å; R183-Y187 WeakPolarHBondContact O-CB 3.48Å; R183-Y187 PolarHBondContact O-N 3.49Å; R183-S202 PolarHBondContact NE-O 2.98Å; R183-S202 PolarHBondContact NH2-O 3.43Å; R183-F203 VanDerWaalsContact CA-O 3.27Å; R183-F203 WeakPolarHBondContact CA-O 3.14Å; R183-F203 WeakPolarHBondContact CB-O 3.21Å; R183-F203 WeakPolarHBondContact CG-O 3.11Å; R183-P205 HydrophobicContact CB-CG 4.25Å; R183-L243 HydrophobicContact CG-CD2 3.89Å
184	K	88.1	Confident	87.5	Confident	97 Å²	97	55.6 Å²	55.6	42%	0.422	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-47.6	176.4	-175.2	176.7	178.3	176.4	0	111.2	R180 M181 A182 C186 Y187 D188	R180-K184 WeakPolarHBondContact O-CB 3.46Å; R180-K184 PolarHBondContact O-N 3.09Å; R180-K184 VanDerWaalsContact O-N 3.09Å; M181-K184 PolarHBondContact O-N 3.49Å; A182-K184 VanDerWaalsContact C-N 3.33Å; A182-K184 PolarHBondContact O-N 2.65Å; K184-C186 VanDerWaalsContact C-N 3.3Å; K184-C186 PolarHBondContact O-N 3.46Å; K184-Y187 PolarHBondContact O-N 2.69Å; K184-D188 WeakPolarHBondContact O-CB 3.31Å; K184-D188 VanDerWaalsContact O-CG 3.26Å; K184-D188 PolarHBondContact O-N 3.03Å
185	A	87.6	Confident	87.6	Confident	11 Å²	11	54.5 Å²	54.5	9%	0.091	29%	0.29	C	S	.	.	H	α-helix	trans	-59.6	-42	176	0	0	0	0	0	111.4	M181 A182 D188 L189 Y253 L255	M181-A185 WeakPolarHBondContact O-CB 3.45Å; M181-A185 PolarHBondContact O-N 3.41Å; A182-A185 PolarHBondContact O-N 3.03Å; A185-D188 PolarHBondContact O-N 3.06Å; A185-L189 VanDerWaalsContact O-CB 3.32Å; A185-L189 WeakPolarHBondContact O-CB 3.5Å; A185-L189 WeakPolarHBondContact O-CG 3.19Å; A185-L189 PolarHBondContact O-N 2.8Å; A185-Y253 HydrophobicContact CB-CD1 4.48Å; A185-Y253 HydrophobicContact CB-CE1 3.7Å; A185-L255 HydrophobicContact CB-CD1 4.29Å
186	C	90.1	Very high	87.2	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-59.9	-50.1	174.9	-165.5	0	0	0	0	111.8	A182 R183 K184 L189 D190 L243 Y246 L247	A182-C186 WeakPolarHBondContact O-CB 3.32Å; A182-C186 PolarHBondContact O-N 3.48Å; R183-C186 PolarHBondContact O-N 3.41Å; K184-C186 VanDerWaalsContact C-N 3.3Å; K184-C186 PolarHBondContact O-N 3.46Å; C186-L189 PolarHBondContact O-N 2.59Å; C186-D190 WeakPolarHBondContact O-CB 3.47Å; C186-D190 PolarHBondContact O-N 2.95Å; C186-D190 PolarHBondContact SG-OD2 2.99Å; C186-L243 HydrophobicContact CB-CD1 3.75Å; C186-Y246 VanDerWaalsContact SG-CE1 3.52Å; C186-L247 HydrophobicContact CB-CD2 4.15Å
187	Y	89.8	Confident	87.1	Confident	78 Å²	78	63.6 Å²	63.6	31%	0.306	34%	0.335	S	S	.	.	H	α-helix	trans	-59	-49	177	176	-100.7	0	0	0	112.3	R183 K184 L189 D190 C191 W204 A208	R183-Y187 WeakPolarHBondContact O-CB 3.48Å; R183-Y187 PolarHBondContact O-N 3.49Å; K184-Y187 PolarHBondContact O-N 2.69Å; Y187-L189 VanDerWaalsContact C-N 3.34Å; Y187-L189 PolarHBondContact O-N 3.2Å; Y187-D190 PolarHBondContact O-N 3.33Å; Y187-C191 WeakPolarHBondContact CE2-SG 3.33Å; Y187-C191 VanDerWaalsContact O-CB 3.24Å; Y187-C191 WeakPolarHBondContact O-CB 3.46Å; Y187-C191 PolarHBondContact O-N 2.95Å; Y187-C191 PolarHBondContact O-SG 2.94Å; Y187-W204 AromaticContact CD2-CD2 3.61Å; Y187-W204 HydrophobicContact CD2-CD2 3.61Å; Y187-W204 AromaticContact CD2-CE2 3.95Å; Y187-W204 AromaticContact CD2-CE3 3.62Å; Y187-W204 HydrophobicContact CD2-CE3 3.62Å; Y187-W204 HydrophobicContact CD2-CG 4.07Å; Y187-W204 HydrophobicContact CD2-CH2 4.3Å; Y187-W204 HydrophobicContact CD2-CZ2 4.3Å; Y187-W204 AromaticContact CD2-CZ3 3.97Å; Y187-W204 HydrophobicContact CD2-CZ3 3.97Å; Y187-W204 HydrophobicContact CE2-CD2 4.3Å; Y187-W204 AromaticContact CE2-CE3 3.84Å; Y187-W204 HydrophobicContact CE2-CE3 3.84Å; Y187-W204 HydrophobicContact CE2-CH2 4.28Å; Y187-W204 AromaticContact CE2-CZ3 3.82Å; Y187-W204 HydrophobicContact CE2-CZ3 3.82Å; Y187-A208 HydrophobicContact CD2-CB 3.74Å; Y187-A208 HydrophobicContact CE2-CB 3.46Å; Y187-A208 VanDerWaalsContact CE2-CB 3.46Å; Y187-A208 HydrophobicContact CG-CB 4.48Å
188	D	86	Confident	87.1	Confident	35 Å²	35	58.3 Å²	58.3	19%	0.187	31%	0.314	C	S	.	.	H	α-helix	trans	-62.1	-42.2	-178.9	-67.8	-13.2	0	0	0	110.9	P36 K184 A185 T192	P36-D188 HydrophobicContact CB-CB 4.13Å; P36-D188 WeakPolarHBondContact CB-OD2 3.12Å; K184-D188 WeakPolarHBondContact O-CB 3.31Å; K184-D188 VanDerWaalsContact O-CG 3.26Å; K184-D188 PolarHBondContact O-N 3.03Å; A185-D188 PolarHBondContact O-N 3.06Å; D188-T192 VanDerWaalsContact O-CB 3.3Å; D188-T192 WeakPolarHBondContact O-CB 3.19Å; D188-T192 PolarHBondContact O-N 2.71Å; D188-T192 PolarHBondContact O-OG1 3.04Å
189	L	88.3	Confident	87	Confident	15 Å²	15	61.7 Å²	61.7	8%	0.079	34%	0.335	C	S	.	.	H	α-helix	trans	-73.3	-38.7	178.4	-65.2	-175.7	0	0	0	113.3	A185 C186 Y187 T192 A193 L247 Y251 Y253 R260	A185-L189 VanDerWaalsContact O-CB 3.32Å; A185-L189 WeakPolarHBondContact O-CB 3.5Å; A185-L189 WeakPolarHBondContact O-CG 3.19Å; A185-L189 PolarHBondContact O-N 2.8Å; C186-L189 PolarHBondContact O-N 2.59Å; Y187-L189 VanDerWaalsContact C-N 3.34Å; Y187-L189 PolarHBondContact O-N 3.2Å; L189-T192 PolarHBondContact O-N 3.35Å; L189-A193 WeakPolarHBondContact O-CB 3.36Å; L189-A193 PolarHBondContact O-N 3.4Å; L189-L247 HydrophobicContact CD1-CD2 3.94Å; L189-Y251 HydrophobicContact CB-CD1 4.42Å; L189-Y251 HydrophobicContact CB-CD2 3.85Å; L189-Y251 HydrophobicContact CB-CE1 4.48Å; L189-Y251 HydrophobicContact CB-CE2 3.92Å; L189-Y251 HydrophobicContact CB-CG 4.11Å; L189-Y251 HydrophobicContact CD1-CD2 3.97Å; L189-Y251 HydrophobicContact CD1-CG 3.98Å; L189-Y253 HydrophobicContact CD1-CD1 4.02Å; L189-Y253 HydrophobicContact CD1-CD2 3.99Å; L189-Y253 HydrophobicContact CD1-CG 3.67Å; L189-R260 VanDerWaalsContact CD2-NH2 3.3Å
190	D	90.6	Very high	86.8	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-64.5	-47.3	174.9	-76.5	-24.6	0	0	0	110.9	C186 Y187 T192 A193 G194 V195 W204 Y246 Y251	C186-D190 WeakPolarHBondContact O-CB 3.47Å; C186-D190 PolarHBondContact O-N 2.95Å; C186-D190 PolarHBondContact SG-OD2 2.99Å; Y187-D190 PolarHBondContact O-N 3.33Å; D190-T192 VanDerWaalsContact C-N 3.35Å; D190-T192 PolarHBondContact O-N 3.45Å; D190-A193 CarbonylContact O-C 3.45Å; D190-A193 WeakPolarHBondContact O-CA 2.91Å; D190-A193 PolarHBondContact O-N 3.27Å; D190-A193 VanDerWaalsContact O-N 3.1Å; D190-G194 PolarHBondContact O-N 3.28Å; D190-G194 VanDerWaalsContact O-N 3.12Å; D190-V195 HydrophobicContact CB-CB 3.95Å; D190-V195 HydrophobicContact CB-CG1 4.31Å; D190-V195 WeakPolarHBondContact O-CB 3.41Å; D190-V195 PolarHBondContact O-N 3.42Å; D190-W204 HydrophobicContact CB-CZ2 3.77Å; D190-W204 PolarHBondContact OD2-NE1 3.43Å; D190-Y246 WeakPolarHBondContact OD1-CE1 3.17Å; D190-Y246 PolarHBondContact OD1-OH 3.2Å; D190-Y251 WeakPolarHBondContact CA-OH 3.07Å; D190-Y251 WeakPolarHBondContact OD1-CE2 3.27Å; D190-Y251 VanDerWaalsContact OD1-CZ 3.27Å; D190-Y251 PolarHBondContact OD1-OH 3.34Å
191	C	85.5	Confident	86.7	Confident	54 Å²	54	61 Å²	61	37%	0.365	35%	0.349	S	S	.	.	H	α-helix	trans	-62.6	-40.8	176.2	-73.7	0	0	0	0	112	Y187 A193 G194	Y187-C191 WeakPolarHBondContact CE2-SG 3.33Å; Y187-C191 VanDerWaalsContact O-CB 3.24Å; Y187-C191 WeakPolarHBondContact O-CB 3.46Å; Y187-C191 PolarHBondContact O-N 2.95Å; Y187-C191 PolarHBondContact O-SG 2.94Å; C191-A193 PolarHBondContact O-N 3.11Å; C191-G194 PolarHBondContact O-N 3.38Å; C191-G194 VanDerWaalsContact O-N 3.11Å
192	T	85.4	Confident	86.6	Confident	108 Å²	108	58.9 Å²	58.9	66%	0.663	34%	0.342	S	S	*	.	H	α-helix	trans	-65.1	-30.6	175.5	-56.5	0	0	0	0	111.6	D188 L189 D190 G194	D188-T192 VanDerWaalsContact O-CB 3.3Å; D188-T192 WeakPolarHBondContact O-CB 3.19Å; D188-T192 PolarHBondContact O-N 2.71Å; D188-T192 PolarHBondContact O-OG1 3.04Å; L189-T192 PolarHBondContact O-N 3.35Å; D190-T192 VanDerWaalsContact C-N 3.35Å; D190-T192 PolarHBondContact O-N 3.45Å; T192-G194 VanDerWaalsContact C-N 3.31Å
193	A	86.2	Confident	86.6	Confident	59 Å²	59	59.1 Å²	59.1	49%	0.488	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	2.1	175.1	0	0	0	0	0	114	L189 D190 C191 V195 Y251	L189-A193 WeakPolarHBondContact O-CB 3.36Å; L189-A193 PolarHBondContact O-N 3.4Å; D190-A193 CarbonylContact O-C 3.45Å; D190-A193 WeakPolarHBondContact O-CA 2.91Å; D190-A193 PolarHBondContact O-N 3.27Å; D190-A193 VanDerWaalsContact O-N 3.1Å; C191-A193 PolarHBondContact O-N 3.11Å; A193-V195 HydrophobicContact CB-CG2 4.39Å; A193-Y251 HydrophobicContact CB-CE1 3.82Å
194	G	84.9	Confident	86.6	Confident	57 Å²	57	57.7 Å²	57.7	59%	0.588	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	14.2	179.5	0	0	0	0	0	115	D190 C191 T192 Q196	D190-G194 PolarHBondContact O-N 3.28Å; D190-G194 VanDerWaalsContact O-N 3.12Å; C191-G194 PolarHBondContact O-N 3.38Å; C191-G194 VanDerWaalsContact O-N 3.11Å; T192-G194 VanDerWaalsContact C-N 3.31Å; G194-Q196 PolarHBondContact O-N 2.81Å
195	V	85.8	Confident	86.5	Confident	44 Å²	44	55.1 Å²	55.1	27%	0.267	33%	0.331	S	S	.	.			trans	-76.8	113.8	177.5	178	0	0	0	0	109.2	D190 A193 T197 W204	D190-V195 HydrophobicContact CB-CB 3.95Å; D190-V195 HydrophobicContact CB-CG1 4.31Å; D190-V195 WeakPolarHBondContact O-CB 3.41Å; D190-V195 PolarHBondContact O-N 3.42Å; A193-V195 HydrophobicContact CB-CG2 4.39Å; V195-T197 WeakPolarHBondContact CG1-O 3.3Å; V195-W204 HydrophobicContact CG1-CZ2 4.47Å; V195-W204 WeakPolarHBondContact O-CH2 3.47Å
196	Q	78.8	Confident	86	Confident	178 Å²	178	61.4 Å²	61.4	83%	0.832	36%	0.356	S	S	*	.			trans	-85.7	-22	-177.7	-63.4	-174.9	2.6	0	0	113.7	G194	G194-Q196 PolarHBondContact O-N 2.81Å
197	T	83.4	Confident	85.2	Confident	109 Å²	109	64.3 Å²	64.3	67%	0.669	39%	0.386	S	S	*	.	S	Bend	trans	-131.4	132.1	-179	55	0	0	0	0	110.2	V195	V195-T197 WeakPolarHBondContact CG1-O 3.3Å
198	P	85.6	Confident	84.5	Confident	22 Å²	22	62.2 Å²	62.2	14%	0.143	38%	0.384	C	S	.	.			trans	-67.1	144.4	-178.8	25.1	-32.3	0	0	0	112.7	M200 W204 L209	P198-M200 WeakPolarHBondContact CB-O 3.39Å; P198-M200 PolarHBondContact O-N 3.07Å; P198-W204 HydrophobicContact CB-CB 4.31Å; P198-W204 HydrophobicContact CB-CD2 3.71Å; P198-W204 HydrophobicContact CB-CE3 4.46Å; P198-W204 HydrophobicContact CB-CG 3.62Å; P198-W204 HydrophobicContact CB-CZ2 4.5Å; P198-W204 HydrophobicContact CG-CB 4.36Å; P198-W204 HydrophobicContact CG-CD2 3.89Å; P198-W204 HydrophobicContact CG-CE3 4.18Å; P198-W204 HydrophobicContact CG-CG 3.99Å; P198-L209 HydrophobicContact CG-CD2 3.92Å
199	V	86	Confident	83.6	Confident	100 Å²	100	64.1 Å²	64.1	61%	0.606	39%	0.394	S	S	*	.	S	Bend	trans	-57.5	-39.6	173.6	177	0	0	0	0	111.7	Y246	V199-Y246 HydrophobicContact CB-CE2 4.29Å; V199-Y246 HydrophobicContact CG2-CE2 3.72Å
200	M	85.9	Confident	82.1	Confident	86 Å²	86	70.3 Å²	70.3	42%	0.424	42%	0.421	S	S	.	.	S	Bend	trans	-128.7	128	168.7	-69.5	-177.4	65.5	0	0	108.4	P198 S202 F203	P198-M200 WeakPolarHBondContact CB-O 3.39Å; P198-M200 PolarHBondContact O-N 3.07Å; M200-S202 PolarHBondContact O-N 2.72Å; M200-F203 HydrophobicContact CB-CD1 3.74Å; M200-F203 HydrophobicContact CB-CD2 4.12Å; M200-F203 HydrophobicContact CB-CE1 3.91Å; M200-F203 HydrophobicContact CB-CE2 4.26Å; M200-F203 HydrophobicContact CB-CG 3.86Å; M200-F203 HydrophobicContact CB-CZ 4.18Å; M200-F203 HydrophobicContact CE-CE1 4.31Å; M200-F203 HydrophobicContact CG-CE1 4.22Å; M200-F203 HydrophobicContact CG-CE2 4.33Å; M200-F203 HydrophobicContact CG-CZ 4.12Å; M200-F203 VanDerWaalsContact O-CB 3.27Å; M200-F203 WeakPolarHBondContact O-CB 3.15Å; M200-F203 PolarHBondContact O-N 3.26Å; M200-F203 HydrophobicContact SD-CD1 4.38Å; M200-F203 HydrophobicContact SD-CE1 3.58Å; M200-F203 VanDerWaalsContact SD-CE1 3.58Å; M200-F203 HydrophobicContact SD-CE2 4.24Å; M200-F203 HydrophobicContact SD-CZ 3.5Å; M200-F203 WeakPolarHBondContact SD-CZ 3.4Å
201	T	84.8	Confident	80	Confident	105 Å²	105	74.6 Å²	74.6	64%	0.644	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-54.6	-25.8	179.8	55.2	0	0	0	0	113.1	F203 L209	T201-F203 VanDerWaalsContact C-N 3.31Å; T201-F203 PolarHBondContact O-N 2.97Å; T201-L209 WeakPolarHBondContact O-CD1 3.09Å
202	S	85.4	Confident	77.8	Confident	33 Å²	33	76.2 Å²	76.2	23%	0.231	47%	0.468	C	S	.	.	G	3₁₀ helix	trans	-75.3	-11.6	176.3	58.6	0	0	0	0	115	R183 M200 L239	R183-S202 PolarHBondContact NE-O 2.98Å; R183-S202 PolarHBondContact NH2-O 3.43Å; M200-S202 PolarHBondContact O-N 2.72Å; S202-L239 VanDerWaalsContact OG-CD1 3.29Å; S202-L239 WeakPolarHBondContact OG-CD1 3.21Å
203	F	90.1	Very high	75.9	Confident	5 Å²	5	78.1 Å²	78.1	2%	0.022	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-83.2	-25.6	-178.3	-73.2	7.1	0	0	0	113.1	R183 M200 T201 L239 S242 L243 Y246	R183-F203 VanDerWaalsContact CA-O 3.27Å; R183-F203 WeakPolarHBondContact CA-O 3.14Å; R183-F203 WeakPolarHBondContact CB-O 3.21Å; R183-F203 WeakPolarHBondContact CG-O 3.11Å; M200-F203 HydrophobicContact CB-CD1 3.74Å; M200-F203 HydrophobicContact CB-CD2 4.12Å; M200-F203 HydrophobicContact CB-CE1 3.91Å; M200-F203 HydrophobicContact CB-CE2 4.26Å; M200-F203 HydrophobicContact CB-CG 3.86Å; M200-F203 HydrophobicContact CB-CZ 4.18Å; M200-F203 HydrophobicContact CE-CE1 4.31Å; M200-F203 HydrophobicContact CG-CE1 4.22Å; M200-F203 HydrophobicContact CG-CE2 4.33Å; M200-F203 HydrophobicContact CG-CZ 4.12Å; M200-F203 VanDerWaalsContact O-CB 3.27Å; M200-F203 WeakPolarHBondContact O-CB 3.15Å; M200-F203 PolarHBondContact O-N 3.26Å; M200-F203 HydrophobicContact SD-CD1 4.38Å; M200-F203 HydrophobicContact SD-CE1 3.58Å; M200-F203 VanDerWaalsContact SD-CE1 3.58Å; M200-F203 HydrophobicContact SD-CE2 4.24Å; M200-F203 HydrophobicContact SD-CZ 3.5Å; M200-F203 WeakPolarHBondContact SD-CZ 3.4Å; T201-F203 VanDerWaalsContact C-N 3.31Å; T201-F203 PolarHBondContact O-N 2.97Å; F203-L239 HydrophobicContact CD1-CD1 4.13Å; F203-L239 HydrophobicContact CE1-CD1 4.04Å; F203-S242 WeakPolarHBondContact CE1-OG 3.3Å; F203-L243 HydrophobicContact CB-CD1 3.57Å; F203-L243 HydrophobicContact CD1-CB 4.35Å; F203-L243 HydrophobicContact CD1-CD1 3.67Å; F203-L243 HydrophobicContact CD2-CD1 3.71Å; F203-L243 HydrophobicContact CE1-CB 4.22Å; F203-L243 HydrophobicContact CE1-CD1 4.21Å; F203-L243 HydrophobicContact CE2-CD1 4.26Å; F203-L243 HydrophobicContact CG-CD1 3.38Å; F203-L243 HydrophobicContact CZ-CD1 4.48Å; F203-Y246 HydrophobicContact CD2-CD1 4.01Å; F203-Y246 HydrophobicContact CD2-CG 4.14Å; F203-Y246 HydrophobicContact CE2-CD1 4.07Å; F203-Y246 HydrophobicContact CE2-CD2 4.3Å; F203-Y246 AromaticContact CE2-CG 3.74Å; F203-Y246 HydrophobicContact CE2-CG 3.74Å
204	W	89.9	Confident	74	Confident	14 Å²	14	82 Å²	82	5%	0.053	48%	0.482	C	S	.	.	S	Bend	trans	-93.2	153.5	176	-75.9	15	0	0	0	111.8	Y187 D190 V195 P198 A208	Y187-W204 AromaticContact CD2-CD2 3.61Å; Y187-W204 HydrophobicContact CD2-CD2 3.61Å; Y187-W204 AromaticContact CD2-CE2 3.95Å; Y187-W204 AromaticContact CD2-CE3 3.62Å; Y187-W204 HydrophobicContact CD2-CE3 3.62Å; Y187-W204 HydrophobicContact CD2-CG 4.07Å; Y187-W204 HydrophobicContact CD2-CH2 4.3Å; Y187-W204 HydrophobicContact CD2-CZ2 4.3Å; Y187-W204 AromaticContact CD2-CZ3 3.97Å; Y187-W204 HydrophobicContact CD2-CZ3 3.97Å; Y187-W204 HydrophobicContact CE2-CD2 4.3Å; Y187-W204 AromaticContact CE2-CE3 3.84Å; Y187-W204 HydrophobicContact CE2-CE3 3.84Å; Y187-W204 HydrophobicContact CE2-CH2 4.28Å; Y187-W204 AromaticContact CE2-CZ3 3.82Å; Y187-W204 HydrophobicContact CE2-CZ3 3.82Å; D190-W204 HydrophobicContact CB-CZ2 3.77Å; D190-W204 PolarHBondContact OD2-NE1 3.43Å; V195-W204 HydrophobicContact CG1-CZ2 4.47Å; V195-W204 WeakPolarHBondContact O-CH2 3.47Å; P198-W204 HydrophobicContact CB-CB 4.31Å; P198-W204 HydrophobicContact CB-CD2 3.71Å; P198-W204 HydrophobicContact CB-CE3 4.46Å; P198-W204 HydrophobicContact CB-CG 3.62Å; P198-W204 HydrophobicContact CB-CZ2 4.5Å; P198-W204 HydrophobicContact CG-CB 4.36Å; P198-W204 HydrophobicContact CG-CD2 3.89Å; P198-W204 HydrophobicContact CG-CE3 4.18Å; P198-W204 HydrophobicContact CG-CG 3.99Å; W204-A208 HydrophobicContact CE3-CB 4.34Å
205	P	85.4	Confident	71.7	Confident	44 Å²	44	88.3 Å²	88.3	29%	0.286	50%	0.496	S	S	.	.			trans	-60.1	136	168.2	-19.8	32.3	0	0	0	110.4	R183 G207 A208	R183-P205 HydrophobicContact CB-CG 4.25Å; P205-G207 PolarHBondContact O-N 2.78Å; P205-A208 WeakPolarHBondContact O-CB 3.37Å; P205-A208 PolarHBondContact O-N 2.68Å
206	K	77.2	Confident	69.4	Low	143 Å²	143	95.2 Å²	95.2	62%	0.622	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-55.1	-31.6	-178.1	-66.7	-170.8	178.1	-173.8	0	114.2	A208 L209	K206-A208 PolarHBondContact O-N 3.31Å; K206-L209 PolarHBondContact O-N 2.68Å
207	G	75	Confident	67.3	Low	61 Å²	61	94.1 Å²	94.1	63%	0.629	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-66.7	-23.6	176.3	0	0	0	0	0	114.1	P205 L209	P205-G207 PolarHBondContact O-N 2.78Å; G207-L209 VanDerWaalsContact C-N 3.32Å
208	A	73.9	Confident	64.8	Low	33 Å²	33	94.6 Å²	94.6	27%	0.273	52%	0.523	S	S	.	.	G	3₁₀ helix	trans	-82.9	-8.8	176.3	0	0	0	0	0	113.3	Y187 W204 P205 K206	Y187-A208 HydrophobicContact CD2-CB 3.74Å; Y187-A208 HydrophobicContact CE2-CB 3.46Å; Y187-A208 VanDerWaalsContact CE2-CB 3.46Å; Y187-A208 HydrophobicContact CG-CB 4.48Å; W204-A208 HydrophobicContact CE3-CB 4.34Å; P205-A208 WeakPolarHBondContact O-CB 3.37Å; P205-A208 PolarHBondContact O-N 2.68Å; K206-A208 PolarHBondContact O-N 3.31Å
209	L	67.5	Low	62.4	Low	76 Å²	76	99.1 Å²	99.1	40%	0.398	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-91.8	-2.3	177.7	-71.2	165.9	0	0	0	113	P198 T201 K206 G207 S211	P198-L209 HydrophobicContact CG-CD2 3.92Å; T201-L209 WeakPolarHBondContact O-CD1 3.09Å; K206-L209 PolarHBondContact O-N 2.68Å; G207-L209 VanDerWaalsContact C-N 3.32Å; L209-S211 PolarHBondContact O-N 2.9Å
210	K	56.2	Low	60	Low	144 Å²	144	99 Å²	99	63%	0.626	57%	0.566	S	S	*	*			trans	-72.5	113.4	-178.8	-72.1	-164.3	167.5	-139.9	0	110.2	E214	K210-E214 IonicContact NZ-OE2 2.74Å; K210-E214 PolarHBondContact NZ-OE2 2.87Å
211	S	46.8	Very low	57.4	Low	91 Å²	91	99.7 Å²	99.7	64%	0.636	57%	0.572	S	S	*	*			trans	-66.8	155.9	165.6	47.8	0	0	0	0	110.8	L209 D213	L209-S211 PolarHBondContact O-N 2.9Å; S211-D213 PolarHBondContact O-N 2.85Å
212	A	40.2	Very low	55	Low	89 Å²	89	102.8 Å²	102.8	74%	0.736	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	13.2	-165.6	0	0	0	0	0	118
213	D	44.7	Very low	52.8	Low	148 Å²	148	109.9 Å²	109.9	79%	0.791	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.7	8.1	-166.2	-60.3	-34.2	0	0	0	115.3	S211	S211-D213 PolarHBondContact O-N 2.85Å
214	E	46.7	Very low	49.8	Very low	140 Å²	140	115.5 Å²	115.5	65%	0.654	64%	0.644	S	S	*	*			trans	-118.2	22.5	-175.9	-70.1	-166.3	165.6	0	0	115.8	K210 E216	K210-E214 IonicContact NZ-OE2 2.74Å; K210-E214 PolarHBondContact NZ-OE2 2.87Å; E214-E216 PolarHBondContact O-N 3.05Å
215	E	36.2	Very low	47.1	Very low	189 Å²	189	121.9 Å²	121.9	88%	0.883	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-0.4	-165.8	-90.4	-172.1	168.4	0	0	118.8
216	E	37	Very low	44.5	Very low	190 Å²	190	125.1 Å²	125.1	89%	0.888	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.7	9.1	-165.1	-100.3	-171.4	175.1	0	0	119.9	E214	E214-E216 PolarHBondContact O-N 3.05Å
217	L	36	Very low	42.5	Very low	154 Å²	154	125.5 Å²	125.5	81%	0.806	71%	0.711	S	S	*	*	S	Bend	trans	-134.1	114.9	179.3	-79	154	0	0	0	113.7
218	N	30.5	Very low	40.8	Very low	120 Å²	120	128.6 Å²	128.6	64%	0.642	71%	0.709	S	S	*	*			trans	100.4	76	154.6	-50	-32.6	0	0	0	117.7	S220	N218-S220 PolarHBondContact O-N 2.69Å
219	A	34.3	Very low	39.8	Very low	117 Å²	117	131.6 Å²	131.6	97%	0.967	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	32.2	166.9	0	0	0	0	0	114.6
220	S	36.7	Very low	39.6	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.2	1.2	-175.2	60.4	0	0	0	0	117.6	N218	N218-S220 PolarHBondContact O-N 2.69Å
221	D	30.8	Very low	40.7	Very low	101 Å²	101	132.7 Å²	132.7	54%	0.54	74%	0.739	S	S	.	*			trans	-121.2	63.5	-171.4	-82.9	-13	0	0	0	114.3	Q223	D221-Q223 PolarHBondContact O-N 2.63Å; D221-Q223 VanDerWaalsContact O-N 3.15Å
222	D	34.8	Very low	42.5	Very low	170 Å²	170	130.7 Å²	130.7	91%	0.909	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	20	173	-152.9	15.7	0	0	0	113.2
223	Q	38.2	Very low	44.5	Very low	182 Å²	182	128.6 Å²	128.6	85%	0.85	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.1	4.6	-176.7	-65.2	-171.8	7.6	0	0	115	D221	D221-Q223 PolarHBondContact O-N 2.63Å; D221-Q223 VanDerWaalsContact O-N 3.15Å
224	N	29	Very low	46.4	Very low	122 Å²	122	129.2 Å²	129.2	65%	0.652	71%	0.705	S	S	*	*			trans	-123.1	27.4	-171	-110.4	-13.4	0	0	0	117.1	T226	N224-T226 PolarHBondContact O-N 2.72Å
225	L	32.9	Very low	48.4	Very low	149 Å²	149	127.3 Å²	127.3	78%	0.78	70%	0.696	S	S	*	*			trans	-78.4	58.3	170	-109.3	100.3	0	0	0	112.4
226	T	30.1	Very low	50.8	Low	112 Å²	112	118.5 Å²	118.5	69%	0.687	66%	0.655	S	S	*	*			trans	-127	47.7	-177.1	-33.3	0	0	0	0	113	N224	N224-T226 PolarHBondContact O-N 2.72Å
227	V	34.6	Very low	53.2	Low	150 Å²	150	111.7 Å²	111.7	91%	0.909	63%	0.627	S	S	*	*			trans	-145.4	57.6	158.5	-163.1	0	0	0	0	109.5
228	Q	40.8	Very low	55.8	Low	126 Å²	126	108.2 Å²	108.2	59%	0.589	62%	0.615	S	S	*	*			trans	-90.7	122.6	164.8	-72.5	-173.4	-1.8	0	0	107.9	K230	Q228-K230 PolarHBondContact O-N 3.09Å
229	A	51.4	Low	58.6	Low	96 Å²	96	103.5 Å²	103.5	79%	0.793	59%	0.59	S	S	*	*			trans	-47	108.8	166.8	0	0	0	0	0	107.9	L231	A229-L231 PolarHBondContact O-N 3.43Å
230	K	63.7	Low	61.3	Low	180 Å²	180	98.6 Å²	98.6	78%	0.783	55%	0.547	S	S	*	.			trans	-66.4	103.5	-176.6	-76.4	178.6	179.4	172.9	0	106.9	Q228 S232	Q228-K230 PolarHBondContact O-N 3.09Å; K230-S232 PolarHBondContact O-N 3.07Å
231	L	79.1	Confident	63.8	Low	64 Å²	64	101 Å²	101	34%	0.335	55%	0.545	S	S	.	.			trans	-52	134.1	165.3	-73.2	151.1	0	0	0	107.6	Y172 A229 E235 I236	Y172-L231 VanDerWaalsContact CE2-O 3.31Å; Y172-L231 WeakPolarHBondContact CE2-O 3.13Å; Y172-L231 PolarHBondContact OH-O 3.31Å; A229-L231 PolarHBondContact O-N 3.43Å; L231-E235 HydrophobicContact CB-CB 4.31Å; L231-E235 HydrophobicContact CD2-CB 3.94Å; L231-I236 HydrophobicContact CB-CD1 4.24Å; L231-I236 HydrophobicContact CB-CG1 3.73Å
232	S	84.4	Confident	66.6	Low	48 Å²	48	97.9 Å²	97.9	34%	0.336	53%	0.532	S	S	.	.			trans	-60	157.9	172.7	62.8	0	0	0	0	110.7	K230 E234 E235 I236	K230-S232 PolarHBondContact O-N 3.07Å; S232-E234 PolarHBondContact O-N 3.04Å; S232-E235 WeakPolarHBondContact CB-OE2 3.44Å; S232-E235 PolarHBondContact N-OE2 3.41Å; S232-E235 PolarHBondContact O-N 3.2Å; S232-E235 WeakPolarHBondContact OG-CB 3.18Å; S232-E235 VanDerWaalsContact OG-CD 3.3Å; S232-E235 WeakPolarHBondContact OG-CG 3.29Å; S232-E235 PolarHBondContact OG-N 2.97Å; S232-E235 PolarHBondContact OG-OE2 3.34Å; S232-I236 WeakPolarHBondContact O-CG1 3.49Å; S232-I236 PolarHBondContact O-N 2.99Å
233	A	83.5	Confident	69.2	Low	45 Å²	45	89.8 Å²	89.8	37%	0.372	49%	0.489	S	S	.	.	H	α-helix	trans	-57	-37.4	177.2	0	0	0	0	0	111.5	Y172 L175 I236 T237	Y172-A233 HydrophobicContact CD2-CB 4.48Å; L175-A233 HydrophobicContact CD1-CB 4.23Å; A233-I236 PolarHBondContact O-N 2.7Å; A233-T237 WeakPolarHBondContact O-CB 3.18Å; A233-T237 PolarHBondContact O-N 2.91Å; A233-T237 PolarHBondContact O-OG1 3.2Å
234	E	84.8	Confident	71.7	Confident	161 Å²	161	82 Å²	82	75%	0.752	45%	0.452	S	S	*	.	H	α-helix	trans	-64.3	-45.3	177.5	-68.5	165.4	-165.2	0	0	112.3	S232 T237 S238	S232-E234 PolarHBondContact O-N 3.04Å; E234-T237 PolarHBondContact O-N 3.48Å; E234-S238 WeakPolarHBondContact O-CB 3.41Å; E234-S238 PolarHBondContact O-N 2.78Å
235	E	86.9	Confident	74.6	Confident	101 Å²	101	81 Å²	81	47%	0.472	44%	0.444	S	S	.	.	H	α-helix	trans	-63	-42.1	175	-73.2	167.8	128.4	0	0	111.7	L231 S232 S238 L239	L231-E235 HydrophobicContact CB-CB 4.31Å; L231-E235 HydrophobicContact CD2-CB 3.94Å; S232-E235 WeakPolarHBondContact CB-OE2 3.44Å; S232-E235 PolarHBondContact N-OE2 3.41Å; S232-E235 PolarHBondContact O-N 3.2Å; S232-E235 WeakPolarHBondContact OG-CB 3.18Å; S232-E235 VanDerWaalsContact OG-CD 3.3Å; S232-E235 WeakPolarHBondContact OG-CG 3.29Å; S232-E235 PolarHBondContact OG-N 2.97Å; S232-E235 PolarHBondContact OG-OE2 3.34Å; E235-S238 PolarHBondContact O-N 2.95Å; E235-L239 VanDerWaalsContact O-CB 3.27Å; E235-L239 WeakPolarHBondContact O-CB 3.41Å; E235-L239 PolarHBondContact O-N 3.4Å
236	I	87.3	Confident	77.3	Confident	3 Å²	3	75.4 Å²	75.4	2%	0.015	41%	0.413	C	S	.	.	H	α-helix	trans	-62.6	-45.8	176.3	-65.7	170.1	0	0	0	110.3	Y172 L175 L179 L231 S232 A233 L239 L240	Y172-I236 HydrophobicContact CD2-CD1 4.31Å; Y172-I236 HydrophobicContact CE2-CD1 3.7Å; L175-I236 HydrophobicContact CB-CG2 3.83Å; L179-I236 HydrophobicContact CB-CG2 4.11Å; L179-I236 HydrophobicContact CD2-CG1 4.33Å; L179-I236 HydrophobicContact CD2-CG2 4.05Å; L231-I236 HydrophobicContact CB-CD1 4.24Å; L231-I236 HydrophobicContact CB-CG1 3.73Å; S232-I236 WeakPolarHBondContact O-CG1 3.49Å; S232-I236 PolarHBondContact O-N 2.99Å; A233-I236 PolarHBondContact O-N 2.7Å; I236-L239 PolarHBondContact O-N 2.81Å; I236-L240 VanDerWaalsContact O-CB 3.22Å; I236-L240 WeakPolarHBondContact O-CB 3.46Å; I236-L240 PolarHBondContact O-N 3.49Å
237	T	88.2	Confident	80.2	Confident	47 Å²	47	70.1 Å²	70.1	29%	0.288	38%	0.38	S	S	.	.	H	α-helix	trans	-63.4	-44.1	178.9	-61.3	0	0	0	0	111.8	A233 E234 L240 K241	A233-T237 WeakPolarHBondContact O-CB 3.18Å; A233-T237 PolarHBondContact O-N 2.91Å; A233-T237 PolarHBondContact O-OG1 3.2Å; E234-T237 PolarHBondContact O-N 3.48Å; T237-L240 PolarHBondContact O-N 3.39Å; T237-K241 HydrophobicContact CG2-CD 4.5Å; T237-K241 WeakPolarHBondContact O-CG 3.38Å; T237-K241 PolarHBondContact O-N 3.42Å
238	S	89.2	Confident	82.6	Confident	81 Å²	81	68.2 Å²	68.2	57%	0.566	36%	0.357	S	S	*	.	H	α-helix	trans	-61.5	-47.1	176.9	-174.4	0	0	0	0	111.3	E234 E235 L240 K241 S242	E234-S238 WeakPolarHBondContact O-CB 3.41Å; E234-S238 PolarHBondContact O-N 2.78Å; E235-S238 PolarHBondContact O-N 2.95Å; S238-L240 PolarHBondContact O-N 3.31Å; S238-K241 PolarHBondContact O-N 3.14Å; S238-S242 PolarHBondContact O-N 2.99Å; S238-S242 VanDerWaalsContact O-N 3.12Å
239	L	89.6	Confident	84.8	Confident	22 Å²	22	68.4 Å²	68.4	12%	0.115	36%	0.355	C	S	.	.	H	α-helix	trans	-63.8	-44.1	178.1	-177.3	61.6	0	0	0	111.9	L179 S202 F203 E235 I236 K241 S242 L243	L179-L239 HydrophobicContact CD1-CB 4.48Å; L179-L239 HydrophobicContact CD1-CD2 3.79Å; L179-L239 HydrophobicContact CD1-CG 3.92Å; L179-L239 HydrophobicContact CD2-CD2 4.12Å; S202-L239 VanDerWaalsContact OG-CD1 3.29Å; S202-L239 WeakPolarHBondContact OG-CD1 3.21Å; F203-L239 HydrophobicContact CD1-CD1 4.13Å; F203-L239 HydrophobicContact CE1-CD1 4.04Å; E235-L239 VanDerWaalsContact O-CB 3.27Å; E235-L239 WeakPolarHBondContact O-CB 3.41Å; E235-L239 PolarHBondContact O-N 3.4Å; I236-L239 PolarHBondContact O-N 2.81Å; L239-K241 VanDerWaalsContact C-N 3.32Å; L239-K241 PolarHBondContact O-N 3.34Å; L239-S242 PolarHBondContact O-N 3.46Å; L239-S242 PolarHBondContact O-OG 3.03Å; L239-L243 WeakPolarHBondContact O-CB 3.45Å; L239-L243 PolarHBondContact O-N 3.1Å
240	L	90.4	Very high	86.5	Confident	13 Å²	13	66.9 Å²	66.9	7%	0.068	34%	0.336	C	S	.	.	H	α-helix	trans	-61.1	-41.1	178.3	-172.2	69.6	0	0	0	111.4	D178 L179 A182 I236 T237 S238 L243 I244 L255	D178-L240 HydrophobicContact CB-CD1 4.27Å; D178-L240 HydrophobicContact CB-CD2 3.96Å; L179-L240 HydrophobicContact CB-CD1 4.43Å; A182-L240 HydrophobicContact CB-CD1 3.75Å; I236-L240 VanDerWaalsContact O-CB 3.22Å; I236-L240 WeakPolarHBondContact O-CB 3.46Å; I236-L240 PolarHBondContact O-N 3.49Å; T237-L240 PolarHBondContact O-N 3.39Å; S238-L240 PolarHBondContact O-N 3.31Å; L240-L243 PolarHBondContact O-N 3.22Å; L240-I244 HydrophobicContact CD1-CD1 4.11Å; L240-I244 HydrophobicContact CD1-CG1 4.45Å; L240-I244 HydrophobicContact CD2-CD1 4.31Å; L240-I244 HydrophobicContact CG-CD1 3.71Å; L240-I244 HydrophobicContact CG-CG1 4.41Å; L240-I244 WeakPolarHBondContact O-CB 3.36Å; L240-I244 WeakPolarHBondContact O-CD1 3.42Å; L240-I244 VanDerWaalsContact O-CG1 3.23Å; L240-I244 WeakPolarHBondContact O-CG1 3.46Å; L240-I244 PolarHBondContact O-N 3.18Å; L240-L255 HydrophobicContact CD1-CD2 4.47Å
241	K	89.5	Confident	87.6	Confident	147 Å²	147	59.4 Å²	59.4	64%	0.639	30%	0.304	S	S	*	.	H	α-helix	trans	-59.1	-50.2	174.3	-76.4	176.4	-179.9	178.4	0	111.5	T237 S238 L239 L243 I244 E245	T237-K241 HydrophobicContact CG2-CD 4.5Å; T237-K241 WeakPolarHBondContact O-CG 3.38Å; T237-K241 PolarHBondContact O-N 3.42Å; S238-K241 PolarHBondContact O-N 3.14Å; L239-K241 VanDerWaalsContact C-N 3.32Å; L239-K241 PolarHBondContact O-N 3.34Å; K241-L243 VanDerWaalsContact C-N 3.33Å; K241-L243 PolarHBondContact O-N 2.9Å; K241-I244 PolarHBondContact O-N 2.92Å; K241-E245 WeakPolarHBondContact O-CB 3.37Å; K241-E245 PolarHBondContact O-N 3.33Å
242	S	90.2	Very high	87.8	Confident	37 Å²	37	59.2 Å²	59.2	26%	0.259	30%	0.3	S	S	.	.	H	α-helix	trans	-62	-39.1	179.2	66.5	0	0	0	0	112.9	F203 S238 L239 E245 Y246	F203-S242 WeakPolarHBondContact CE1-OG 3.3Å; S238-S242 PolarHBondContact O-N 2.99Å; S238-S242 VanDerWaalsContact O-N 3.12Å; L239-S242 PolarHBondContact O-N 3.46Å; L239-S242 PolarHBondContact O-OG 3.03Å; S242-E245 PolarHBondContact O-N 2.69Å; S242-Y246 PolarHBondContact O-N 2.91Å
243	L	90.3	Very high	87.7	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-69.8	-43.1	179.6	-173.7	60.7	0	0	0	112.3	L179 A182 R183 C186 F203 L239 L240 K241 E245 Y246 L247	L179-L243 HydrophobicContact CD1-CD2 4.21Å; A182-L243 HydrophobicContact CB-CD2 3.37Å; A182-L243 HydrophobicContact CB-CG 4Å; R183-L243 HydrophobicContact CG-CD2 3.89Å; C186-L243 HydrophobicContact CB-CD1 3.75Å; F203-L243 HydrophobicContact CB-CD1 3.57Å; F203-L243 HydrophobicContact CD1-CB 4.35Å; F203-L243 HydrophobicContact CD1-CD1 3.67Å; F203-L243 HydrophobicContact CD2-CD1 3.71Å; F203-L243 HydrophobicContact CE1-CB 4.22Å; F203-L243 HydrophobicContact CE1-CD1 4.21Å; F203-L243 HydrophobicContact CE2-CD1 4.26Å; F203-L243 HydrophobicContact CG-CD1 3.38Å; F203-L243 HydrophobicContact CZ-CD1 4.48Å; L239-L243 WeakPolarHBondContact O-CB 3.45Å; L239-L243 PolarHBondContact O-N 3.1Å; L240-L243 PolarHBondContact O-N 3.22Å; K241-L243 VanDerWaalsContact C-N 3.33Å; K241-L243 PolarHBondContact O-N 2.9Å; L243-E245 VanDerWaalsContact C-N 3.31Å; L243-Y246 PolarHBondContact O-N 2.84Å; L243-L247 WeakPolarHBondContact O-CG 3.32Å; L243-L247 PolarHBondContact O-N 3.28Å
244	I	89.9	Confident	87.6	Confident	17 Å²	17	56.2 Å²	56.2	9%	0.087	27%	0.273	C	S	.	.	H	α-helix	trans	-64.7	-39.1	175	-69.7	166.5	0	0	0	110.5	L240 K241 L247 R248 L255 W256	L240-I244 HydrophobicContact CD1-CD1 4.11Å; L240-I244 HydrophobicContact CD1-CG1 4.45Å; L240-I244 HydrophobicContact CD2-CD1 4.31Å; L240-I244 HydrophobicContact CG-CD1 3.71Å; L240-I244 HydrophobicContact CG-CG1 4.41Å; L240-I244 WeakPolarHBondContact O-CB 3.36Å; L240-I244 WeakPolarHBondContact O-CD1 3.42Å; L240-I244 VanDerWaalsContact O-CG1 3.23Å; L240-I244 WeakPolarHBondContact O-CG1 3.46Å; L240-I244 PolarHBondContact O-N 3.18Å; K241-I244 PolarHBondContact O-N 2.92Å; I244-L247 PolarHBondContact O-N 3.41Å; I244-R248 HydrophobicContact CG2-CG 4.29Å; I244-R248 WeakPolarHBondContact O-CB 3.49Å; I244-R248 VanDerWaalsContact O-CG 3.3Å; I244-R248 WeakPolarHBondContact O-CG 3.45Å; I244-R248 PolarHBondContact O-N 3.16Å; I244-L255 HydrophobicContact CD1-CD2 4.4Å; I244-L255 HydrophobicContact CG1-CD2 4.34Å; I244-W256 HydrophobicContact CD1-CH2 3.46Å; I244-W256 VanDerWaalsContact CD1-CH2 3.46Å; I244-W256 HydrophobicContact CD1-CZ2 3.84Å; I244-W256 HydrophobicContact CD1-CZ3 4.17Å; I244-W256 HydrophobicContact CG2-CZ3 4.45Å
245	E	89.1	Confident	87.5	Confident	101 Å²	101	49.1 Å²	49.1	47%	0.472	24%	0.24	S	C	.	.	H	α-helix	trans	-63.1	-42.3	176.5	-172.1	172.4	-177.7	0	0	111.8	K241 S242 L243 R248 K249	K241-E245 WeakPolarHBondContact O-CB 3.37Å; K241-E245 PolarHBondContact O-N 3.33Å; S242-E245 PolarHBondContact O-N 2.69Å; L243-E245 VanDerWaalsContact C-N 3.31Å; E245-R248 PolarHBondContact O-N 3.22Å; E245-K249 HydrophobicContact CG-CD 3.97Å; E245-K249 HydrophobicContact CG-CG 4.48Å; E245-K249 WeakPolarHBondContact O-CB 3.32Å; E245-K249 WeakPolarHBondContact O-CG 3.43Å; E245-K249 PolarHBondContact O-N 3.38Å; E245-K249 VanDerWaalsContact OE1-CE 3.23Å; E245-K249 WeakPolarHBondContact OE1-CE 3.49Å; E245-K249 IonicContact OE1-NZ 2.84Å; E245-K249 PolarHBondContact OE1-NZ 3.05Å
246	Y	91.1	Very high	87.1	Confident	32 Å²	32	50.4 Å²	50.4	13%	0.125	24%	0.241	C	C	.	.	H	α-helix	trans	-60.8	-51	172.1	175.3	-103.7	0	0	0	112	C186 D190 V199 F203 S242 L243 R248 K249 T250 Y251	C186-Y246 VanDerWaalsContact SG-CE1 3.52Å; D190-Y246 WeakPolarHBondContact OD1-CE1 3.17Å; D190-Y246 PolarHBondContact OD1-OH 3.2Å; V199-Y246 HydrophobicContact CB-CE2 4.29Å; V199-Y246 HydrophobicContact CG2-CE2 3.72Å; F203-Y246 HydrophobicContact CD2-CD1 4.01Å; F203-Y246 HydrophobicContact CD2-CG 4.14Å; F203-Y246 HydrophobicContact CE2-CD1 4.07Å; F203-Y246 HydrophobicContact CE2-CD2 4.3Å; F203-Y246 AromaticContact CE2-CG 3.74Å; F203-Y246 HydrophobicContact CE2-CG 3.74Å; S242-Y246 PolarHBondContact O-N 2.91Å; L243-Y246 PolarHBondContact O-N 2.84Å; Y246-R248 VanDerWaalsContact C-N 3.28Å; Y246-R248 PolarHBondContact O-N 2.93Å; Y246-K249 PolarHBondContact O-N 3.2Å; Y246-T250 VanDerWaalsContact CD2-OG1 3.31Å; Y246-T250 WeakPolarHBondContact CD2-OG1 3.47Å; Y246-T250 HydrophobicContact CE2-CG2 4.18Å; Y246-T250 WeakPolarHBondContact CE2-OG1 3.37Å; Y246-T250 WeakPolarHBondContact O-CB 3.45Å; Y246-T250 PolarHBondContact O-N 3.32Å; Y246-T250 PolarHBondContact O-OG1 3.3Å; Y246-T250 VanDerWaalsContact O-OG1 3.11Å; Y246-Y251 HydrophobicContact CE1-CD2 4.5Å; Y246-Y251 AromaticContact CE1-CE2 3.86Å; Y246-Y251 HydrophobicContact CE1-CE2 3.86Å
247	L	89.2	Confident	86.4	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-56.5	-40.6	178.3	-75.5	173.7	0	0	0	112.6	C186 L189 L243 I244 Y251 F252 Y253	C186-L247 HydrophobicContact CB-CD2 4.15Å; L189-L247 HydrophobicContact CD1-CD2 3.94Å; L243-L247 WeakPolarHBondContact O-CG 3.32Å; L243-L247 PolarHBondContact O-N 3.28Å; I244-L247 PolarHBondContact O-N 3.41Å; L247-Y251 HydrophobicContact CD2-CD2 4.19Å; L247-Y251 CarbonylContact O-C 3.56Å; L247-Y251 PolarHBondContact O-N 3.34Å; L247-Y251 VanDerWaalsContact O-N 3.15Å; L247-F252 PolarHBondContact O-N 2.98Å; L247-Y253 HydrophobicContact CB-CD1 4.38Å; L247-Y253 HydrophobicContact CD1-CD1 4.2Å; L247-Y253 HydrophobicContact CD2-CD1 4.23Å; L247-Y253 PolarHBondContact O-N 3.34Å
248	R	86.9	Confident	85.6	Confident	110 Å²	110	54.8 Å²	54.8	42%	0.415	27%	0.272	S	S	.	.	H	α-helix	trans	-73.5	-37	178.5	-74.5	177.8	173	-175.3	-5.7	113.1	I244 E245 Y246 F252 Y253	I244-R248 HydrophobicContact CG2-CG 4.29Å; I244-R248 WeakPolarHBondContact O-CB 3.49Å; I244-R248 VanDerWaalsContact O-CG 3.3Å; I244-R248 WeakPolarHBondContact O-CG 3.45Å; I244-R248 PolarHBondContact O-N 3.16Å; E245-R248 PolarHBondContact O-N 3.22Å; Y246-R248 VanDerWaalsContact C-N 3.28Å; Y246-R248 PolarHBondContact O-N 2.93Å; R248-F252 WeakPolarHBondContact O-CA 3.28Å; R248-F252 PolarHBondContact O-N 3.02Å; R248-Y253 WeakPolarHBondContact CG-O 3.33Å
249	K	86.4	Confident	84.7	Confident	130 Å²	130	54.5 Å²	54.5	57%	0.565	27%	0.267	S	S	*	.	H	α-helix	trans	-78.5	-40.6	-178.8	-77.4	178.2	172.6	172.6	0	112.9	E245 Y246	E245-K249 HydrophobicContact CG-CD 3.97Å; E245-K249 HydrophobicContact CG-CG 4.48Å; E245-K249 WeakPolarHBondContact O-CB 3.32Å; E245-K249 WeakPolarHBondContact O-CG 3.43Å; E245-K249 PolarHBondContact O-N 3.38Å; E245-K249 VanDerWaalsContact OE1-CE 3.23Å; E245-K249 WeakPolarHBondContact OE1-CE 3.49Å; E245-K249 IonicContact OE1-NZ 2.84Å; E245-K249 PolarHBondContact OE1-NZ 3.05Å; Y246-K249 PolarHBondContact O-N 3.2Å
250	T	87.5	Confident	84.1	Confident	64 Å²	64	59 Å²	59	39%	0.393	28%	0.283	S	S	.	.	H	α-helix	trans	-90.2	-41.1	-172.3	-49.1	0	0	0	0	112	Y246	Y246-T250 VanDerWaalsContact CD2-OG1 3.31Å; Y246-T250 WeakPolarHBondContact CD2-OG1 3.47Å; Y246-T250 HydrophobicContact CE2-CG2 4.18Å; Y246-T250 WeakPolarHBondContact CE2-OG1 3.37Å; Y246-T250 WeakPolarHBondContact O-CB 3.45Å; Y246-T250 PolarHBondContact O-N 3.32Å; Y246-T250 PolarHBondContact O-OG1 3.3Å; Y246-T250 VanDerWaalsContact O-OG1 3.11Å
251	Y	85.7	Confident	83.3	Confident	24 Å²	24	62.8 Å²	62.8	9%	0.094	30%	0.297	C	S	.	.	S	Bend	trans	-118.2	3.7	-172.5	-60.4	-60.3	0	0	0	114.3	L189 D190 A193 Y246 L247 Y253	L189-Y251 HydrophobicContact CB-CD1 4.42Å; L189-Y251 HydrophobicContact CB-CD2 3.85Å; L189-Y251 HydrophobicContact CB-CE1 4.48Å; L189-Y251 HydrophobicContact CB-CE2 3.92Å; L189-Y251 HydrophobicContact CB-CG 4.11Å; L189-Y251 HydrophobicContact CD1-CD2 3.97Å; L189-Y251 HydrophobicContact CD1-CG 3.98Å; D190-Y251 WeakPolarHBondContact CA-OH 3.07Å; D190-Y251 WeakPolarHBondContact OD1-CE2 3.27Å; D190-Y251 VanDerWaalsContact OD1-CZ 3.27Å; D190-Y251 PolarHBondContact OD1-OH 3.34Å; A193-Y251 HydrophobicContact CB-CE1 3.82Å; Y246-Y251 HydrophobicContact CE1-CD2 4.5Å; Y246-Y251 AromaticContact CE1-CE2 3.86Å; Y246-Y251 HydrophobicContact CE1-CE2 3.86Å; L247-Y251 HydrophobicContact CD2-CD2 4.19Å; L247-Y251 CarbonylContact O-C 3.56Å; L247-Y251 PolarHBondContact O-N 3.34Å; L247-Y251 VanDerWaalsContact O-N 3.15Å; Y251-Y253 PolarHBondContact O-N 3.4Å; Y251-Y253 VanDerWaalsContact O-N 3.07Å
252	F	84.6	Confident	82	Confident	60 Å²	60	61.4 Å²	61.4	26%	0.263	29%	0.293	S	S	.	.			trans	49.6	35.2	-173.5	-58.2	-70.9	0	0	0	112.3	L247 R248 R260 Y261 Q264	L247-F252 PolarHBondContact O-N 2.98Å; R248-F252 WeakPolarHBondContact O-CA 3.28Å; R248-F252 PolarHBondContact O-N 3.02Å; F252-R260 CarbonylContact O-C 3.51Å; F252-R260 WeakPolarHBondContact O-CA 3.45Å; F252-Y261 WeakPolarHBondContact CB-O 3.27Å; F252-Y261 WeakPolarHBondContact O-CD2 3.25Å; F252-Y261 PolarHBondContact O-N 2.99Å; F252-Q264 HydrophobicContact CE1-CB 4.26Å; F252-Q264 HydrophobicContact CE1-CG 3.43Å; F252-Q264 VanDerWaalsContact CE1-CG 3.43Å; F252-Q264 HydrophobicContact CZ-CG 3.64Å
253	Y	82.2	Confident	80.5	Confident	23 Å²	23	64.9 Å²	64.9	9%	0.09	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.4	-170	-178.5	-102.9	0	0	0	111.7	A185 L189 L247 R248 Y251 L255 V259 R260	A185-Y253 HydrophobicContact CB-CD1 4.48Å; A185-Y253 HydrophobicContact CB-CE1 3.7Å; L189-Y253 HydrophobicContact CD1-CD1 4.02Å; L189-Y253 HydrophobicContact CD1-CD2 3.99Å; L189-Y253 HydrophobicContact CD1-CG 3.67Å; L247-Y253 HydrophobicContact CB-CD1 4.38Å; L247-Y253 HydrophobicContact CD1-CD1 4.2Å; L247-Y253 HydrophobicContact CD2-CD1 4.23Å; L247-Y253 PolarHBondContact O-N 3.34Å; R248-Y253 WeakPolarHBondContact CG-O 3.33Å; Y251-Y253 PolarHBondContact O-N 3.4Å; Y251-Y253 VanDerWaalsContact O-N 3.07Å; Y253-L255 HydrophobicContact CE1-CD1 4.42Å; Y253-V259 WeakPolarHBondContact CA-O 3.45Å; Y253-R260 HydrophobicContact CD2-CG 3.86Å
254	C	81.5	Confident	78.8	Confident	6 Å²	6	70.5 Å²	70.5	4%	0.041	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	119	169.7	-177.7	0	0	0	0	110.8	W256 C257 S258 V259 Y261	C254-W256 VanDerWaalsContact C-N 3.29Å; C254-W256 PolarHBondContact O-N 3.13Å; C254-C257 HydrophobicContact CB-CB 3.96Å; C254-C257 PolarHBondContact O-N 3.25Å; C254-S258 VanDerWaalsContact O-CA 3.29Å; C254-S258 WeakPolarHBondContact O-CA 3.46Å; C254-S258 PolarHBondContact O-N 3.44Å; C254-V259 PolarHBondContact N-O 3.1Å; C254-Y261 HydrophobicContact CB-CE2 3.72Å; C254-Y261 VanDerWaalsContact CB-OH 3.23Å; C254-Y261 WeakPolarHBondContact CB-OH 3.32Å
255	L	81.9	Confident	76.9	Confident	13 Å²	13	75.9 Å²	75.9	7%	0.068	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-36.3	179.6	-176.9	64.3	0	0	0	113.8	M181 A182 A185 L240 I244 Y253	M181-L255 HydrophobicContact CB-CD1 4.16Å; A182-L255 HydrophobicContact CB-CD1 4.13Å; A182-L255 HydrophobicContact CB-CD2 3.67Å; A185-L255 HydrophobicContact CB-CD1 4.29Å; L240-L255 HydrophobicContact CD1-CD2 4.47Å; I244-L255 HydrophobicContact CD1-CD2 4.4Å; I244-L255 HydrophobicContact CG1-CD2 4.34Å; Y253-L255 HydrophobicContact CE1-CD1 4.42Å
256	W	78.5	Confident	74.8	Confident	127 Å²	127	77.2 Å²	77.2	48%	0.481	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-28.9	-174.6	-59.2	-77.4	0	0	0	113.2	I244 C254	I244-W256 HydrophobicContact CD1-CH2 3.46Å; I244-W256 VanDerWaalsContact CD1-CH2 3.46Å; I244-W256 HydrophobicContact CD1-CZ2 3.84Å; I244-W256 HydrophobicContact CD1-CZ3 4.17Å; I244-W256 HydrophobicContact CG2-CZ3 4.45Å; C254-W256 VanDerWaalsContact C-N 3.29Å; C254-W256 PolarHBondContact O-N 3.13Å
257	C	72.9	Confident	72.4	Confident	77 Å²	77	78.3 Å²	78.3	52%	0.52	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-22.8	173.1	-55.8	0	0	0	0	111.7	C254 V259	C254-C257 HydrophobicContact CB-CB 3.96Å; C254-C257 PolarHBondContact O-N 3.25Å; C257-V259 HydrophobicContact CB-CB 4.37Å; C257-V259 HydrophobicContact CB-CG2 4.3Å; C257-V259 WeakPolarHBondContact O-CG2 3.4Å; C257-V259 PolarHBondContact O-N 3.36Å
258	S	72.1	Confident	70.3	Confident	65 Å²	65	85.3 Å²	85.3	46%	0.455	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	58	31.3	-170.7	-57.4	0	0	0	0	113.8	C254	C254-S258 VanDerWaalsContact O-CA 3.29Å; C254-S258 WeakPolarHBondContact O-CA 3.46Å; C254-S258 PolarHBondContact O-N 3.44Å
259	V	69.8	Low	68.1	Low	76 Å²	76	89.5 Å²	89.5	46%	0.461	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	143.9	-177.5	179.2	0	0	0	0	110.2	Y253 C254 C257	Y253-V259 WeakPolarHBondContact CA-O 3.45Å; C254-V259 PolarHBondContact N-O 3.1Å; C257-V259 HydrophobicContact CB-CB 4.37Å; C257-V259 HydrophobicContact CB-CG2 4.3Å; C257-V259 WeakPolarHBondContact O-CG2 3.4Å; C257-V259 PolarHBondContact O-N 3.36Å
260	R	76.3	Confident	65.9	Low	115 Å²	115	89.7 Å²	89.7	43%	0.434	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.4	166.5	-72.5	-177.3	148.3	172.5	-9.8	109.3	L189 F252 Y253	L189-R260 VanDerWaalsContact CD2-NH2 3.3Å; F252-R260 CarbonylContact O-C 3.51Å; F252-R260 WeakPolarHBondContact O-CA 3.45Å; Y253-R260 HydrophobicContact CD2-CG 3.86Å
261	Y	73	Confident	63.5	Low	94 Å²	94	94.1 Å²	94.1	37%	0.369	45%	0.453	S	S	.	.			trans	-90.1	153.2	176.3	-50.4	-73.5	0	0	0	111.2	F252 C254	F252-Y261 WeakPolarHBondContact CB-O 3.27Å; F252-Y261 WeakPolarHBondContact O-CD2 3.25Å; F252-Y261 PolarHBondContact O-N 2.99Å; C254-Y261 HydrophobicContact CB-CE2 3.72Å; C254-Y261 VanDerWaalsContact CB-OH 3.23Å; C254-Y261 WeakPolarHBondContact CB-OH 3.32Å
262	E	63.3	Low	61.3	Low	118 Å²	118	100.9 Å²	100.9	55%	0.551	49%	0.491	S	S	*	.	S	Bend	trans	-83.4	-23.3	-176.2	-66.9	176.3	-163.2	0	0	113.8	F29	F29-E262 WeakPolarHBondContact CD2-OE1 3.48Å; F29-E262 HydrophobicContact CE2-CG 3.66Å; F29-E262 WeakPolarHBondContact CE2-OE1 3.04Å; F29-E262 HydrophobicContact CZ-CG 3.91Å
263	D	59.5	Low	59	Low	110 Å²	110	103.3 Å²	103.3	59%	0.588	52%	0.515	S	S	*	.			trans	-142.8	146.7	-170.5	-102.8	-30	0	0	0	115.8	L265	D263-L265 PolarHBondContact O-N 2.98Å; D263-L265 VanDerWaalsContact O-N 3.15Å
264	Q	53.5	Low	57	Low	117 Å²	117	105.2 Å²	105.2	55%	0.547	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-22.8	178.5	-87.5	-175	18.4	0	0	114.5	F252 G267	F252-Q264 HydrophobicContact CE1-CB 4.26Å; F252-Q264 HydrophobicContact CE1-CG 3.43Å; F252-Q264 VanDerWaalsContact CE1-CG 3.43Å; F252-Q264 HydrophobicContact CZ-CG 3.64Å; Q264-G267 PolarHBondContact O-N 3.5Å
265	L	49.2	Very low	54.9	Low	131 Å²	131	108.9 Å²	108.9	69%	0.686	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	-28.4	-168.4	-74.4	166.5	0	0	0	113.9	D263	D263-L265 PolarHBondContact O-N 2.98Å; D263-L265 VanDerWaalsContact O-N 3.15Å
266	L	45.9	Very low	52.8	Low	129 Å²	129	116.4 Å²	116.4	68%	0.675	60%	0.596	S	S	*	*	H	α-helix	trans	-71.5	-30.4	172.4	-93.4	112.9	0	0	0	112.2	R268	L266-R268 PolarHBondContact O-N 3.03Å
267	G	41.3	Very low	50.8	Low	55 Å²	55	113.9 Å²	113.9	57%	0.567	59%	0.594	S	S	*	*	H	α-helix	trans	-77.2	-10.5	179.4	0	0	0	0	0	115.9	Q264	Q264-G267 PolarHBondContact O-N 3.5Å
268	R	43.6	Very low	49	Very low	148 Å²	148	115.4 Å²	115.4	56%	0.558	60%	0.603	S	S	*	*	H	α-helix	trans	-99.8	-27.7	-179.9	-84.4	-173.8	-172.4	-177.9	5.1	114.6	L266 R271	L266-R268 PolarHBondContact O-N 3.03Å; R268-R271 WeakPolarHBondContact O-CG 3.23Å
269	K	41.7	Very low	47.3	Very low	197 Å²	197	119 Å²	119	86%	0.857	62%	0.616	S	S	*	*	H	α-helix	trans	-79.3	-15.3	-175.4	-82.2	-176.2	174.1	179.9	0	114.5
270	E	40.1	Very low	46.1	Very low	134 Å²	134	121.8 Å²	121.8	63%	0.626	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	15.3	173.6	-65.4	-172.9	155.2	0	0	113.9	L272	E270-L272 PolarHBondContact O-N 3.49Å
271	R	37.5	Very low	44.8	Very low	157 Å²	157	123.4 Å²	123.4	59%	0.592	63%	0.632	S	S	*	*			trans	-71.2	115	-177.4	-80.1	-175.8	-172.7	-169.4	1.8	112.5	R268	R268-R271 WeakPolarHBondContact O-CG 3.23Å
272	L	39.1	Very low	44.1	Very low	167 Å²	167	123 Å²	123	87%	0.874	64%	0.635	S	S	*	*	S	Bend	trans	111.5	-12.3	140.9	-67.2	153.3	0	0	0	119.4	E270	E270-L272 PolarHBondContact O-N 3.49Å
273	S	37.2	Very low	44.4	Very low	111 Å²	111	120 Å²	120	78%	0.776	62%	0.623	S	S	*	*	S	Bend	trans	-126.8	-20.2	178.9	62.7	0	0	0	0	116.7
274	S	38.6	Very low	45.2	Very low	63 Å²	63	117.9 Å²	117.9	44%	0.441	61%	0.609	S	S	.	*	S	Bend	trans	-95.1	-17.6	-171.8	61.5	0	0	0	0	115.3
275	C	37.8	Very low	46.7	Very low	83 Å²	83	112.5 Å²	112.5	56%	0.561	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-4.3	-170.9	-39.1	0	0	0	0	115
276	L	38.1	Very low	48.6	Very low	171 Å²	171	106.4 Å²	106.4	90%	0.895	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.2	-1.8	173.5	-85.5	160.6	0	0	0	112.9
277	V	36.7	Very low	50.9	Low	74 Å²	74	100.2 Å²	100.2	45%	0.448	52%	0.52	S	S	.	.	S	Bend	trans	-82.4	127.4	166.6	-172.3	0	0	0	0	106.5	I279	V277-I279 PolarHBondContact O-N 3.36Å
278	P	35.3	Very low	53.4	Low	109 Å²	109	97.6 Å²	97.6	71%	0.708	49%	0.493	S	S	*	.			trans	-52.2	121.5	172.2	19.8	-28	0	0	0	106.6	K280	P278-K280 VanDerWaalsContact C-N 3.31Å; P278-K280 PolarHBondContact O-N 3.14Å
279	I	35.5	Very low	55.8	Low	140 Å²	140	90.6 Å²	90.6	72%	0.718	47%	0.467	S	S	*	.			trans	-42.1	103	177.4	-65.5	169.4	0	0	0	106	V277 K281	V277-I279 PolarHBondContact O-N 3.36Å; I279-K281 VanDerWaalsContact C-N 3.32Å; I279-K281 PolarHBondContact O-N 3.28Å
280	K	45.1	Very low	58.2	Low	135 Å²	135	81.5 Å²	81.5	59%	0.587	43%	0.428	S	S	*	.			trans	-62.7	104.1	-177.3	-76.1	-176.9	178.3	179.3	0	103.8	P278 L282	P278-K280 VanDerWaalsContact C-N 3.31Å; P278-K280 PolarHBondContact O-N 3.14Å; K280-L282 PolarHBondContact O-N 3.2Å
281	K	50	Low	60.6	Low	148 Å²	148	75.1 Å²	75.1	64%	0.643	40%	0.398	S	S	*	.			trans	-46.9	112.1	174.8	-85.6	175.1	170.2	-173.5	0	106.5	I279 N283 N311	I279-K281 VanDerWaalsContact C-N 3.32Å; I279-K281 PolarHBondContact O-N 3.28Å; K281-N283 PolarHBondContact O-N 3.24Å; K281-N283 PolarHBondContact O-OD1 3.07Å; K281-N311 WeakPolarHBondContact CB-ND2 3.02Å
282	L	57.4	Low	63.1	Low	85 Å²	85	70.6 Å²	70.6	45%	0.445	39%	0.385	S	S	.	.			trans	-59.1	115.4	175.7	-84.7	141.8	0	0	0	106.8	K280 N518 I520	K280-L282 PolarHBondContact O-N 3.2Å; L282-N518 HydrophobicContact CB-CB 4.48Å; L282-N518 HydrophobicContact CD2-CB 4.09Å; L282-I520 HydrophobicContact CD2-CG1 4.29Å
283	N	68.6	Low	65.5	Low	55 Å²	55	63.3 Å²	63.3	29%	0.294	35%	0.35	S	S	.	.			trans	-73.9	126.6	174.7	-69.6	-16.5	0	0	0	107.9	K281 E313	K281-N283 PolarHBondContact O-N 3.24Å; K281-N283 PolarHBondContact O-OD1 3.07Å; N283-E313 HydrophobicContact CB-CB 4.25Å; N283-E313 PolarHBondContact ND2-OE2 3.12Å
284	F	77.7	Confident	68	Low	67 Å²	67	61 Å²	61	29%	0.294	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	142.9	172.7	-73.7	-94.7	0	0	0	109.3	I309 N311 F312 E313	F284-I309 HydrophobicContact CB-CG2 3.79Å; F284-I309 HydrophobicContact CD1-CD1 4.02Å; F284-I309 HydrophobicContact CD1-CG2 4.42Å; F284-I309 HydrophobicContact CD2-CG2 3.32Å; F284-I309 HydrophobicContact CE1-CD1 4.27Å; F284-I309 HydrophobicContact CE2-CG2 3.95Å; F284-I309 HydrophobicContact CG-CD1 4.19Å; F284-I309 HydrophobicContact CG-CG2 3.59Å; F284-N311 PolarHBondContact N-O 2.96Å; F284-F312 HydrophobicContact CB-CD2 3.75Å; F284-F312 HydrophobicContact CB-CE2 4.39Å; F284-F312 CarbonylContact O-C 3.58Å; F284-F312 VanDerWaalsContact O-CA 3.32Å; F284-F312 WeakPolarHBondContact O-CA 3.33Å; F284-E313 PolarHBondContact O-N 3.12Å
285	R	84.9	Confident	70.4	Confident	3 Å²	3	58 Å²	58	1%	0.011	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	148.2	179.5	-56.1	-175.3	-171.5	115	-5.7	109.2	E313 M314 S382 L384 A516 F517 I519	R285-E313 HydrophobicContact CG-CB 4.43Å; R285-E313 IonicContact CZ-OE2 3.84Å; R285-E313 IonicContact NE-OE2 2.72Å; R285-E313 PolarHBondContact NE-OE2 2.95Å; R285-E313 IonicContact NH2-OE2 3.1Å; R285-E313 PolarHBondContact NH2-OE2 2.92Å; R285-M314 HydrophobicContact CB-CG 4.49Å; R285-M314 HydrophobicContact CG-CG 4.17Å; R285-S382 PolarHBondContact NH2-OG 3.23Å; R285-L384 VanDerWaalsContact CZ-CD2 3.45Å; R285-A516 WeakPolarHBondContact O-CA 3.29Å; R285-F517 HydrophobicContact CB-CD1 4.49Å; R285-F517 HydrophobicContact CB-CE1 3.89Å; R285-F517 HydrophobicContact CB-CZ 4.06Å; R285-F517 PolarHBondContact N-O 3.5Å; R285-F517 WeakPolarHBondContact O-CD1 3.47Å; R285-F517 PolarHBondContact O-N 3.42Å; R285-I519 PolarHBondContact NH1-O 3.29Å; R285-I519 VanDerWaalsContact NH1-O 3.09Å
286	G	89.6	Confident	72.8	Confident	3 Å²	3	57.5 Å²	57.5	3%	0.031	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	146.3	176.7	0	0	0	0	0	111.8	F312 M314 M315 L316 F515	G286-F312 VanDerWaalsContact CA-CZ 3.42Å; G286-M314 PolarHBondContact N-O 3.14Å; G286-M314 VanDerWaalsContact N-O 3.14Å; G286-M315 CarbonylContact O-C 3.54Å; G286-M315 WeakPolarHBondContact O-CA 3.03Å; G286-L316 PolarHBondContact O-N 2.84Å; G286-F515 CarbonylContact C-O 3.57Å; G286-F515 WeakPolarHBondContact CA-O 3.33Å
287	V	93.4	Very high	75.1	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	136.8	164.2	-164.4	0	0	0	0	108.9	L316 F470 L502 L514 F515 F517	V287-L316 CarbonylContact C-O 3.49Å; V287-L316 WeakPolarHBondContact CA-O 3.41Å; V287-L316 HydrophobicContact CG1-CB 4.22Å; V287-L316 HydrophobicContact CG2-CB 4.32Å; V287-L316 HydrophobicContact CG2-CD1 4.44Å; V287-F470 HydrophobicContact CB-CD1 4.08Å; V287-F470 HydrophobicContact CB-CE1 4.25Å; V287-F470 HydrophobicContact CB-CG 4.3Å; V287-F470 HydrophobicContact CG1-CB 3.94Å; V287-F470 HydrophobicContact CG1-CD1 3.97Å; V287-F470 HydrophobicContact CG1-CD2 4.37Å; V287-F470 HydrophobicContact CG1-CG 3.85Å; V287-F470 HydrophobicContact CG2-CD1 3.94Å; V287-F470 HydrophobicContact CG2-CD2 3.86Å; V287-F470 HydrophobicContact CG2-CE1 3.81Å; V287-F470 HydrophobicContact CG2-CE2 3.69Å; V287-F470 HydrophobicContact CG2-CG 3.99Å; V287-F470 HydrophobicContact CG2-CZ 3.68Å; V287-L502 HydrophobicContact CB-CD1 3.93Å; V287-L502 HydrophobicContact CG1-CD1 3.71Å; V287-L514 CarbonylContact O-C 3.49Å; V287-L514 WeakPolarHBondContact O-CA 3.4Å; V287-F515 PolarHBondContact N-O 3.01Å; V287-F515 PolarHBondContact O-N 2.79Å; V287-F517 HydrophobicContact CG2-CD1 4.16Å; V287-F517 HydrophobicContact CG2-CE1 3.44Å; V287-F517 VanDerWaalsContact CG2-CE1 3.44Å; V287-F517 HydrophobicContact CG2-CZ 4.22Å
288	C	93.6	Very high	77.5	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.5	174.8	-168.3	0	0	0	0	109.5	L298 M315 L316 V317 C318 Y513 L514	C288-L298 HydrophobicContact CB-CD1 4.43Å; C288-M315 HydrophobicContact CB-SD 4.27Å; C288-L316 PolarHBondContact N-O 2.82Å; C288-V317 HydrophobicContact CB-CG2 4.27Å; C288-V317 WeakPolarHBondContact O-CA 3.35Å; C288-C318 PolarHBondContact O-N 2.79Å; C288-C318 PolarHBondContact O-SG 2.7Å; C288-Y513 CarbonylContact C-O 3.43Å; C288-Y513 WeakPolarHBondContact CA-O 3.32Å; C288-L514 HydrophobicContact CB-CD2 3.74Å
289	G	93.2	Very high	80	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.			trans	-76	-138.2	168.6	0	0	0	0	0	111.4	V291 V317 Y513	G289-V291 PolarHBondContact O-N 3.22Å; G289-V317 WeakPolarHBondContact O-CG1 3.17Å; G289-Y513 PolarHBondContact N-O 3.14Å
290	D	92.2	Very high	82.5	Confident	7 Å²	7	42.2 Å²	42.2	4%	0.037	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-73.2	124.8	-177.8	-48.9	-60.9	0	0	0	111	L292 G319 E320 N473 S503 R504 C505	D290-L292 HydrophobicContact CB-CD1 4.37Å; D290-L292 HydrophobicContact CB-CD2 4.35Å; D290-L292 HydrophobicContact CB-CG 3.99Å; D290-G319 WeakPolarHBondContact OD1-CA 3.23Å; D290-E320 PolarHBondContact OD1-N 2.99Å; D290-N473 WeakPolarHBondContact OD1-CA 3.26Å; D290-N473 PolarHBondContact OD1-N 3.23Å; D290-N473 PolarHBondContact OD1-OD1 3.01Å; D290-N473 WeakPolarHBondContact OD2-CA 3.46Å; D290-N473 PolarHBondContact OD2-N 2.94Å; D290-N473 VanDerWaalsContact OD2-N 3.14Å; D290-S503 PolarHBondContact N-O 3.36Å; D290-R504 HydrophobicContact CB-CB 3.94Å; D290-R504 CarbonylContact O-C 3.45Å; D290-C505 VanDerWaalsContact O-CB 3.29Å; D290-C505 WeakPolarHBondContact O-CB 3.46Å; D290-C505 PolarHBondContact O-N 3.05Å
291	V	92.2	Very high	84.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.			trans	-90.8	-37.4	178.9	-179	0	0	0	0	110.9	G289 G293 N294 F295 L298 V317 E320 F321	G289-V291 PolarHBondContact O-N 3.22Å; V291-G293 PolarHBondContact O-N 2.88Å; V291-G293 VanDerWaalsContact O-N 3.16Å; V291-N294 VanDerWaalsContact O-CB 3.32Å; V291-N294 WeakPolarHBondContact O-CB 3.37Å; V291-N294 PolarHBondContact O-N 2.87Å; V291-F295 HydrophobicContact CG1-CD1 3.9Å; V291-F295 HydrophobicContact CG1-CE1 4.25Å; V291-L298 HydrophobicContact CG1-CD2 4.24Å; V291-L298 HydrophobicContact CG2-CD2 3.8Å; V291-V317 HydrophobicContact CG2-CG1 3.82Å; V291-E320 PolarHBondContact N-O 3.37Å; V291-F321 HydrophobicContact CB-CD2 4.14Å; V291-F321 HydrophobicContact CG1-CD2 4.43Å; V291-F321 HydrophobicContact CG2-CD2 3.99Å; V291-F321 HydrophobicContact CG2-CE2 4.45Å
292	L	90.1	Very high	86	Confident	62 Å²	62	33.2 Å²	33.2	33%	0.325	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	37.1	175.7	-56.4	177.4	0	0	0	114.2	D290 N294 E320 F321 G323 R504	D290-L292 HydrophobicContact CB-CD1 4.37Å; D290-L292 HydrophobicContact CB-CD2 4.35Å; D290-L292 HydrophobicContact CB-CG 3.99Å; L292-N294 VanDerWaalsContact C-N 3.29Å; L292-N294 PolarHBondContact O-N 2.81Å; L292-E320 HydrophobicContact CD2-CB 3.91Å; L292-E320 HydrophobicContact CD2-CG 3.95Å; L292-E320 PolarHBondContact N-O 3.34Å; L292-E320 VanDerWaalsContact N-O 3.08Å; L292-F321 PolarHBondContact N-O 3.03Å; L292-G323 VanDerWaalsContact O-CA 3.26Å; L292-G323 WeakPolarHBondContact O-CA 3.46Å; L292-R504 HydrophobicContact CD1-CB 4.07Å
293	G	88.9	Confident	87.4	Confident	13 Å²	13	33.3 Å²	33.3	13%	0.134	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.4	-1.9	-179.5	0	0	0	0	0	115.5	V291 F295 F321	V291-G293 PolarHBondContact O-N 2.88Å; V291-G293 VanDerWaalsContact O-N 3.16Å; G293-F295 VanDerWaalsContact O-CD2 3.26Å; G293-F295 WeakPolarHBondContact O-CD2 3.37Å; G293-F295 WeakPolarHBondContact O-CG 3.41Å; G293-F295 PolarHBondContact O-N 2.77Å; G293-F321 PolarHBondContact N-O 3.06Å; G293-F321 VanDerWaalsContact N-O 3.07Å
294	N	88.8	Confident	88	Confident	62 Å²	62	35.6 Å²	35.6	33%	0.332	18%	0.181	S	C	.	.			trans	-76.8	53.2	176	-71.8	-40.2	0	0	0	112.2	V291 L292 L298 C505	V291-N294 VanDerWaalsContact O-CB 3.32Å; V291-N294 WeakPolarHBondContact O-CB 3.37Å; V291-N294 PolarHBondContact O-N 2.87Å; L292-N294 VanDerWaalsContact C-N 3.29Å; L292-N294 PolarHBondContact O-N 2.81Å; N294-L298 PolarHBondContact O-N 2.81Å; N294-C505 HydrophobicContact CB-CB 4.4Å; N294-C505 PolarHBondContact ND2-O 2.88Å; N294-C505 VanDerWaalsContact ND2-O 3.07Å
295	F	89.7	Confident	88.1	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.009	18%	0.18	C	C	.	.	H	α-helix	trans	-62.5	-58.7	-171.6	-55.9	-49.6	0	0	0	111.7	V291 G293 N297 L298 W299 F321 F322 E328 N329 I332	V291-F295 HydrophobicContact CG1-CD1 3.9Å; V291-F295 HydrophobicContact CG1-CE1 4.25Å; G293-F295 VanDerWaalsContact O-CD2 3.26Å; G293-F295 WeakPolarHBondContact O-CD2 3.37Å; G293-F295 WeakPolarHBondContact O-CG 3.41Å; G293-F295 PolarHBondContact O-N 2.77Å; F295-N297 PolarHBondContact O-N 2.86Å; F295-L298 WeakPolarHBondContact O-CA 3.32Å; F295-L298 WeakPolarHBondContact O-CB 3.04Å; F295-L298 PolarHBondContact O-N 3.4Å; F295-W299 HydrophobicContact CB-CE3 3.99Å; F295-W299 HydrophobicContact CB-CH2 3.46Å; F295-W299 VanDerWaalsContact CB-CH2 3.46Å; F295-W299 HydrophobicContact CB-CZ2 4.22Å; F295-W299 HydrophobicContact CB-CZ3 3.35Å; F295-W299 AromaticContact CD1-CH2 3.6Å; F295-W299 HydrophobicContact CD1-CH2 3.6Å; F295-W299 AromaticContact CD1-CZ3 3.73Å; F295-W299 HydrophobicContact CD1-CZ3 3.73Å; F295-W299 AromaticContact CG-CH2 3.79Å; F295-W299 HydrophobicContact CG-CH2 3.79Å; F295-W299 AromaticContact CG-CZ3 3.96Å; F295-W299 HydrophobicContact CG-CZ3 3.96Å; F295-W299 WeakPolarHBondContact O-CZ3 3.33Å; F295-W299 PolarHBondContact O-N 3.37Å; F295-F321 HydrophobicContact CD1-CE1 4.09Å; F295-F321 HydrophobicContact CD1-CE2 4.31Å; F295-F321 AromaticContact CD1-CZ 3.87Å; F295-F321 HydrophobicContact CD1-CZ 3.87Å; F295-F321 AromaticContact CE1-CD1 3.77Å; F295-F321 HydrophobicContact CE1-CD1 3.77Å; F295-F321 HydrophobicContact CE1-CD2 4.48Å; F295-F321 AromaticContact CE1-CE1 3.41Å; F295-F321 HydrophobicContact CE1-CE1 3.41Å; F295-F321 VanDerWaalsContact CE1-CE1 3.41Å; F295-F321 HydrophobicContact CE1-CE2 4.19Å; F295-F321 HydrophobicContact CE1-CG 4.31Å; F295-F321 AromaticContact CE1-CZ 3.67Å; F295-F321 HydrophobicContact CE1-CZ 3.67Å; F295-F321 VanDerWaalsContact CE1-O 3.32Å; F295-F321 WeakPolarHBondContact CE1-O 3.35Å; F295-F321 HydrophobicContact CZ-CD1 4.4Å; F295-F321 HydrophobicContact CZ-CE1 4.11Å; F295-F322 HydrophobicContact CZ-CD1 4Å; F295-E328 HydrophobicContact CD2-CB 4.25Å; F295-E328 HydrophobicContact CE2-CB 4.16Å; F295-N329 WeakPolarHBondContact CZ-OD1 3.38Å; F295-I332 HydrophobicContact CB-CD1 3.83Å; F295-I332 HydrophobicContact CD1-CD1 3.34Å; F295-I332 HydrophobicContact CD2-CD1 3.3Å; F295-I332 HydrophobicContact CD2-CG1 4.04Å; F295-I332 HydrophobicContact CE1-CD1 3.58Å; F295-I332 HydrophobicContact CE2-CD1 3.53Å; F295-I332 HydrophobicContact CE2-CG1 4.24Å; F295-I332 HydrophobicContact CG-CD1 3.19Å; F295-I332 HydrophobicContact CG-CG1 4.3Å; F295-I332 HydrophobicContact CZ-CD1 3.66Å
296	V	87.5	Confident	87.7	Confident	72 Å²	72	37 Å²	37	44%	0.436	19%	0.192	S	C	.	.	H	α-helix	trans	-52.3	-41.2	-176.8	-177.7	0	0	0	0	112	L298 W299 V300	V296-L298 PolarHBondContact O-N 3.19Å; V296-W299 PolarHBondContact O-N 2.91Å; V296-V300 HydrophobicContact CG1-CG2 4.34Å; V296-V300 VanDerWaalsContact O-CG2 3.28Å; V296-V300 WeakPolarHBondContact O-CG2 3.44Å; V296-V300 PolarHBondContact O-N 3.38Å
297	N	86.9	Confident	87.3	Confident	82 Å²	82	46.2 Å²	46.2	44%	0.439	23%	0.226	S	C	.	.	H	α-helix	trans	-62.4	-41.5	177.6	-69.7	-19.3	0	0	0	112.8	F295 R301	F295-N297 PolarHBondContact O-N 2.86Å; N297-R301 WeakPolarHBondContact O-CG 3.45Å; N297-R301 PolarHBondContact O-N 2.96Å
298	L	87.4	Confident	86.5	Confident	1 Å²	1	55 Å²	55	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-67.3	-43	176	174.7	63.6	0	0	0	110.9	C288 V291 N294 F295 V296 R301 M302 M315 L514	C288-L298 HydrophobicContact CB-CD1 4.43Å; V291-L298 HydrophobicContact CG1-CD2 4.24Å; V291-L298 HydrophobicContact CG2-CD2 3.8Å; N294-L298 PolarHBondContact O-N 2.81Å; F295-L298 WeakPolarHBondContact O-CA 3.32Å; F295-L298 WeakPolarHBondContact O-CB 3.04Å; F295-L298 PolarHBondContact O-N 3.4Å; V296-L298 PolarHBondContact O-N 3.19Å; L298-R301 PolarHBondContact O-N 3.48Å; L298-M302 HydrophobicContact CD1-CG 4.25Å; L298-M302 HydrophobicContact CD1-SD 4.04Å; L298-M302 HydrophobicContact CD2-SD 4.29Å; L298-M302 HydrophobicContact CG-CG 4.43Å; L298-M302 HydrophobicContact CG-SD 3.71Å; L298-M302 VanDerWaalsContact O-CG 3.24Å; L298-M302 WeakPolarHBondContact O-CG 3.18Å; L298-M302 PolarHBondContact O-N 3.18Å; L298-M315 HydrophobicContact CD1-CE 4.44Å; L298-L514 HydrophobicContact CD1-CD1 4.41Å; L298-L514 HydrophobicContact CD1-CD2 3.87Å
299	W	88	Confident	85.6	Confident	22 Å²	22	57.2 Å²	57.2	8%	0.083	28%	0.276	C	S	.	.	H	α-helix	trans	-64.6	-44.8	-179.1	-82.7	-127.3	0	0	0	111.8	F295 V296 R301 M302 E303 F321 I332 R338 C339	F295-W299 HydrophobicContact CB-CE3 3.99Å; F295-W299 HydrophobicContact CB-CH2 3.46Å; F295-W299 VanDerWaalsContact CB-CH2 3.46Å; F295-W299 HydrophobicContact CB-CZ2 4.22Å; F295-W299 HydrophobicContact CB-CZ3 3.35Å; F295-W299 AromaticContact CD1-CH2 3.6Å; F295-W299 HydrophobicContact CD1-CH2 3.6Å; F295-W299 AromaticContact CD1-CZ3 3.73Å; F295-W299 HydrophobicContact CD1-CZ3 3.73Å; F295-W299 AromaticContact CG-CH2 3.79Å; F295-W299 HydrophobicContact CG-CH2 3.79Å; F295-W299 AromaticContact CG-CZ3 3.96Å; F295-W299 HydrophobicContact CG-CZ3 3.96Å; F295-W299 WeakPolarHBondContact O-CZ3 3.33Å; F295-W299 PolarHBondContact O-N 3.37Å; V296-W299 PolarHBondContact O-N 2.91Å; W299-R301 VanDerWaalsContact C-N 3.26Å; W299-R301 PolarHBondContact O-N 3.45Å; W299-M302 WeakPolarHBondContact O-CB 3.49Å; W299-M302 PolarHBondContact O-N 3.02Å; W299-M302 VanDerWaalsContact O-N 3.12Å; W299-E303 WeakPolarHBondContact O-CG 3.48Å; W299-E303 PolarHBondContact O-N 2.9Å; W299-F321 HydrophobicContact CH2-CE2 4.37Å; W299-F321 AromaticContact CH2-CZ 3.84Å; W299-F321 HydrophobicContact CH2-CZ 3.84Å; W299-F321 HydrophobicContact CZ3-CZ 4.42Å; W299-I332 HydrophobicContact CH2-CD1 3.36Å; W299-I332 HydrophobicContact CH2-CG1 4.48Å; W299-I332 HydrophobicContact CZ2-CD1 3.65Å; W299-I332 HydrophobicContact CZ2-CG1 4.35Å; W299-R338 VanDerWaalsContact CD1-O 3.27Å; W299-R338 PolarHBondContact NE1-O 3.49Å; W299-C339 WeakPolarHBondContact CZ2-SG 3.49Å
300	V	87.7	Confident	84.3	Confident	68 Å²	68	63 Å²	63	41%	0.412	31%	0.312	S	S	.	.	H	α-helix	trans	-57.7	-42.6	176.6	169.5	0	0	0	0	110.5	V296 E303 Q304	V296-V300 HydrophobicContact CG1-CG2 4.34Å; V296-V300 VanDerWaalsContact O-CG2 3.28Å; V296-V300 WeakPolarHBondContact O-CG2 3.44Å; V296-V300 PolarHBondContact O-N 3.38Å; V300-E303 PolarHBondContact O-N 3.34Å; V300-Q304 VanDerWaalsContact O-CG 3.28Å; V300-Q304 WeakPolarHBondContact O-CG 3.49Å; V300-Q304 PolarHBondContact O-N 2.9Å
301	R	84.1	Confident	83.4	Confident	90 Å²	90	64.9 Å²	64.9	34%	0.34	32%	0.322	S	S	.	.	H	α-helix	trans	-67.5	-39.7	176.3	-72.6	-179.2	172	139.5	-16.3	112.4	N297 L298 W299 Q304 V305 Y513 L514	N297-R301 WeakPolarHBondContact O-CG 3.45Å; N297-R301 PolarHBondContact O-N 2.96Å; L298-R301 PolarHBondContact O-N 3.48Å; W299-R301 VanDerWaalsContact C-N 3.26Å; W299-R301 PolarHBondContact O-N 3.45Å; R301-Q304 PolarHBondContact O-N 3.48Å; R301-V305 WeakPolarHBondContact O-CG2 3.25Å; R301-V305 PolarHBondContact O-N 3.26Å; R301-Y513 WeakPolarHBondContact CD-OH 3.39Å; R301-Y513 VanDerWaalsContact CZ-CZ 3.47Å; R301-Y513 PolarHBondContact NE-OH 2.9Å; R301-Y513 PolarHBondContact NH1-OH 3.08Å; R301-L514 HydrophobicContact CB-CD1 4.27Å
302	M	84.6	Confident	82.8	Confident	4 Å²	4	65.8 Å²	65.8	2%	0.02	33%	0.326	C	S	.	.	H	α-helix	trans	-61.5	-44.3	174.5	-71.6	167.2	73.8	0	0	111.7	L298 W299 Q304 V305 L306 M315 P340 L341	L298-M302 HydrophobicContact CD1-CG 4.25Å; L298-M302 HydrophobicContact CD1-SD 4.04Å; L298-M302 HydrophobicContact CD2-SD 4.29Å; L298-M302 HydrophobicContact CG-CG 4.43Å; L298-M302 HydrophobicContact CG-SD 3.71Å; L298-M302 VanDerWaalsContact O-CG 3.24Å; L298-M302 WeakPolarHBondContact O-CG 3.18Å; L298-M302 PolarHBondContact O-N 3.18Å; W299-M302 WeakPolarHBondContact O-CB 3.49Å; W299-M302 PolarHBondContact O-N 3.02Å; W299-M302 VanDerWaalsContact O-N 3.12Å; M302-Q304 VanDerWaalsContact C-N 3.34Å; M302-Q304 PolarHBondContact O-N 3.15Å; M302-V305 PolarHBondContact O-N 3.5Å; M302-L306 WeakPolarHBondContact O-CB 3.08Å; M302-L306 WeakPolarHBondContact O-CG 2.98Å; M302-L306 PolarHBondContact O-N 2.9Å; M302-M315 HydrophobicContact CE-CB 3.84Å; M302-M315 HydrophobicContact CE-CE 4Å; M302-M315 HydrophobicContact CE-CG 4.2Å; M302-M315 HydrophobicContact CG-CE 3.43Å; M302-M315 VanDerWaalsContact CG-CE 3.43Å; M302-M315 HydrophobicContact SD-CE 3.82Å; M302-M315 HydrophobicContact SD-CG 4.47Å; M302-P340 HydrophobicContact CB-CG 4.22Å; M302-P340 HydrophobicContact CE-CG 4.27Å; M302-L341 HydrophobicContact CB-CD2 4.09Å; M302-L341 HydrophobicContact CE-CD1 3.68Å; M302-L341 HydrophobicContact CE-CD2 3.27Å; M302-L341 HydrophobicContact CE-CG 3.25Å; M302-L341 HydrophobicContact CG-CD2 4.41Å
303	E	85.4	Confident	82.6	Confident	87 Å²	87	64.9 Å²	64.9	41%	0.407	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-39.6	175.8	-73.3	-174.5	-176.9	0	0	112.3	W299 V300 V305 L306 R307	W299-E303 WeakPolarHBondContact O-CG 3.48Å; W299-E303 PolarHBondContact O-N 2.9Å; V300-E303 PolarHBondContact O-N 3.34Å; E303-V305 VanDerWaalsContact C-N 3.32Å; E303-V305 PolarHBondContact O-N 3.08Å; E303-L306 PolarHBondContact O-N 2.95Å; E303-R307 VanDerWaalsContact O-CG 3.28Å; E303-R307 WeakPolarHBondContact O-CG 3.25Å; E303-R307 PolarHBondContact O-N 2.96Å; E303-R307 IonicContact OE2-NH2 3.07Å
304	Q	82.2	Confident	82.6	Confident	102 Å²	102	64.3 Å²	64.3	48%	0.477	31%	0.314	S	S	.	.	H	α-helix	trans	-62.1	-40.4	174.2	-73.1	172.8	-1.7	0	0	111.9	V300 R301 M302 R307 K308	V300-Q304 VanDerWaalsContact O-CG 3.28Å; V300-Q304 WeakPolarHBondContact O-CG 3.49Å; V300-Q304 PolarHBondContact O-N 2.9Å; R301-Q304 PolarHBondContact O-N 3.48Å; M302-Q304 VanDerWaalsContact C-N 3.34Å; M302-Q304 PolarHBondContact O-N 3.15Å; Q304-R307 PolarHBondContact O-N 3.48Å; Q304-K308 PolarHBondContact O-N 3.19Å
305	V	78.9	Confident	82.7	Confident	47 Å²	47	61.7 Å²	61.7	29%	0.285	30%	0.299	S	S	.	.	H	α-helix	trans	-65.4	-46.7	174.3	173.2	0	0	0	0	110.6	R301 M302 E303 R307 K308 I309 F312	R301-V305 WeakPolarHBondContact O-CG2 3.25Å; R301-V305 PolarHBondContact O-N 3.26Å; M302-V305 PolarHBondContact O-N 3.5Å; E303-V305 VanDerWaalsContact C-N 3.32Å; E303-V305 PolarHBondContact O-N 3.08Å; V305-R307 VanDerWaalsContact C-N 3.27Å; V305-R307 PolarHBondContact O-N 2.81Å; V305-K308 PolarHBondContact O-N 2.9Å; V305-I309 HydrophobicContact CG1-CD1 4.28Å; V305-I309 PolarHBondContact O-N 3.23Å; V305-F312 HydrophobicContact CG1-CD2 3.74Å; V305-F312 HydrophobicContact CG1-CE2 3.77Å; V305-F312 HydrophobicContact CG1-CG 4.41Å; V305-F312 HydrophobicContact CG1-CZ 4.43Å
306	L	78.4	Confident	83	Confident	52 Å²	52	61.6 Å²	61.6	27%	0.272	30%	0.299	S	S	.	.	H	α-helix	trans	-60.2	-33.3	178.1	-75.3	171	0	0	0	113.2	M302 E303 K308 F312 P340 L341	M302-L306 WeakPolarHBondContact O-CB 3.08Å; M302-L306 WeakPolarHBondContact O-CG 2.98Å; M302-L306 PolarHBondContact O-N 2.9Å; E303-L306 PolarHBondContact O-N 2.95Å; L306-K308 VanDerWaalsContact C-N 3.31Å; L306-K308 PolarHBondContact O-N 2.96Å; L306-F312 HydrophobicContact CD2-CB 3.73Å; L306-P340 HydrophobicContact CD1-CB 4.18Å; L306-L341 HydrophobicContact CD1-CD2 3.73Å; L306-L341 HydrophobicContact CD2-CD2 4.21Å; L306-L341 HydrophobicContact CG-CD2 4.05Å
307	R	80.4	Confident	83.3	Confident	197 Å²	197	58.1 Å²	58.1	74%	0.743	28%	0.278	S	S	*	.	H	α-helix	trans	-66.7	-31.7	174.2	-74	173.8	-167.4	-174.5	7.6	112.7	E303 Q304 V305	E303-R307 VanDerWaalsContact O-CG 3.28Å; E303-R307 WeakPolarHBondContact O-CG 3.25Å; E303-R307 PolarHBondContact O-N 2.96Å; E303-R307 IonicContact OE2-NH2 3.07Å; Q304-R307 PolarHBondContact O-N 3.48Å; V305-R307 VanDerWaalsContact C-N 3.27Å; V305-R307 PolarHBondContact O-N 2.81Å
308	K	75.9	Confident	83.6	Confident	185 Å²	185	54.2 Å²	54.2	80%	0.804	26%	0.257	S	S	*	.	H	α-helix	trans	-90	-35.7	-179.8	-67.4	-177.7	179.5	-177.3	0	112.2	Q304 V305 L306	Q304-K308 PolarHBondContact O-N 3.19Å; V305-K308 PolarHBondContact O-N 2.9Å; L306-K308 VanDerWaalsContact C-N 3.31Å; L306-K308 PolarHBondContact O-N 2.96Å
309	I	74.6	Confident	83.8	Confident	46 Å²	46	54.3 Å²	54.3	24%	0.236	26%	0.258	C	S	.	.			trans	-125.1	107.7	-172.5	-57.6	177.7	0	0	0	108.5	F284 V305 N311	F284-I309 HydrophobicContact CB-CG2 3.79Å; F284-I309 HydrophobicContact CD1-CD1 4.02Å; F284-I309 HydrophobicContact CD1-CG2 4.42Å; F284-I309 HydrophobicContact CD2-CG2 3.32Å; F284-I309 HydrophobicContact CE1-CD1 4.27Å; F284-I309 HydrophobicContact CE2-CG2 3.95Å; F284-I309 HydrophobicContact CG-CD1 4.19Å; F284-I309 HydrophobicContact CG-CG2 3.59Å; V305-I309 HydrophobicContact CG1-CD1 4.28Å; V305-I309 PolarHBondContact O-N 3.23Å; I309-N311 VanDerWaalsContact C-N 3.34Å; I309-N311 PolarHBondContact O-N 3.42Å
310	T	66.9	Low	83.9	Confident	122 Å²	122	53.4 Å²	53.4	75%	0.748	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-17.9	-176.1	52.1	0	0	0	0	114.2
311	N	73.5	Confident	84.2	Confident	46 Å²	46	50.2 Å²	50.2	25%	0.246	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.5	43.7	-176.5	-55	-33.4	0	0	0	112.5	K281 F284 I309	K281-N311 WeakPolarHBondContact CB-ND2 3.02Å; F284-N311 PolarHBondContact N-O 2.96Å; I309-N311 VanDerWaalsContact C-N 3.34Å; I309-N311 PolarHBondContact O-N 3.42Å
312	F	80	Confident	84.5	Confident	20 Å²	20	46.2 Å²	46.2	9%	0.088	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	113.8	175.5	-157.5	-94.6	0	0	0	110.1	F284 G286 V305 L306 M314 M315 L341	F284-F312 HydrophobicContact CB-CD2 3.75Å; F284-F312 HydrophobicContact CB-CE2 4.39Å; F284-F312 CarbonylContact O-C 3.58Å; F284-F312 VanDerWaalsContact O-CA 3.32Å; F284-F312 WeakPolarHBondContact O-CA 3.33Å; G286-F312 VanDerWaalsContact CA-CZ 3.42Å; V305-F312 HydrophobicContact CG1-CD2 3.74Å; V305-F312 HydrophobicContact CG1-CE2 3.77Å; V305-F312 HydrophobicContact CG1-CG 4.41Å; V305-F312 HydrophobicContact CG1-CZ 4.43Å; L306-F312 HydrophobicContact CD2-CB 3.73Å; F312-M314 WeakPolarHBondContact CE1-O 3.26Å; F312-M315 HydrophobicContact CE1-CE 4.14Å; F312-M315 HydrophobicContact CZ-CE 4.11Å; F312-L341 HydrophobicContact CD1-CD1 3.84Å; F312-L341 HydrophobicContact CD1-CD2 3.83Å; F312-L341 HydrophobicContact CD1-CG 4.45Å; F312-L341 HydrophobicContact CE1-CD1 3.85Å; F312-L341 HydrophobicContact CE1-CD2 4.07Å
313	E	84.1	Confident	84.7	Confident	42 Å²	42	46.8 Å²	46.8	20%	0.196	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-44.5	-167.5	-178.3	-176	171.7	0	0	113.3	N283 F284 R285 S380 S382	N283-E313 HydrophobicContact CB-CB 4.25Å; N283-E313 PolarHBondContact ND2-OE2 3.12Å; F284-E313 PolarHBondContact O-N 3.12Å; R285-E313 HydrophobicContact CG-CB 4.43Å; R285-E313 IonicContact CZ-OE2 3.84Å; R285-E313 IonicContact NE-OE2 2.72Å; R285-E313 PolarHBondContact NE-OE2 2.95Å; R285-E313 IonicContact NH2-OE2 3.1Å; R285-E313 PolarHBondContact NH2-OE2 2.92Å; E313-S380 PolarHBondContact OE1-OG 3.21Å; E313-S382 WeakPolarHBondContact OE1-CB 3.35Å; E313-S382 PolarHBondContact OE1-N 3.16Å; E313-S382 PolarHBondContact OE1-OG 3.23Å; E313-S382 WeakPolarHBondContact OE2-CB 3.44Å; E313-S382 PolarHBondContact OE2-OG 3.4Å
314	M	89.7	Confident	84.8	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	157.5	-169.6	56.1	-170.1	-93	0	0	111.9	R285 G286 F312 L316 L341 P342 Y344 F378	R285-M314 HydrophobicContact CB-CG 4.49Å; R285-M314 HydrophobicContact CG-CG 4.17Å; G286-M314 PolarHBondContact N-O 3.14Å; G286-M314 VanDerWaalsContact N-O 3.14Å; F312-M314 WeakPolarHBondContact CE1-O 3.26Å; M314-L316 HydrophobicContact CE-CD1 3.86Å; M314-L316 HydrophobicContact CE-CD2 3.19Å; M314-L316 HydrophobicContact CE-CG 3.6Å; M314-L341 VanDerWaalsContact C-CD1 3.46Å; M314-P342 WeakPolarHBondContact CA-O 3.48Å; M314-Y344 HydrophobicContact CB-CD2 4.18Å; M314-Y344 HydrophobicContact CB-CE2 3.83Å; M314-Y344 HydrophobicContact CE-CD2 3.96Å; M314-Y344 HydrophobicContact CE-CE2 4.06Å; M314-Y344 HydrophobicContact SD-CE2 4.23Å; M314-F378 HydrophobicContact CE-CE2 4.38Å; M314-F378 HydrophobicContact CE-CZ 3.97Å
315	M	91.9	Very high	85	Confident	6 Å²	6	47.6 Å²	47.6	3%	0.03	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.5	168.7	-175.1	66.9	75.5	0	0	109.4	G286 C288 L298 M302 F312 V317 L341 P342 T343 Y344 L514	G286-M315 CarbonylContact O-C 3.54Å; G286-M315 WeakPolarHBondContact O-CA 3.03Å; C288-M315 HydrophobicContact CB-SD 4.27Å; L298-M315 HydrophobicContact CD1-CE 4.44Å; M302-M315 HydrophobicContact CE-CB 3.84Å; M302-M315 HydrophobicContact CE-CE 4Å; M302-M315 HydrophobicContact CE-CG 4.2Å; M302-M315 HydrophobicContact CG-CE 3.43Å; M302-M315 VanDerWaalsContact CG-CE 3.43Å; M302-M315 HydrophobicContact SD-CE 3.82Å; M302-M315 HydrophobicContact SD-CG 4.47Å; F312-M315 HydrophobicContact CE1-CE 4.14Å; F312-M315 HydrophobicContact CZ-CE 4.11Å; M315-V317 HydrophobicContact CG-CG2 4.49Å; M315-L341 HydrophobicContact CB-CD1 3.74Å; M315-L341 VanDerWaalsContact N-CD1 3.29Å; M315-P342 PolarHBondContact N-O 3.3Å; M315-T343 HydrophobicContact CB-CG2 4.17Å; M315-T343 HydrophobicContact CG-CG2 4.19Å; M315-T343 CarbonylContact O-C 3.48Å; M315-T343 WeakPolarHBondContact O-CA 3.18Å; M315-Y344 PolarHBondContact O-N 2.85Å; M315-L514 HydrophobicContact CE-CD2 4.17Å; M315-L514 HydrophobicContact SD-CD2 4.27Å
316	L	94.3	Very high	85.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.2	173.8	-64.3	173.1	0	0	0	108.6	G286 V287 C288 M314 Y344 F378 I425 L427	G286-L316 PolarHBondContact O-N 2.84Å; V287-L316 CarbonylContact C-O 3.49Å; V287-L316 WeakPolarHBondContact CA-O 3.41Å; V287-L316 HydrophobicContact CG1-CB 4.22Å; V287-L316 HydrophobicContact CG2-CB 4.32Å; V287-L316 HydrophobicContact CG2-CD1 4.44Å; C288-L316 PolarHBondContact N-O 2.82Å; M314-L316 HydrophobicContact CE-CD1 3.86Å; M314-L316 HydrophobicContact CE-CD2 3.19Å; M314-L316 HydrophobicContact CE-CG 3.6Å; L316-Y344 CarbonylContact C-O 3.5Å; L316-Y344 HydrophobicContact CD2-CD2 4.08Å; L316-Y344 HydrophobicContact CD2-CG 4.26Å; L316-F378 HydrophobicContact CD2-CZ 4.42Å; L316-I425 HydrophobicContact CD1-CD1 4.04Å; L316-L427 HydrophobicContact CB-CD1 4.08Å; L316-L427 HydrophobicContact CB-CD2 4.36Å; L316-L427 HydrophobicContact CD1-CD1 4.03Å; L316-L427 HydrophobicContact CD1-CD2 4.18Å; L316-L427 HydrophobicContact CD2-CD1 3.78Å; L316-L427 HydrophobicContact CG-CD1 4.16Å
317	V	94.8	Very high	85.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	113.9	174.6	-173.6	0	0	0	0	108	C288 G289 V291 M315 F321 T343 Y344 I345 L346	C288-V317 HydrophobicContact CB-CG2 4.27Å; C288-V317 WeakPolarHBondContact O-CA 3.35Å; G289-V317 WeakPolarHBondContact O-CG1 3.17Å; V291-V317 HydrophobicContact CG2-CG1 3.82Å; M315-V317 HydrophobicContact CG-CG2 4.49Å; V317-F321 HydrophobicContact CG1-CD2 4.26Å; V317-F321 HydrophobicContact CG2-CD2 4.28Å; V317-T343 HydrophobicContact CG2-CG2 3.68Å; V317-Y344 PolarHBondContact N-O 3.16Å; V317-I345 HydrophobicContact CB-CB 4.38Å; V317-I345 HydrophobicContact CB-CG2 3.93Å; V317-I345 HydrophobicContact CG2-CG2 3.93Å; V317-L346 PolarHBondContact O-N 3.01Å
318	C	93.6	Very high	86	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.245	C	C	.	.			trans	-95.7	-10	-179.6	58.3	0	0	0	0	113.4	C288 L346 L427 S429	C288-C318 PolarHBondContact O-N 2.79Å; C288-C318 PolarHBondContact O-SG 2.7Å; C318-L346 HydrophobicContact CB-CD1 4.36Å; C318-L427 HydrophobicContact CB-CD2 4.47Å; C318-S429 WeakPolarHBondContact O-CA 3.41Å
319	G	90.3	Very high	86.6	Confident	2 Å²	2	35.8 Å²	35.8	2%	0.021	21%	0.207	C	C	.	.	S	Bend	trans	-104.3	-174	178.9	0	0	0	0	0	114.6	D290 F321 A472	D290-G319 WeakPolarHBondContact OD1-CA 3.23Å; G319-F321 PolarHBondContact O-N 3.3Å; G319-A472 VanDerWaalsContact CA-CB 3.48Å
320	E	91.4	Very high	87.2	Confident	4 Å²	4	37.1 Å²	37.1	2%	0.019	21%	0.214	C	C	.	.			trans	-66.2	123.7	175.2	-179.1	58.5	-99.4	0	0	110.7	D290 V291 L292 F322 V349 N473	D290-E320 PolarHBondContact OD1-N 2.99Å; V291-E320 PolarHBondContact N-O 3.37Å; L292-E320 HydrophobicContact CD2-CB 3.91Å; L292-E320 HydrophobicContact CD2-CG 3.95Å; L292-E320 PolarHBondContact N-O 3.34Å; L292-E320 VanDerWaalsContact N-O 3.08Å; E320-F322 PolarHBondContact OE1-N 3.5Å; E320-V349 PolarHBondContact OE2-N 3.34Å; E320-V349 VanDerWaalsContact OE2-N 3.11Å; E320-N473 PolarHBondContact N-OD1 2.99Å
321	F	92.9	Very high	88.2	Confident	1 Å²	1	35.2 Å²	35.2	0%	0.004	19%	0.193	C	C	.	.			trans	-87.3	-47.4	-174.4	-175.4	-102.9	0	0	0	111.9	V291 L292 G293 F295 W299 V317 G319 I332 I345 L369	V291-F321 HydrophobicContact CB-CD2 4.14Å; V291-F321 HydrophobicContact CG1-CD2 4.43Å; V291-F321 HydrophobicContact CG2-CD2 3.99Å; V291-F321 HydrophobicContact CG2-CE2 4.45Å; L292-F321 PolarHBondContact N-O 3.03Å; G293-F321 PolarHBondContact N-O 3.06Å; G293-F321 VanDerWaalsContact N-O 3.07Å; F295-F321 HydrophobicContact CD1-CE1 4.09Å; F295-F321 HydrophobicContact CD1-CE2 4.31Å; F295-F321 AromaticContact CD1-CZ 3.87Å; F295-F321 HydrophobicContact CD1-CZ 3.87Å; F295-F321 AromaticContact CE1-CD1 3.77Å; F295-F321 HydrophobicContact CE1-CD1 3.77Å; F295-F321 HydrophobicContact CE1-CD2 4.48Å; F295-F321 AromaticContact CE1-CE1 3.41Å; F295-F321 HydrophobicContact CE1-CE1 3.41Å; F295-F321 VanDerWaalsContact CE1-CE1 3.41Å; F295-F321 HydrophobicContact CE1-CE2 4.19Å; F295-F321 HydrophobicContact CE1-CG 4.31Å; F295-F321 AromaticContact CE1-CZ 3.67Å; F295-F321 HydrophobicContact CE1-CZ 3.67Å; F295-F321 VanDerWaalsContact CE1-O 3.32Å; F295-F321 WeakPolarHBondContact CE1-O 3.35Å; F295-F321 HydrophobicContact CZ-CD1 4.4Å; F295-F321 HydrophobicContact CZ-CE1 4.11Å; W299-F321 HydrophobicContact CH2-CE2 4.37Å; W299-F321 AromaticContact CH2-CZ 3.84Å; W299-F321 HydrophobicContact CH2-CZ 3.84Å; W299-F321 HydrophobicContact CZ3-CZ 4.42Å; V317-F321 HydrophobicContact CG1-CD2 4.26Å; V317-F321 HydrophobicContact CG2-CD2 4.28Å; G319-F321 PolarHBondContact O-N 3.3Å; F321-I332 HydrophobicContact CE1-CD1 4.12Å; F321-I332 HydrophobicContact CE1-CG2 4.46Å; F321-I332 HydrophobicContact CZ-CD1 4.15Å; F321-I345 HydrophobicContact CB-CB 4.49Å; F321-I345 HydrophobicContact CB-CD1 4.22Å; F321-I345 HydrophobicContact CB-CG2 4.4Å; F321-I345 HydrophobicContact CD1-CD1 3.98Å; F321-I345 HydrophobicContact CD2-CG2 3.71Å; F321-I345 HydrophobicContact CE2-CG2 4.06Å; F321-I345 HydrophobicContact CG-CD1 4.09Å; F321-I345 HydrophobicContact CG-CG2 3.99Å; F321-L369 HydrophobicContact CD1-CD2 4.42Å; F321-L369 HydrophobicContact CE1-CD1 3.92Å; F321-L369 HydrophobicContact CE1-CD2 3.53Å; F321-L369 HydrophobicContact CE1-CG 4.37Å; F321-L369 HydrophobicContact CE2-CD1 3.99Å; F321-L369 HydrophobicContact CZ-CD1 3.52Å; F321-L369 HydrophobicContact CZ-CD2 3.85Å; F321-L369 HydrophobicContact CZ-CG 4.36Å
322	F	91.7	Very high	88.8	Confident	5 Å²	5	33 Å²	33	2%	0.022	18%	0.182	C	C	.	.			trans	-83.6	145.1	-175	-68.2	-75.2	0	0	0	111.5	F295 E320 N329 T333 I345 A353 Y356 Y357 I365	F295-F322 HydrophobicContact CZ-CD1 4Å; E320-F322 PolarHBondContact OE1-N 3.5Å; F322-N329 HydrophobicContact CD1-CB 3.81Å; F322-N329 HydrophobicContact CE1-CB 4.41Å; F322-T333 HydrophobicContact CE1-CG2 4.14Å; F322-T333 HydrophobicContact CZ-CG2 4.25Å; F322-I345 HydrophobicContact CE2-CD1 4.38Å; F322-A353 HydrophobicContact CB-CB 4.46Å; F322-Y356 HydrophobicContact CB-CD2 4.09Å; F322-Y356 HydrophobicContact CB-CE2 4.47Å; F322-Y356 HydrophobicContact CD1-CD2 4.06Å; F322-Y356 HydrophobicContact CD1-CG 4.16Å; F322-Y356 HydrophobicContact CD2-CD2 4.1Å; F322-Y356 HydrophobicContact CD2-CG 4.31Å; F322-Y356 HydrophobicContact CE1-CG 4.19Å; F322-Y356 HydrophobicContact CE2-CG 4.35Å; F322-Y356 AromaticContact CG-CD2 3.81Å; F322-Y356 HydrophobicContact CG-CD2 3.81Å; F322-Y356 HydrophobicContact CG-CG 4.22Å; F322-Y356 HydrophobicContact CZ-CG 4.29Å; F322-Y357 AromaticContact CD2-CE2 3.67Å; F322-Y357 HydrophobicContact CD2-CE2 3.67Å; F322-Y357 AromaticContact CD2-CZ 3.71Å; F322-Y357 HydrophobicContact CE2-CD2 4.43Å; F322-Y357 HydrophobicContact CE2-CE1 4.18Å; F322-Y357 AromaticContact CE2-CE2 3.82Å; F322-Y357 HydrophobicContact CE2-CE2 3.82Å; F322-Y357 AromaticContact CE2-CZ 3.69Å; F322-I365 HydrophobicContact CZ-CG2 4.27Å
323	G	88.4	Confident	89	Confident	17 Å²	17	34.1 Å²	34.1	18%	0.175	19%	0.19	C	C	.	.			trans	-97	-175.9	179.8	0	0	0	0	0	113.1	L292 D325 N329	L292-G323 VanDerWaalsContact O-CA 3.26Å; L292-G323 WeakPolarHBondContact O-CA 3.46Å; G323-D325 VanDerWaalsContact C-N 3.31Å; G323-N329 PolarHBondContact N-OD1 3.21Å; G323-N329 VanDerWaalsContact N-OD1 3.08Å; G323-N329 PolarHBondContact O-ND2 3Å
324	S	86.8	Confident	89	Confident	127 Å²	127	39 Å²	39	89%	0.888	21%	0.211	S	C	*	.	S	Bend	trans	-72.7	-23.2	171	51.8	0	0	0	0	113.2	M326	S324-M326 PolarHBondContact O-N 2.89Å
325	D	87.3	Confident	88.6	Confident	79 Å²	79	40 Å²	40	42%	0.422	22%	0.221	S	C	.	.			trans	-77.1	103.5	178.6	-172.3	-6.7	0	0	0	111.4	G323 T327 E328 N329	G323-D325 VanDerWaalsContact C-N 3.31Å; D325-T327 PolarHBondContact O-N 2.75Å; D325-T327 VanDerWaalsContact OD1-CB 3.28Å; D325-T327 WeakPolarHBondContact OD1-CB 2.9Å; D325-T327 PolarHBondContact OD1-N 2.9Å; D325-T327 PolarHBondContact OD1-OG1 3.4Å; D325-E328 HydrophobicContact CB-CB 4.37Å; D325-E328 HydrophobicContact CB-CG 4.48Å; D325-E328 WeakPolarHBondContact OD2-CG 3.22Å; D325-N329 PolarHBondContact O-N 2.83Å; D325-N329 PolarHBondContact O-ND2 3.24Å
326	M	85.3	Confident	88.2	Confident	95 Å²	95	45.5 Å²	45.5	47%	0.468	25%	0.247	S	C	.	.	H	α-helix	trans	-62.8	-28.8	178.7	-60.5	-163.2	-162.1	0	0	112.8	S324 L330 R355	S324-M326 PolarHBondContact O-N 2.89Å; M326-L330 WeakPolarHBondContact O-CB 3.43Å; M326-L330 WeakPolarHBondContact O-CD1 3.41Å; M326-L330 WeakPolarHBondContact O-CG 3.21Å; M326-L330 PolarHBondContact O-N 2.89Å; M326-R355 PolarHBondContact SD-NH1 2.94Å; M326-R355 VanDerWaalsContact SD-NH1 3.35Å
327	T	86.8	Confident	87.6	Confident	94 Å²	94	46.9 Å²	46.9	58%	0.577	25%	0.254	S	S	*	.	H	α-helix	trans	-68.1	-51.3	-177.4	-47.2	0	0	0	0	109.8	D325 N329 L330 R331	D325-T327 PolarHBondContact O-N 2.75Å; D325-T327 VanDerWaalsContact OD1-CB 3.28Å; D325-T327 WeakPolarHBondContact OD1-CB 2.9Å; D325-T327 PolarHBondContact OD1-N 2.9Å; D325-T327 PolarHBondContact OD1-OG1 3.4Å; T327-N329 PolarHBondContact O-N 3.44Å; T327-L330 PolarHBondContact O-N 3.25Å; T327-R331 WeakPolarHBondContact O-CG 3.2Å; T327-R331 PolarHBondContact O-N 2.98Å; T327-R331 VanDerWaalsContact O-N 3.11Å
328	E	86.6	Confident	87.2	Confident	43 Å²	43	55 Å²	55	20%	0.201	29%	0.285	C	S	.	.	H	α-helix	trans	-61.5	-42.6	176.6	-72.6	-61	109.6	0	0	111.9	F295 D325 L330 R331 I332	F295-E328 HydrophobicContact CD2-CB 4.25Å; F295-E328 HydrophobicContact CE2-CB 4.16Å; D325-E328 HydrophobicContact CB-CB 4.37Å; D325-E328 HydrophobicContact CB-CG 4.48Å; D325-E328 WeakPolarHBondContact OD2-CG 3.22Å; E328-L330 VanDerWaalsContact C-N 3.29Å; E328-L330 PolarHBondContact O-N 2.85Å; E328-R331 VanDerWaalsContact CD-NH1 3.31Å; E328-R331 WeakPolarHBondContact O-CB 3.47Å; E328-R331 PolarHBondContact O-N 3.49Å; E328-R331 VanDerWaalsContact OE1-CD 3.25Å; E328-R331 WeakPolarHBondContact OE1-CD 3.48Å; E328-R331 IonicContact OE1-CZ 3.79Å; E328-R331 IonicContact OE1-NE 3.37Å; E328-R331 IonicContact OE1-NH1 2.65Å; E328-R331 PolarHBondContact OE1-NH1 2.85Å; E328-R331 IonicContact OE2-NH1 3.85Å; E328-R331 PolarHBondContact OE2-NH1 3.07Å; E328-R331 VanDerWaalsContact OE2-NH1 3.14Å; E328-I332 PolarHBondContact O-N 3.08Å
329	N	88.6	Confident	86.7	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-59.5	-40.1	176.8	-66.1	-19.4	0	0	0	111.8	F295 F322 G323 D325 T327 I332 T333 Y356	F295-N329 WeakPolarHBondContact CZ-OD1 3.38Å; F322-N329 HydrophobicContact CD1-CB 3.81Å; F322-N329 HydrophobicContact CE1-CB 4.41Å; G323-N329 PolarHBondContact N-OD1 3.21Å; G323-N329 VanDerWaalsContact N-OD1 3.08Å; G323-N329 PolarHBondContact O-ND2 3Å; D325-N329 PolarHBondContact O-N 2.83Å; D325-N329 PolarHBondContact O-ND2 3.24Å; T327-N329 PolarHBondContact O-N 3.44Å; N329-I332 PolarHBondContact O-N 3.36Å; N329-T333 PolarHBondContact O-N 3.03Å; N329-T333 PolarHBondContact O-OG1 3.35Å; N329-Y356 HydrophobicContact CB-CD1 4.45Å; N329-Y356 HydrophobicContact CB-CE1 3.87Å; N329-Y356 HydrophobicContact CB-CE2 4.03Å; N329-Y356 WeakPolarHBondContact ND2-CE2 3.5Å
330	L	86.7	Confident	86.4	Confident	73 Å²	73	57.5 Å²	57.5	38%	0.382	30%	0.301	S	S	.	.	H	α-helix	trans	-68.8	-33.1	177.6	-76.4	168.3	0	0	0	113.1	M326 T327 E328 I332 T333 K334	M326-L330 WeakPolarHBondContact O-CB 3.43Å; M326-L330 WeakPolarHBondContact O-CD1 3.41Å; M326-L330 WeakPolarHBondContact O-CG 3.21Å; M326-L330 PolarHBondContact O-N 2.89Å; T327-L330 PolarHBondContact O-N 3.25Å; E328-L330 VanDerWaalsContact C-N 3.29Å; E328-L330 PolarHBondContact O-N 2.85Å; L330-I332 VanDerWaalsContact C-N 3.26Å; L330-I332 PolarHBondContact O-N 2.97Å; L330-T333 WeakPolarHBondContact CA-OG1 3.41Å; L330-T333 PolarHBondContact O-N 2.9Å; L330-T333 PolarHBondContact O-OG1 2.62Å; L330-K334 VanDerWaalsContact O-CB 3.29Å; L330-K334 WeakPolarHBondContact O-CB 3.27Å; L330-K334 VanDerWaalsContact O-CG 3.28Å; L330-K334 WeakPolarHBondContact O-CG 3.44Å; L330-K334 PolarHBondContact O-N 3.08Å
331	R	87.5	Confident	86.2	Confident	82 Å²	82	57.6 Å²	57.6	31%	0.309	30%	0.302	S	S	.	.	H	α-helix	trans	-62.3	-35.5	177.6	-68.5	173.7	68.5	-156.6	-3.9	111.9	T327 E328 G335 E336 L337	T327-R331 WeakPolarHBondContact O-CG 3.2Å; T327-R331 PolarHBondContact O-N 2.98Å; T327-R331 VanDerWaalsContact O-N 3.11Å; E328-R331 VanDerWaalsContact CD-NH1 3.31Å; E328-R331 WeakPolarHBondContact O-CB 3.47Å; E328-R331 PolarHBondContact O-N 3.49Å; E328-R331 VanDerWaalsContact OE1-CD 3.25Å; E328-R331 WeakPolarHBondContact OE1-CD 3.48Å; E328-R331 IonicContact OE1-CZ 3.79Å; E328-R331 IonicContact OE1-NE 3.37Å; E328-R331 IonicContact OE1-NH1 2.65Å; E328-R331 PolarHBondContact OE1-NH1 2.85Å; E328-R331 IonicContact OE2-NH1 3.85Å; E328-R331 PolarHBondContact OE2-NH1 3.07Å; E328-R331 VanDerWaalsContact OE2-NH1 3.14Å; R331-G335 PolarHBondContact O-N 2.86Å; R331-E336 HydrophobicContact CB-CB 4.35Å; R331-E336 IonicContact NE-OE2 3.3Å; R331-E336 WeakPolarHBondContact O-CB 3.4Å; R331-E336 PolarHBondContact O-N 2.82Å; R331-L337 HydrophobicContact CB-CD1 3.82Å; R331-L337 HydrophobicContact CB-CG 4.12Å; R331-L337 PolarHBondContact O-N 2.99Å; R331-L337 VanDerWaalsContact O-N 3.16Å
332	I	86.3	Confident	86.1	Confident	1 Å²	1	59.3 Å²	59.3	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-72.2	-49.2	174.9	-76.4	-173.7	0	0	0	111.9	F295 W299 F321 E328 N329 L330 K334 G335 L337 L369	F295-I332 HydrophobicContact CB-CD1 3.83Å; F295-I332 HydrophobicContact CD1-CD1 3.34Å; F295-I332 HydrophobicContact CD2-CD1 3.3Å; F295-I332 HydrophobicContact CD2-CG1 4.04Å; F295-I332 HydrophobicContact CE1-CD1 3.58Å; F295-I332 HydrophobicContact CE2-CD1 3.53Å; F295-I332 HydrophobicContact CE2-CG1 4.24Å; F295-I332 HydrophobicContact CG-CD1 3.19Å; F295-I332 HydrophobicContact CG-CG1 4.3Å; F295-I332 HydrophobicContact CZ-CD1 3.66Å; W299-I332 HydrophobicContact CH2-CD1 3.36Å; W299-I332 HydrophobicContact CH2-CG1 4.48Å; W299-I332 HydrophobicContact CZ2-CD1 3.65Å; W299-I332 HydrophobicContact CZ2-CG1 4.35Å; F321-I332 HydrophobicContact CE1-CD1 4.12Å; F321-I332 HydrophobicContact CE1-CG2 4.46Å; F321-I332 HydrophobicContact CZ-CD1 4.15Å; E328-I332 PolarHBondContact O-N 3.08Å; N329-I332 PolarHBondContact O-N 3.36Å; L330-I332 VanDerWaalsContact C-N 3.26Å; L330-I332 PolarHBondContact O-N 2.97Å; I332-K334 VanDerWaalsContact C-N 3.25Å; I332-K334 PolarHBondContact O-N 2.93Å; I332-G335 PolarHBondContact O-N 3.23Å; I332-L337 HydrophobicContact CG1-CB 3.66Å; I332-L337 HydrophobicContact CG1-CD1 3.93Å; I332-L337 HydrophobicContact CG1-CG 4.46Å; I332-L369 HydrophobicContact CG2-CD2 3.39Å
333	T	84.4	Confident	86.1	Confident	42 Å²	42	59.2 Å²	59.2	26%	0.258	31%	0.312	S	S	.	.	H	α-helix	trans	-67	-28.5	-176.4	56.3	0	0	0	0	112.3	F322 N329 L330 G335 Y356 I365	F322-T333 HydrophobicContact CE1-CG2 4.14Å; F322-T333 HydrophobicContact CZ-CG2 4.25Å; N329-T333 PolarHBondContact O-N 3.03Å; N329-T333 PolarHBondContact O-OG1 3.35Å; L330-T333 WeakPolarHBondContact CA-OG1 3.41Å; L330-T333 PolarHBondContact O-N 2.9Å; L330-T333 PolarHBondContact O-OG1 2.62Å; T333-G335 VanDerWaalsContact C-N 3.31Å; T333-Y356 HydrophobicContact CG2-CD1 4.22Å; T333-I365 HydrophobicContact CG2-CG2 3.82Å
334	K	84.5	Confident	86.4	Confident	145 Å²	145	60.5 Å²	60.5	63%	0.63	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-7.6	171.5	-68.7	177.9	179	179.9	0	114.2	L330 I332 E336	L330-K334 VanDerWaalsContact O-CB 3.29Å; L330-K334 WeakPolarHBondContact O-CB 3.27Å; L330-K334 VanDerWaalsContact O-CG 3.28Å; L330-K334 WeakPolarHBondContact O-CG 3.44Å; L330-K334 PolarHBondContact O-N 3.08Å; I332-K334 VanDerWaalsContact C-N 3.25Å; I332-K334 PolarHBondContact O-N 2.93Å; K334-E336 HydrophobicContact CB-CG 4.41Å
335	G	80.1	Confident	86.8	Confident	22 Å²	22	54.5 Å²	54.5	23%	0.227	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.3	16.2	179.4	0	0	0	0	0	115.4	R331 I332 T333	R331-G335 PolarHBondContact O-N 2.86Å; I332-G335 PolarHBondContact O-N 3.23Å; T333-G335 VanDerWaalsContact C-N 3.31Å
336	E	84.1	Confident	87.1	Confident	123 Å²	123	50.8 Å²	50.8	58%	0.575	25%	0.25	S	S	*	.	S	Bend	trans	-70.9	-40.2	172.9	-60.9	177	-164.1	0	0	110.9	R331 K334	R331-E336 HydrophobicContact CB-CB 4.35Å; R331-E336 IonicContact NE-OE2 3.3Å; R331-E336 WeakPolarHBondContact O-CB 3.4Å; R331-E336 PolarHBondContact O-N 2.82Å; K334-E336 HydrophobicContact CB-CG 4.41Å
337	L	82.4	Confident	87.3	Confident	28 Å²	28	46.3 Å²	46.3	15%	0.147	23%	0.228	C	C	.	.	S	Bend	trans	-96.9	114.7	171.7	-74.4	171.1	0	0	0	109.6	R331 I332	R331-L337 HydrophobicContact CB-CD1 3.82Å; R331-L337 HydrophobicContact CB-CG 4.12Å; R331-L337 PolarHBondContact O-N 2.99Å; R331-L337 VanDerWaalsContact O-N 3.16Å; I332-L337 HydrophobicContact CG1-CB 3.66Å; I332-L337 HydrophobicContact CG1-CD1 3.93Å; I332-L337 HydrophobicContact CG1-CG 4.46Å
338	R	84.8	Confident	87.4	Confident	170 Å²	170	42 Å²	42	64%	0.642	20%	0.202	S	C	*	.			trans	-102.5	128.9	-175.1	-64	-174.5	-178.9	-173.4	-0.2	111.3	W299 H367	W299-R338 VanDerWaalsContact CD1-O 3.27Å; W299-R338 PolarHBondContact NE1-O 3.49Å; R338-H367 HydrophobicContact CB-CB 4.33Å; R338-H367 HydrophobicContact CG-CB 4.1Å
339	C	84	Confident	87.5	Confident	4 Å²	4	40.4 Å²	40.4	3%	0.027	20%	0.195	C	C	.	.			trans	-70.2	129	174.8	-64.9	0	0	0	0	110.6	W299 L341 H367 N368	W299-C339 WeakPolarHBondContact CZ2-SG 3.49Å; C339-L341 PolarHBondContact O-N 3.33Å; C339-H367 WeakPolarHBondContact CB-O 3.2Å; C339-H367 PolarHBondContact N-O 3.34Å; C339-N368 HydrophobicContact CB-CB 3.84Å; C339-N368 PolarHBondContact O-ND2 3.21Å
340	P	84.1	Confident	87.3	Confident	51 Å²	51	45.6 Å²	45.6	33%	0.331	22%	0.218	S	C	.	.	S	Bend	trans	-70.4	-22	-176.4	27.4	-35.1	0	0	0	112.6	M302 L306	M302-P340 HydrophobicContact CB-CG 4.22Å; M302-P340 HydrophobicContact CE-CG 4.27Å; L306-P340 HydrophobicContact CD1-CB 4.18Å
341	L	86.9	Confident	87.2	Confident	7 Å²	7	45.9 Å²	45.9	4%	0.037	22%	0.224	C	C	.	.	S	Bend	trans	-143.2	163	176.8	65.2	108.4	0	0	0	110.4	M302 L306 F312 M314 M315 C339 T343	M302-L341 HydrophobicContact CB-CD2 4.09Å; M302-L341 HydrophobicContact CE-CD1 3.68Å; M302-L341 HydrophobicContact CE-CD2 3.27Å; M302-L341 HydrophobicContact CE-CG 3.25Å; M302-L341 HydrophobicContact CG-CD2 4.41Å; L306-L341 HydrophobicContact CD1-CD2 3.73Å; L306-L341 HydrophobicContact CD2-CD2 4.21Å; L306-L341 HydrophobicContact CG-CD2 4.05Å; F312-L341 HydrophobicContact CD1-CD1 3.84Å; F312-L341 HydrophobicContact CD1-CD2 3.83Å; F312-L341 HydrophobicContact CD1-CG 4.45Å; F312-L341 HydrophobicContact CE1-CD1 3.85Å; F312-L341 HydrophobicContact CE1-CD2 4.07Å; M314-L341 VanDerWaalsContact C-CD1 3.46Å; M315-L341 HydrophobicContact CB-CD1 3.74Å; M315-L341 VanDerWaalsContact N-CD1 3.29Å; C339-L341 PolarHBondContact O-N 3.33Å; L341-T343 PolarHBondContact O-N 3.06Å; L341-T343 VanDerWaalsContact O-N 3.12Å; L341-T343 PolarHBondContact O-OG1 3.34Å
342	P	90.7	Very high	87.1	Confident	36 Å²	36	47.5 Å²	47.5	23%	0.234	24%	0.235	C	C	.	.			trans	-59.8	114	179.4	-23.5	34.9	0	0	0	111.9	M314 M315 Y344	M314-P342 WeakPolarHBondContact CA-O 3.48Å; M315-P342 PolarHBondContact N-O 3.3Å; P342-Y344 HydrophobicContact CB-CE2 4.19Å
343	T	92.7	Very high	87.1	Confident	3 Å²	3	47.8 Å²	47.8	2%	0.018	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	117.2	179.5	-57.7	0	0	0	0	109.2	M315 V317 L341 I345 N368 L369 I370	M315-T343 HydrophobicContact CB-CG2 4.17Å; M315-T343 HydrophobicContact CG-CG2 4.19Å; M315-T343 CarbonylContact O-C 3.48Å; M315-T343 WeakPolarHBondContact O-CA 3.18Å; V317-T343 HydrophobicContact CG2-CG2 3.68Å; L341-T343 PolarHBondContact O-N 3.06Å; L341-T343 VanDerWaalsContact O-N 3.12Å; L341-T343 PolarHBondContact O-OG1 3.34Å; T343-I345 HydrophobicContact CG2-CG2 4.09Å; T343-N368 PolarHBondContact N-O 3.48Å; T343-L369 HydrophobicContact CG2-CD1 4.07Å; T343-I370 PolarHBondContact O-N 3.49Å
344	Y	94.1	Very high	87.1	Confident	45 Å²	45	46.2 Å²	46.2	18%	0.176	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	127.5	177.2	-59.9	-89.6	0	0	0	109.6	M314 M315 L316 V317 P342 I370 L372 F378	M314-Y344 HydrophobicContact CB-CD2 4.18Å; M314-Y344 HydrophobicContact CB-CE2 3.83Å; M314-Y344 HydrophobicContact CE-CD2 3.96Å; M314-Y344 HydrophobicContact CE-CE2 4.06Å; M314-Y344 HydrophobicContact SD-CE2 4.23Å; M315-Y344 PolarHBondContact O-N 2.85Å; L316-Y344 CarbonylContact C-O 3.5Å; L316-Y344 HydrophobicContact CD2-CD2 4.08Å; L316-Y344 HydrophobicContact CD2-CG 4.26Å; V317-Y344 PolarHBondContact N-O 3.16Å; P342-Y344 HydrophobicContact CB-CE2 4.19Å; Y344-I370 CarbonylContact C-O 3.57Å; Y344-I370 VanDerWaalsContact CA-O 3.28Å; Y344-I370 WeakPolarHBondContact CA-O 3.29Å; Y344-I370 HydrophobicContact CD1-CB 3.87Å; Y344-I370 HydrophobicContact CD1-CD1 3.97Å; Y344-I370 HydrophobicContact CD1-CG2 3.93Å; Y344-I370 HydrophobicContact CE1-CB 4.19Å; Y344-I370 HydrophobicContact CE1-CD1 3.47Å; Y344-I370 VanDerWaalsContact CE1-CD1 3.47Å; Y344-I370 HydrophobicContact CE1-CG1 4.46Å; Y344-I370 HydrophobicContact CE1-CG2 4.13Å; Y344-L372 HydrophobicContact CD1-CD2 3.52Å; Y344-L372 HydrophobicContact CD1-CG 4.37Å; Y344-L372 HydrophobicContact CE1-CD2 4.39Å; Y344-L372 HydrophobicContact CG-CD2 4.12Å; Y344-F378 HydrophobicContact CD1-CZ 4.2Å; Y344-F378 HydrophobicContact CD2-CZ 4.47Å; Y344-F378 HydrophobicContact CE1-CE2 4.22Å; Y344-F378 HydrophobicContact CE1-CZ 4.31Å; Y344-F378 HydrophobicContact CG-CZ 4.26Å
345	I	94.5	Very high	87.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.7	-177.2	69.9	174.9	0	0	0	110.9	V317 F321 F322 T343 Y357 I365 L369 I370 L372	V317-I345 HydrophobicContact CB-CB 4.38Å; V317-I345 HydrophobicContact CB-CG2 3.93Å; V317-I345 HydrophobicContact CG2-CG2 3.93Å; F321-I345 HydrophobicContact CB-CB 4.49Å; F321-I345 HydrophobicContact CB-CD1 4.22Å; F321-I345 HydrophobicContact CB-CG2 4.4Å; F321-I345 HydrophobicContact CD1-CD1 3.98Å; F321-I345 HydrophobicContact CD2-CG2 3.71Å; F321-I345 HydrophobicContact CE2-CG2 4.06Å; F321-I345 HydrophobicContact CG-CD1 4.09Å; F321-I345 HydrophobicContact CG-CG2 3.99Å; F322-I345 HydrophobicContact CE2-CD1 4.38Å; T343-I345 HydrophobicContact CG2-CG2 4.09Å; I345-Y357 HydrophobicContact CD1-CE1 3.76Å; I345-Y357 HydrophobicContact CG1-CE1 4.28Å; I345-I365 HydrophobicContact CD1-CD1 4.04Å; I345-L369 HydrophobicContact CD1-CD1 4.23Å; I345-L369 HydrophobicContact CD1-CG 4.37Å; I345-L369 HydrophobicContact CG2-CD1 3.6Å; I345-I370 PolarHBondContact N-O 3.28Å; I345-L372 PolarHBondContact O-N 3.05Å
346	L	94	Very high	87.4	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.005	22%	0.218	C	C	.	.			trans	-74.9	171.7	166.4	-63.9	-173.8	0	0	0	111.1	V317 C318 Y357 L372 Y388 L427 S429	V317-L346 PolarHBondContact O-N 3.01Å; C318-L346 HydrophobicContact CB-CD1 4.36Å; L346-Y357 WeakPolarHBondContact O-CE1 3.39Å; L346-Y357 PolarHBondContact O-OH 3.24Å; L346-L372 HydrophobicContact CD2-CD1 4.22Å; L346-Y388 HydrophobicContact CD2-CG 4.43Å; L346-L427 HydrophobicContact CD1-CB 4.43Å; L346-L427 HydrophobicContact CD2-CB 4.29Å; L346-S429 WeakPolarHBondContact CD1-OG 3.31Å
347	G	89.5	Confident	87.5	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.01	20%	0.195	C	C	.	.			trans	-76	175.9	-178.6	0	0	0	0	0	113.5	Y371 S390	G347-Y371 VanDerWaalsContact N-CE2 3.31Å; G347-S390 VanDerWaalsContact N-CB 3.3Å; G347-S390 PolarHBondContact N-OG 3.29Å
348	P	89.6	Confident	86.8	Confident	3 Å²	3	45 Å²	45	2%	0.019	22%	0.222	C	C	.	.			trans	-64	142.1	-178.1	29	-34.9	0	0	0	110.9	A353 A354 Y357 F400	P348-A353 HydrophobicContact CB-CB 4.05Å; P348-A354 HydrophobicContact CB-CB 4.21Å; P348-A354 HydrophobicContact CG-CB 4.07Å; P348-Y357 HydrophobicContact CB-CD2 3.83Å; P348-Y357 HydrophobicContact CB-CE2 3.66Å; P348-Y357 HydrophobicContact CG-CD2 3.89Å; P348-Y357 HydrophobicContact CG-CE2 4.15Å; P348-Y357 HydrophobicContact CG-CG 4.42Å; P348-F400 HydrophobicContact CG-CB 4.48Å; P348-F400 WeakPolarHBondContact O-CA 3.34Å; P348-F400 WeakPolarHBondContact O-CB 3.47Å
349	V	87.6	Confident	86.2	Confident	11 Å²	11	40.8 Å²	40.8	7%	0.067	21%	0.212	C	C	.	.	S	Bend	trans	-103.9	-22.3	169.8	179.8	0	0	0	0	110.5	E320 F392	E320-V349 PolarHBondContact OE2-N 3.34Å; E320-V349 VanDerWaalsContact OE2-N 3.11Å; V349-F392 HydrophobicContact CB-CE2 4.46Å; V349-F392 HydrophobicContact CG1-CD1 4.47Å; V349-F392 HydrophobicContact CG1-CD2 3.45Å; V349-F392 VanDerWaalsContact CG1-CD2 3.45Å; V349-F392 HydrophobicContact CG1-CE1 4.09Å; V349-F392 HydrophobicContact CG1-CE2 2.96Å; V349-F392 HydrophobicContact CG1-CG 4.2Å; V349-F392 HydrophobicContact CG1-CZ 3.32Å
350	K	85.6	Confident	85.7	Confident	109 Å²	109	44.8 Å²	44.8	47%	0.474	24%	0.236	S	C	.	.	S	Bend	trans	-113.8	144.3	177.4	-62.5	179.9	-179.6	177.9	0	111.8	E352 A353 A354	K350-E352 WeakPolarHBondContact CB-OE2 3.48Å; K350-E352 PolarHBondContact O-N 3.13Å; K350-A353 PolarHBondContact O-N 3.13Å; K350-A353 VanDerWaalsContact O-N 3.09Å; K350-A354 PolarHBondContact O-N 2.97Å
351	P	84.7	Confident	85.2	Confident	79 Å²	79	46.1 Å²	46.1	51%	0.513	25%	0.252	S	S	.	.	H	α-helix	trans	-56.7	-34.2	176	-22.4	30.9	0	0	0	113.2	A353 A354 F400	P351-A353 PolarHBondContact O-N 3.14Å; P351-A354 WeakPolarHBondContact O-CB 3.36Å; P351-A354 PolarHBondContact O-N 3.39Å; P351-F400 HydrophobicContact CB-CE1 4.29Å; P351-F400 HydrophobicContact CB-CZ 4.32Å; P351-F400 HydrophobicContact CG-CE1 4.13Å; P351-F400 HydrophobicContact CG-CE2 3.9Å; P351-F400 HydrophobicContact CG-CZ 3.73Å
352	E	84.9	Confident	85	Confident	117 Å²	117	46.2 Å²	46.2	55%	0.547	25%	0.254	S	S	.	.	H	α-helix	trans	-68	-25.5	-178.6	-53.1	95.2	-167.5	0	0	113.1	K350 R355	K350-E352 WeakPolarHBondContact CB-OE2 3.48Å; K350-E352 PolarHBondContact O-N 3.13Å; E352-R355 PolarHBondContact O-NE 3.43Å; E352-R355 PolarHBondContact O-NH2 3.45Å
353	A	85.5	Confident	84.7	Confident	7 Å²	7	45.9 Å²	45.9	6%	0.058	26%	0.257	C	S	.	.	H	α-helix	trans	-82.1	-25.9	179.5	0	0	0	0	0	111.8	F322 P348 K350 P351 R355 Y356 Y357	F322-A353 HydrophobicContact CB-CB 4.46Å; P348-A353 HydrophobicContact CB-CB 4.05Å; K350-A353 PolarHBondContact O-N 3.13Å; K350-A353 VanDerWaalsContact O-N 3.09Å; P351-A353 PolarHBondContact O-N 3.14Å; A353-R355 PolarHBondContact O-N 2.84Å; A353-R355 VanDerWaalsContact O-N 3.11Å; A353-Y356 WeakPolarHBondContact O-CD2 3.29Å; A353-Y356 PolarHBondContact O-N 2.94Å; A353-Y357 HydrophobicContact CB-CE2 4.22Å; A353-Y357 WeakPolarHBondContact O-CD2 3.31Å; A353-Y357 WeakPolarHBondContact O-CE2 2.95Å
354	A	85	Confident	84.5	Confident	9 Å²	9	50 Å²	50	7%	0.074	28%	0.276	C	S	.	.	H	α-helix	trans	-54.1	-36.4	-173.6	0	0	0	0	0	113.8	P348 K350 P351 Y356 Y357 E399	P348-A354 HydrophobicContact CB-CB 4.21Å; P348-A354 HydrophobicContact CG-CB 4.07Å; K350-A354 PolarHBondContact O-N 2.97Å; P351-A354 WeakPolarHBondContact O-CB 3.36Å; P351-A354 PolarHBondContact O-N 3.39Å; A354-Y356 PolarHBondContact O-N 2.89Å; A354-Y357 PolarHBondContact O-N 3.43Å; A354-E399 WeakPolarHBondContact CB-OE2 3.44Å
355	R	86.5	Confident	84.1	Confident	142 Å²	142	48.8 Å²	48.8	54%	0.536	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.5	177.3	70.1	-177.1	131.2	-176.3	-4.2	115.4	M326 E352 A353	M326-R355 PolarHBondContact SD-NH1 2.94Å; M326-R355 VanDerWaalsContact SD-NH1 3.35Å; E352-R355 PolarHBondContact O-NE 3.43Å; E352-R355 PolarHBondContact O-NH2 3.45Å; A353-R355 PolarHBondContact O-N 2.84Å; A353-R355 VanDerWaalsContact O-N 3.11Å
356	Y	85.2	Confident	83.6	Confident	22 Å²	22	49.3 Å²	49.3	9%	0.086	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-8.9	-179.7	-56.3	-64.6	0	0	0	112.7	F322 N329 T333 A353 A354	F322-Y356 HydrophobicContact CB-CD2 4.09Å; F322-Y356 HydrophobicContact CB-CE2 4.47Å; F322-Y356 HydrophobicContact CD1-CD2 4.06Å; F322-Y356 HydrophobicContact CD1-CG 4.16Å; F322-Y356 HydrophobicContact CD2-CD2 4.1Å; F322-Y356 HydrophobicContact CD2-CG 4.31Å; F322-Y356 HydrophobicContact CE1-CG 4.19Å; F322-Y356 HydrophobicContact CE2-CG 4.35Å; F322-Y356 AromaticContact CG-CD2 3.81Å; F322-Y356 HydrophobicContact CG-CD2 3.81Å; F322-Y356 HydrophobicContact CG-CG 4.22Å; F322-Y356 HydrophobicContact CZ-CG 4.29Å; N329-Y356 HydrophobicContact CB-CD1 4.45Å; N329-Y356 HydrophobicContact CB-CE1 3.87Å; N329-Y356 HydrophobicContact CB-CE2 4.03Å; N329-Y356 WeakPolarHBondContact ND2-CE2 3.5Å; T333-Y356 HydrophobicContact CG2-CD1 4.22Å; A353-Y356 WeakPolarHBondContact O-CD2 3.29Å; A353-Y356 PolarHBondContact O-N 2.94Å; A354-Y356 PolarHBondContact O-N 2.89Å
357	Y	86.1	Confident	83.2	Confident	22 Å²	22	53.2 Å²	53.2	9%	0.086	30%	0.296	C	S	.	.			trans	-101.6	96.7	178.6	-60.5	-92	0	0	0	109.1	F322 I345 L346 P348 A353 A354 N359 I365 Y371	F322-Y357 AromaticContact CD2-CE2 3.67Å; F322-Y357 HydrophobicContact CD2-CE2 3.67Å; F322-Y357 AromaticContact CD2-CZ 3.71Å; F322-Y357 HydrophobicContact CE2-CD2 4.43Å; F322-Y357 HydrophobicContact CE2-CE1 4.18Å; F322-Y357 AromaticContact CE2-CE2 3.82Å; F322-Y357 HydrophobicContact CE2-CE2 3.82Å; F322-Y357 AromaticContact CE2-CZ 3.69Å; I345-Y357 HydrophobicContact CD1-CE1 3.76Å; I345-Y357 HydrophobicContact CG1-CE1 4.28Å; L346-Y357 WeakPolarHBondContact O-CE1 3.39Å; L346-Y357 PolarHBondContact O-OH 3.24Å; P348-Y357 HydrophobicContact CB-CD2 3.83Å; P348-Y357 HydrophobicContact CB-CE2 3.66Å; P348-Y357 HydrophobicContact CG-CD2 3.89Å; P348-Y357 HydrophobicContact CG-CE2 4.15Å; P348-Y357 HydrophobicContact CG-CG 4.42Å; A353-Y357 HydrophobicContact CB-CE2 4.22Å; A353-Y357 WeakPolarHBondContact O-CD2 3.31Å; A353-Y357 WeakPolarHBondContact O-CE2 2.95Å; A354-Y357 PolarHBondContact O-N 3.43Å; Y357-N359 VanDerWaalsContact C-N 3.32Å; Y357-N359 PolarHBondContact O-N 2.97Å; Y357-I365 HydrophobicContact CD1-CD1 3.69Å; Y357-I365 HydrophobicContact CE1-CD1 4.1Å; Y357-I365 HydrophobicContact CG-CD1 4.39Å; Y357-Y371 AromaticContact CD1-CD1 3.77Å; Y357-Y371 HydrophobicContact CD1-CD1 3.77Å; Y357-Y371 AromaticContact CD1-CD2 3.82Å; Y357-Y371 HydrophobicContact CD1-CD2 3.82Å; Y357-Y371 HydrophobicContact CD1-CE1 4.02Å; Y357-Y371 HydrophobicContact CD1-CE2 4.15Å; Y357-Y371 AromaticContact CD1-CG 3.65Å; Y357-Y371 HydrophobicContact CD1-CG 3.65Å; Y357-Y371 HydrophobicContact CE1-CD2 4.02Å; Y357-Y371 HydrophobicContact CE1-CE2 4.45Å; Y357-Y371 HydrophobicContact CE1-CG 4.21Å
358	C	67.3	Low	83.1	Confident	107 Å²	107	54.4 Å²	54.4	72%	0.723	30%	0.302	S	S	*	.			trans	-73.3	-16.7	-170.7	56.9	0	0	0	0	115.3
359	N	72.5	Confident	83.1	Confident	81 Å²	81	54.3 Å²	54.3	43%	0.433	30%	0.301	S	S	.	.			trans	-144	121.8	-176.5	-176.2	9.3	0	0	0	111.6	Y357 A361 G362 Y371	Y357-N359 VanDerWaalsContact C-N 3.32Å; Y357-N359 PolarHBondContact O-N 2.97Å; N359-A361 PolarHBondContact O-N 3Å; N359-A361 PolarHBondContact OD1-N 3.21Å; N359-A361 VanDerWaalsContact OD1-N 3.12Å; N359-G362 PolarHBondContact ND2-O 2.91Å; N359-G362 PolarHBondContact O-N 3.28Å; N359-Y371 WeakPolarHBondContact O-CD1 3.12Å; N359-Y371 WeakPolarHBondContact O-CE1 3.49Å
360	V	73.2	Confident	83.3	Confident	87 Å²	87	55.1 Å²	55.1	53%	0.527	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.6	178.2	-174.6	0	0	0	0	112.3	G362 K374	V360-G362 PolarHBondContact O-N 3.46Å; V360-K374 PolarHBondContact O-N 2.95Å
361	A	73.9	Confident	83.7	Confident	80 Å²	80	50.4 Å²	50.4	66%	0.661	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-2	179.3	0	0	0	0	0	114.2	N359	N359-A361 PolarHBondContact O-N 3Å; N359-A361 PolarHBondContact OD1-N 3.21Å; N359-A361 VanDerWaalsContact OD1-N 3.12Å
362	G	82.6	Confident	84	Confident	9 Å²	9	47.3 Å²	47.3	9%	0.093	26%	0.263	C	S	.	.			trans	92.8	170.3	-172.7	0	0	0	0	0	113.1	N359 V360 Y371	N359-G362 PolarHBondContact ND2-O 2.91Å; N359-G362 PolarHBondContact O-N 3.28Å; V360-G362 PolarHBondContact O-N 3.46Å; G362-Y371 CarbonylContact C-O 3.53Å; G362-Y371 WeakPolarHBondContact CA-O 3.03Å
363	G	84.5	Confident	84.3	Confident	28 Å²	28	41.8 Å²	41.8	29%	0.289	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	159.8	171.5	-178.6	0	0	0	0	0	113.8	I365 Y371	G363-I365 PolarHBondContact O-N 3.12Å; G363-Y371 PolarHBondContact N-O 2.93Å; G363-Y371 PolarHBondContact O-N 3.42Å
364	E	87.4	Confident	84.6	Confident	89 Å²	89	42.3 Å²	42.3	42%	0.416	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	118.2	172.8	-170.5	166.6	-166.5	0	0	109.4	G366 N368 L369	E364-G366 WeakPolarHBondContact CG-O 3.48Å; E364-N368 PolarHBondContact OE1-N 2.88Å; E364-L369 WeakPolarHBondContact CA-O 3.3Å
365	I	86.7	Confident	84.9	Confident	20 Å²	20	44.9 Å²	44.9	10%	0.103	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-31.7	178.7	-66.5	173	0	0	0	110.7	F322 T333 I345 Y357 G363 L369 Y371	F322-I365 HydrophobicContact CZ-CG2 4.27Å; T333-I365 HydrophobicContact CG2-CG2 3.82Å; I345-I365 HydrophobicContact CD1-CD1 4.04Å; Y357-I365 HydrophobicContact CD1-CD1 3.69Å; Y357-I365 HydrophobicContact CE1-CD1 4.1Å; Y357-I365 HydrophobicContact CG-CD1 4.39Å; G363-I365 PolarHBondContact O-N 3.12Å; I365-L369 HydrophobicContact CB-CD2 4.42Å; I365-L369 HydrophobicContact CG2-CD2 4.43Å; I365-L369 PolarHBondContact N-O 3.48Å; I365-Y371 HydrophobicContact CD1-CG 4.35Å
366	G	82.9	Confident	85.2	Confident	11 Å²	11	38.9 Å²	38.9	11%	0.113	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	179.4	179.6	0	0	0	0	0	110.6	E364 N368 L369	E364-G366 WeakPolarHBondContact CG-O 3.48Å; G366-N368 PolarHBondContact O-N 3.38Å; G366-L369 PolarHBondContact N-O 3.42Å; G366-L369 PolarHBondContact O-N 3.17Å
367	H	85	Confident	85.5	Confident	83 Å²	83	40.2 Å²	40.2	38%	0.384	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	114.2	-175.7	177.5	-81	0	0	0	111.9	R338 C339 L369	R338-H367 HydrophobicContact CB-CB 4.33Å; R338-H367 HydrophobicContact CG-CB 4.1Å; C339-H367 WeakPolarHBondContact CB-O 3.2Å; C339-H367 PolarHBondContact N-O 3.34Å; H367-L369 PolarHBondContact O-N 3.44Å
368	N	87.9	Confident	85.7	Confident	26 Å²	26	41 Å²	41	14%	0.139	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	20.5	-175.4	-73.3	-25.1	0	0	0	114.5	C339 T343 E364 G366 R764	C339-N368 HydrophobicContact CB-CB 3.84Å; C339-N368 PolarHBondContact O-ND2 3.21Å; T343-N368 PolarHBondContact N-O 3.48Å; E364-N368 PolarHBondContact OE1-N 2.88Å; G366-N368 PolarHBondContact O-N 3.38Å; N368-R764 PolarHBondContact OD1-NH1 3.41Å; N368-R764 VanDerWaalsContact OD1-NH1 3.08Å
369	L	90.7	Very high	86.8	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	113.3	176.5	-176.3	67.9	0	0	0	110	F321 I332 T343 I345 E364 I365 G366 H367	F321-L369 HydrophobicContact CD1-CD2 4.42Å; F321-L369 HydrophobicContact CE1-CD1 3.92Å; F321-L369 HydrophobicContact CE1-CD2 3.53Å; F321-L369 HydrophobicContact CE1-CG 4.37Å; F321-L369 HydrophobicContact CE2-CD1 3.99Å; F321-L369 HydrophobicContact CZ-CD1 3.52Å; F321-L369 HydrophobicContact CZ-CD2 3.85Å; F321-L369 HydrophobicContact CZ-CG 4.36Å; I332-L369 HydrophobicContact CG2-CD2 3.39Å; T343-L369 HydrophobicContact CG2-CD1 4.07Å; I345-L369 HydrophobicContact CD1-CD1 4.23Å; I345-L369 HydrophobicContact CD1-CG 4.37Å; I345-L369 HydrophobicContact CG2-CD1 3.6Å; E364-L369 WeakPolarHBondContact CA-O 3.3Å; I365-L369 HydrophobicContact CB-CD2 4.42Å; I365-L369 HydrophobicContact CG2-CD2 4.43Å; I365-L369 PolarHBondContact N-O 3.48Å; G366-L369 PolarHBondContact N-O 3.42Å; G366-L369 PolarHBondContact O-N 3.17Å; H367-L369 PolarHBondContact O-N 3.44Å
370	I	92.2	Very high	87.3	Confident	28 Å²	28	35 Å²	35	14%	0.144	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	117.1	-168.3	-54.7	161.3	0	0	0	109	T343 Y344 I345	T343-I370 PolarHBondContact O-N 3.49Å; Y344-I370 CarbonylContact C-O 3.57Å; Y344-I370 VanDerWaalsContact CA-O 3.28Å; Y344-I370 WeakPolarHBondContact CA-O 3.29Å; Y344-I370 HydrophobicContact CD1-CB 3.87Å; Y344-I370 HydrophobicContact CD1-CD1 3.97Å; Y344-I370 HydrophobicContact CD1-CG2 3.93Å; Y344-I370 HydrophobicContact CE1-CB 4.19Å; Y344-I370 HydrophobicContact CE1-CD1 3.47Å; Y344-I370 VanDerWaalsContact CE1-CD1 3.47Å; Y344-I370 HydrophobicContact CE1-CG1 4.46Å; Y344-I370 HydrophobicContact CE1-CG2 4.13Å; I345-I370 PolarHBondContact N-O 3.28Å
371	Y	93.2	Very high	87.6	Confident	11 Å²	11	36.1 Å²	36.1	4%	0.043	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	124	167.1	169.4	-140.6	0	0	0	109.8	G347 Y357 N359 G362 G363 I365 G373 K374	G347-Y371 VanDerWaalsContact N-CE2 3.31Å; Y357-Y371 AromaticContact CD1-CD1 3.77Å; Y357-Y371 HydrophobicContact CD1-CD1 3.77Å; Y357-Y371 AromaticContact CD1-CD2 3.82Å; Y357-Y371 HydrophobicContact CD1-CD2 3.82Å; Y357-Y371 HydrophobicContact CD1-CE1 4.02Å; Y357-Y371 HydrophobicContact CD1-CE2 4.15Å; Y357-Y371 AromaticContact CD1-CG 3.65Å; Y357-Y371 HydrophobicContact CD1-CG 3.65Å; Y357-Y371 HydrophobicContact CE1-CD2 4.02Å; Y357-Y371 HydrophobicContact CE1-CE2 4.45Å; Y357-Y371 HydrophobicContact CE1-CG 4.21Å; N359-Y371 WeakPolarHBondContact O-CD1 3.12Å; N359-Y371 WeakPolarHBondContact O-CE1 3.49Å; G362-Y371 CarbonylContact C-O 3.53Å; G362-Y371 WeakPolarHBondContact CA-O 3.03Å; G363-Y371 PolarHBondContact N-O 2.93Å; G363-Y371 PolarHBondContact O-N 3.42Å; I365-Y371 HydrophobicContact CD1-CG 4.35Å; Y371-G373 VanDerWaalsContact C-N 3.27Å; Y371-G373 VanDerWaalsContact CD2-N 3.27Å; Y371-G373 VanDerWaalsContact CE2-C 3.44Å; Y371-G373 WeakPolarHBondContact CE2-O 3.45Å; Y371-G373 VanDerWaalsContact CZ-C 3.44Å; Y371-G373 PolarHBondContact O-N 3.42Å; Y371-G373 VanDerWaalsContact OH-C 3.23Å; Y371-K374 PolarHBondContact OH-N 3.19Å
372	L	92	Very high	88	Confident	13 Å²	13	33.4 Å²	33.4	7%	0.068	20%	0.2	C	C	.	.			trans	-70.2	-23.4	-178.7	-69.3	176.1	0	0	0	113.2	Y344 I345 L346 F378 Y388 L427	Y344-L372 HydrophobicContact CD1-CD2 3.52Å; Y344-L372 HydrophobicContact CD1-CG 4.37Å; Y344-L372 HydrophobicContact CE1-CD2 4.39Å; Y344-L372 HydrophobicContact CG-CD2 4.12Å; I345-L372 PolarHBondContact O-N 3.05Å; L346-L372 HydrophobicContact CD2-CD1 4.22Å; L372-F378 HydrophobicContact CD1-CD1 4.49Å; L372-F378 HydrophobicContact CD1-CE1 3.88Å; L372-F378 HydrophobicContact CD2-CD1 3.54Å; L372-F378 HydrophobicContact CD2-CE1 3.34Å; L372-F378 HydrophobicContact CD2-CG 4.39Å; L372-F378 HydrophobicContact CD2-CZ 4.08Å; L372-F378 HydrophobicContact CG-CE1 4.28Å; L372-Y388 VanDerWaalsContact C-CE2 3.48Å; L372-Y388 HydrophobicContact CB-CD1 4.12Å; L372-Y388 HydrophobicContact CB-CD2 3.66Å; L372-Y388 HydrophobicContact CB-CE1 4.09Å; L372-Y388 HydrophobicContact CB-CE2 3.61Å; L372-Y388 HydrophobicContact CB-CG 3.92Å; L372-Y388 HydrophobicContact CD1-CD1 4Å; L372-Y388 HydrophobicContact CD1-CD2 4.48Å; L372-Y388 HydrophobicContact CD1-CG 3.94Å; L372-Y388 HydrophobicContact CD2-CE1 4.45Å; L372-Y388 HydrophobicContact CG-CD1 4.47Å; L372-Y388 WeakPolarHBondContact O-CE2 3.49Å; L372-Y388 PolarHBondContact O-OH 3.22Å; L372-L427 HydrophobicContact CD1-CD1 4.19Å
373	G	90.6	Very high	88.1	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.01	20%	0.201	C	C	.	.			trans	100.6	176.1	-170.9	0	0	0	0	0	112.1	Y371 Y388 S390	Y371-G373 VanDerWaalsContact C-N 3.27Å; Y371-G373 VanDerWaalsContact CD2-N 3.27Å; Y371-G373 VanDerWaalsContact CE2-C 3.44Å; Y371-G373 WeakPolarHBondContact CE2-O 3.45Å; Y371-G373 VanDerWaalsContact CZ-C 3.44Å; Y371-G373 PolarHBondContact O-N 3.42Å; Y371-G373 VanDerWaalsContact OH-C 3.23Å; G373-Y388 WeakPolarHBondContact O-CE2 3.1Å; G373-S390 PolarHBondContact O-OG 3.42Å
374	K	90.7	Very high	88.2	Confident	18 Å²	18	32.2 Å²	32.2	8%	0.078	19%	0.188	C	C	.	.	S	Bend	trans	-66.3	-43.4	-175.3	-173.7	175	-177	-177.8	0	113.2	V360 Y371 S390 E397 D398 H401	V360-K374 PolarHBondContact O-N 2.95Å; Y371-K374 PolarHBondContact OH-N 3.19Å; K374-S390 WeakPolarHBondContact O-CB 3.43Å; K374-S390 PolarHBondContact O-N 3.36Å; K374-E397 IonicContact NZ-OE1 3.32Å; K374-E397 PolarHBondContact NZ-OE1 2.85Å; K374-D398 WeakPolarHBondContact CE-O 3.41Å; K374-D398 PolarHBondContact NZ-O 3.07Å; K374-H401 WeakPolarHBondContact CE-O 3.32Å; K374-H401 PolarHBondContact NZ-O 3.01Å
375	K	92.5	Very high	88.5	Confident	64 Å²	64	29 Å²	29	28%	0.278	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	153.1	177.1	72.4	-173.6	-178.6	-175.8	0	110.2	Y388 L389 T406 L410	K375-Y388 WeakPolarHBondContact CA-O 3.42Å; K375-L389 HydrophobicContact CB-CD1 4.08Å; K375-T406 HydrophobicContact CD-CG2 3.47Å; K375-T406 VanDerWaalsContact CD-CG2 3.47Å; K375-T406 WeakPolarHBondContact CD-O 3.35Å; K375-T406 PolarHBondContact NZ-O 3.2Å; K375-L410 HydrophobicContact CB-CD2 4.34Å; K375-L410 HydrophobicContact CD-CB 4.45Å
376	G	92	Very high	88.8	Confident	15 Å²	15	28.1 Å²	28.1	16%	0.155	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	159	-164.2	172.1	0	0	0	0	0	112.2	A387 Y388	G376-A387 WeakPolarHBondContact O-CA 3.45Å; G376-Y388 PolarHBondContact N-O 3.24Å; G376-Y388 VanDerWaalsContact N-O 3.14Å; G376-Y388 WeakPolarHBondContact O-CD1 3.45Å; G376-Y388 PolarHBondContact O-N 3.06Å
377	M	92.1	Very high	89.5	Confident	51 Å²	51	27.6 Å²	27.6	25%	0.251	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	136.6	174.3	173.4	-170.4	57.6	0	0	108	V386 A387 V414 R417 I423	M377-V386 CarbonylContact C-O 3.51Å; M377-V386 VanDerWaalsContact CA-O 3.25Å; M377-V386 WeakPolarHBondContact CA-O 3.43Å; M377-A387 HydrophobicContact CB-CB 4.39Å; M377-V414 HydrophobicContact CB-CG2 4.12Å; M377-V414 HydrophobicContact CE-CG2 4.36Å; M377-V414 HydrophobicContact SD-CG1 3.93Å; M377-V414 HydrophobicContact SD-CG2 4.2Å; M377-R417 PolarHBondContact SD-NH1 2.94Å; M377-I423 HydrophobicContact CG-CD1 3.95Å; M377-I423 HydrophobicContact SD-CD1 3.88Å
378	F	90.4	Very high	90	Very high	37 Å²	37	24.8 Å²	24.8	16%	0.162	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	157.1	171.6	78.4	-85.2	0	0	0	110.5	M314 L316 Y344 L372 V386 Y388	M314-F378 HydrophobicContact CE-CE2 4.38Å; M314-F378 HydrophobicContact CE-CZ 3.97Å; L316-F378 HydrophobicContact CD2-CZ 4.42Å; Y344-F378 HydrophobicContact CD1-CZ 4.2Å; Y344-F378 HydrophobicContact CD2-CZ 4.47Å; Y344-F378 HydrophobicContact CE1-CE2 4.22Å; Y344-F378 HydrophobicContact CE1-CZ 4.31Å; Y344-F378 HydrophobicContact CG-CZ 4.26Å; L372-F378 HydrophobicContact CD1-CD1 4.49Å; L372-F378 HydrophobicContact CD1-CE1 3.88Å; L372-F378 HydrophobicContact CD2-CD1 3.54Å; L372-F378 HydrophobicContact CD2-CE1 3.34Å; L372-F378 HydrophobicContact CD2-CG 4.39Å; L372-F378 HydrophobicContact CD2-CZ 4.08Å; L372-F378 HydrophobicContact CG-CE1 4.28Å; F378-V386 HydrophobicContact CD1-CB 3.97Å; F378-V386 HydrophobicContact CD1-CG1 4.41Å; F378-V386 HydrophobicContact CE1-CB 3.53Å; F378-V386 HydrophobicContact CE1-CG1 3.71Å; F378-V386 HydrophobicContact CE1-CG2 4.15Å; F378-V386 HydrophobicContact CE2-CG2 4.45Å; F378-V386 HydrophobicContact CZ-CB 3.87Å; F378-V386 HydrophobicContact CZ-CG1 4.23Å; F378-V386 HydrophobicContact CZ-CG2 3.95Å; F378-V386 PolarHBondContact N-O 2.99Å; F378-V386 PolarHBondContact O-N 3.07Å; F378-Y388 HydrophobicContact CD1-CD1 4.05Å; F378-Y388 AromaticContact CD1-CE1 3.94Å; F378-Y388 HydrophobicContact CD1-CE1 3.94Å
379	T	88.9	Confident	90.3	Very high	51 Å²	51	23.6 Å²	23.6	31%	0.313	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	124.1	173.3	-54.6	0	0	0	0	108.1	L384 T385	T379-L384 CarbonylContact C-O 3.5Å; T379-L384 VanDerWaalsContact CA-O 3.29Å; T379-L384 WeakPolarHBondContact CA-O 3.22Å; T379-T385 HydrophobicContact CG2-CG2 4.32Å
380	S	84.2	Confident	90.5	Very high	11 Å²	11	23.7 Å²	23.7	8%	0.077	15%	0.145	C	C	.	.			trans	-70.5	167.6	178.8	78.1	0	0	0	0	111.6	E313 S382 G383 L384	E313-S380 PolarHBondContact OE1-OG 3.21Å; S380-S382 PolarHBondContact O-N 3.15Å; S380-S382 PolarHBondContact OG-N 3.43Å; S380-S382 PolarHBondContact OG-OG 3.4Å; S380-G383 WeakPolarHBondContact O-CA 3.38Å; S380-G383 PolarHBondContact O-N 3.37Å; S380-L384 PolarHBondContact N-O 3.34Å; S380-L384 VanDerWaalsContact OG-CB 3.25Å; S380-L384 WeakPolarHBondContact OG-CB 3.38Å; S380-L384 PolarHBondContact OG-N 2.85Å
381	A	80.4	Confident	90.5	Very high	112 Å²	112	22.3 Å²	22.3	93%	0.926	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.7	175.5	0	0	0	0	0	113.1	G383	A381-G383 PolarHBondContact O-N 2.78Å
382	S	80.8	Confident	90.4	Very high	23 Å²	23	22.8 Å²	22.8	16%	0.161	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	2.2	172.5	58.8	0	0	0	0	113.9	R285 E313 S380 P521 Y524	R285-S382 PolarHBondContact NH2-OG 3.23Å; E313-S382 WeakPolarHBondContact OE1-CB 3.35Å; E313-S382 PolarHBondContact OE1-N 3.16Å; E313-S382 PolarHBondContact OE1-OG 3.23Å; E313-S382 WeakPolarHBondContact OE2-CB 3.44Å; E313-S382 PolarHBondContact OE2-OG 3.4Å; S380-S382 PolarHBondContact O-N 3.15Å; S380-S382 PolarHBondContact OG-N 3.43Å; S380-S382 PolarHBondContact OG-OG 3.4Å; S382-P521 WeakPolarHBondContact O-CG 3.39Å; S382-Y524 WeakPolarHBondContact O-CE2 2.84Å
383	G	84.2	Confident	90.5	Very high	11 Å²	11	25.3 Å²	25.3	11%	0.113	15%	0.152	C	C	.	.			trans	84.4	8.6	-179.2	0	0	0	0	0	114.7	S380 A381 P521	S380-G383 WeakPolarHBondContact O-CA 3.38Å; S380-G383 PolarHBondContact O-N 3.37Å; A381-G383 PolarHBondContact O-N 2.78Å; G383-P521 WeakPolarHBondContact O-CB 3.45Å
384	L	88.5	Confident	90.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.16	C	C	.	.			trans	-74.5	127.6	178.9	-169.9	73.1	0	0	0	110.9	R285 T379 S380 V386 D424 I425 I519 P521	R285-L384 VanDerWaalsContact CZ-CD2 3.45Å; T379-L384 CarbonylContact C-O 3.5Å; T379-L384 VanDerWaalsContact CA-O 3.29Å; T379-L384 WeakPolarHBondContact CA-O 3.22Å; S380-L384 PolarHBondContact N-O 3.34Å; S380-L384 VanDerWaalsContact OG-CB 3.25Å; S380-L384 WeakPolarHBondContact OG-CB 3.38Å; S380-L384 PolarHBondContact OG-N 2.85Å; L384-V386 HydrophobicContact CD2-CG2 4.02Å; L384-V386 HydrophobicContact CG-CG2 4.23Å; L384-D424 HydrophobicContact CD1-CB 3.43Å; L384-D424 VanDerWaalsContact CD1-CB 3.43Å; L384-D424 HydrophobicContact CG-CB 4.09Å; L384-I425 HydrophobicContact CD2-CD1 3.51Å; L384-I425 HydrophobicContact CD2-CG1 4.34Å; L384-I425 HydrophobicContact CG-CD1 4.26Å; L384-I519 HydrophobicContact CD1-CG2 3.64Å; L384-P521 HydrophobicContact CB-CG 4.33Å; L384-P521 HydrophobicContact CD1-CB 4.41Å; L384-P521 HydrophobicContact CD1-CG 4.25Å
385	T	92	Very high	90.3	Very high	23 Å²	23	34.7 Å²	34.7	14%	0.141	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	122.9	178.6	55.7	0	0	0	0	111.4	T379 I423 D424 I425	T379-T385 HydrophobicContact CG2-CG2 4.32Å; T385-I423 WeakPolarHBondContact O-CG1 3.47Å; T385-I423 WeakPolarHBondContact OG1-CG1 3.42Å; T385-D424 PolarHBondContact N-OD2 3.01Å; T385-D424 WeakPolarHBondContact O-CB 3.24Å; T385-D424 PolarHBondContact O-N 3.11Å; T385-D424 PolarHBondContact OG1-N 3.44Å; T385-D424 VanDerWaalsContact OG1-N 3.07Å; T385-D424 PolarHBondContact OG1-OD2 3.21Å; T385-I425 PolarHBondContact O-N 3.31Å
386	V	94.7	Very high	90	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	113.4	-177.5	-174.6	0	0	0	0	109.4	M377 F378 L384 I425 L427	M377-V386 CarbonylContact C-O 3.51Å; M377-V386 VanDerWaalsContact CA-O 3.25Å; M377-V386 WeakPolarHBondContact CA-O 3.43Å; F378-V386 HydrophobicContact CD1-CB 3.97Å; F378-V386 HydrophobicContact CD1-CG1 4.41Å; F378-V386 HydrophobicContact CE1-CB 3.53Å; F378-V386 HydrophobicContact CE1-CG1 3.71Å; F378-V386 HydrophobicContact CE1-CG2 4.15Å; F378-V386 HydrophobicContact CE2-CG2 4.45Å; F378-V386 HydrophobicContact CZ-CB 3.87Å; F378-V386 HydrophobicContact CZ-CG1 4.23Å; F378-V386 HydrophobicContact CZ-CG2 3.95Å; F378-V386 PolarHBondContact N-O 2.99Å; F378-V386 PolarHBondContact O-N 3.07Å; L384-V386 HydrophobicContact CD2-CG2 4.02Å; L384-V386 HydrophobicContact CG-CG2 4.23Å; V386-I425 CarbonylContact C-O 3.53Å; V386-I425 WeakPolarHBondContact CA-O 3.46Å; V386-I425 HydrophobicContact CG1-CB 4.22Å; V386-I425 HydrophobicContact CG1-CG2 4.25Å; V386-I425 HydrophobicContact CG2-CB 4.19Å; V386-I425 HydrophobicContact CG2-CD1 4.3Å; V386-L427 HydrophobicContact CG1-CD1 3.62Å; V386-L427 HydrophobicContact CG1-CG 3.86Å
387	A	95.8	Very high	89.6	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	147.2	168	0	0	0	0	0	109.4	G376 M377 I423 I425 L426 L427 L464	G376-A387 WeakPolarHBondContact O-CA 3.45Å; M377-A387 HydrophobicContact CB-CB 4.39Å; A387-I423 HydrophobicContact CB-CD1 3.3Å; A387-I425 PolarHBondContact N-O 3.03Å; A387-L426 HydrophobicContact CB-CD1 4.05Å; A387-L426 WeakPolarHBondContact O-CA 3.4Å; A387-L427 PolarHBondContact O-N 3.33Å; A387-L464 HydrophobicContact CB-CD1 3.89Å
388	Y	95.9	Very high	89.4	Confident	25 Å²	25	41.3 Å²	41.3	10%	0.098	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	144.9	-178	56	-86.6	0	0	0	112.1	L346 L372 G373 K375 G376 F378 L427	L346-Y388 HydrophobicContact CD2-CG 4.43Å; L372-Y388 VanDerWaalsContact C-CE2 3.48Å; L372-Y388 HydrophobicContact CB-CD1 4.12Å; L372-Y388 HydrophobicContact CB-CD2 3.66Å; L372-Y388 HydrophobicContact CB-CE1 4.09Å; L372-Y388 HydrophobicContact CB-CE2 3.61Å; L372-Y388 HydrophobicContact CB-CG 3.92Å; L372-Y388 HydrophobicContact CD1-CD1 4Å; L372-Y388 HydrophobicContact CD1-CD2 4.48Å; L372-Y388 HydrophobicContact CD1-CG 3.94Å; L372-Y388 HydrophobicContact CD2-CE1 4.45Å; L372-Y388 HydrophobicContact CG-CD1 4.47Å; L372-Y388 WeakPolarHBondContact O-CE2 3.49Å; L372-Y388 PolarHBondContact O-OH 3.22Å; G373-Y388 WeakPolarHBondContact O-CE2 3.1Å; K375-Y388 WeakPolarHBondContact CA-O 3.42Å; G376-Y388 PolarHBondContact N-O 3.24Å; G376-Y388 VanDerWaalsContact N-O 3.14Å; G376-Y388 WeakPolarHBondContact O-CD1 3.45Å; G376-Y388 PolarHBondContact O-N 3.06Å; F378-Y388 HydrophobicContact CD1-CD1 4.05Å; F378-Y388 AromaticContact CD1-CE1 3.94Å; F378-Y388 HydrophobicContact CD1-CE1 3.94Å; Y388-L427 CarbonylContact C-O 3.59Å; Y388-L427 WeakPolarHBondContact CA-O 3.4Å
389	L	95.5	Very high	89.1	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	121.3	171.7	-178.8	70	0	0	0	109.5	K375 F402 T406 V407 L410 L427 T428 S429 V457 L460	K375-L389 HydrophobicContact CB-CD1 4.08Å; L389-F402 HydrophobicContact CD1-CB 4.15Å; L389-F402 HydrophobicContact CD1-CD1 4.26Å; L389-F402 HydrophobicContact CD1-CG 4.12Å; L389-F402 HydrophobicContact CD2-CD1 3.94Å; L389-F402 HydrophobicContact CD2-CD2 4.02Å; L389-F402 HydrophobicContact CD2-CE1 3.86Å; L389-F402 HydrophobicContact CD2-CE2 3.97Å; L389-F402 HydrophobicContact CD2-CG 4.03Å; L389-F402 HydrophobicContact CD2-CZ 3.91Å; L389-F402 HydrophobicContact CG-CD1 3.98Å; L389-F402 HydrophobicContact CG-CE1 4.23Å; L389-F402 HydrophobicContact CG-CG 4.24Å; L389-T406 HydrophobicContact CD1-CG2 4.45Å; L389-V407 HydrophobicContact CD2-CG2 3.97Å; L389-L410 HydrophobicContact CB-CD2 4.47Å; L389-L427 PolarHBondContact N-O 2.78Å; L389-T428 HydrophobicContact CB-CG2 4.18Å; L389-T428 WeakPolarHBondContact O-CA 3.38Å; L389-S429 PolarHBondContact O-N 3.34Å; L389-S429 VanDerWaalsContact O-N 3.16Å; L389-V457 HydrophobicContact CD2-CG2 4.22Å; L389-L460 HydrophobicContact CB-CD2 4.05Å; L389-L460 HydrophobicContact CD2-CD2 3.89Å
390	S	93.6	Very high	89.1	Confident	2 Å²	2	44.2 Å²	44.2	1%	0.014	23%	0.232	C	C	.	.			trans	-103	145.3	-178.6	-53.4	0	0	0	0	111.5	G347 G373 K374	G347-S390 VanDerWaalsContact N-CB 3.3Å; G347-S390 PolarHBondContact N-OG 3.29Å; G373-S390 PolarHBondContact O-OG 3.42Å; K374-S390 WeakPolarHBondContact O-CB 3.43Å; K374-S390 PolarHBondContact O-N 3.36Å
391	G	91.6	Very high	89.4	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.235	C	C	.	.	S	Bend	trans	100.3	-167.6	174.8	0	0	0	0	0	114.8	F400 F402 S429	G391-F400 CarbonylContact C-O 3.53Å; G391-F400 WeakPolarHBondContact CA-O 3.43Å; G391-F402 VanDerWaalsContact O-CE1 3.28Å; G391-F402 WeakPolarHBondContact O-CE1 3.43Å; G391-S429 PolarHBondContact N-OG 3.31Å
392	F	92.2	Very high	90	Very high	21 Å²	21	39.9 Å²	39.9	9%	0.092	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	152.8	176.8	-74.4	-45.3	0	0	0	113.1	V349 S394 F400 H401 F402 Q430 R452 N473	V349-F392 HydrophobicContact CB-CE2 4.46Å; V349-F392 HydrophobicContact CG1-CD1 4.47Å; V349-F392 HydrophobicContact CG1-CD2 3.45Å; V349-F392 VanDerWaalsContact CG1-CD2 3.45Å; V349-F392 HydrophobicContact CG1-CE1 4.09Å; V349-F392 HydrophobicContact CG1-CE2 2.96Å; V349-F392 HydrophobicContact CG1-CG 4.2Å; V349-F392 HydrophobicContact CG1-CZ 3.32Å; F392-S394 PolarHBondContact O-N 3.17Å; F392-F400 PolarHBondContact N-O 3.34Å; F392-H401 CarbonylContact O-C 3.48Å; F392-H401 WeakPolarHBondContact O-CA 3.31Å; F392-F402 PolarHBondContact O-N 3.16Å; F392-Q430 HydrophobicContact CD1-CB 3.91Å; F392-Q430 VanDerWaalsContact CD1-CD 3.46Å; F392-Q430 HydrophobicContact CD1-CG 3.73Å; F392-Q430 HydrophobicContact CE1-CB 4.22Å; F392-Q430 HydrophobicContact CE1-CG 3.97Å; F392-R452 HydrophobicContact CE1-CB 4.36Å; F392-N473 HydrophobicContact CE1-CB 4.43Å; F392-N473 HydrophobicContact CZ-CB 4.27Å
393	E	92.9	Very high	90.6	Very high	66 Å²	66	39.6 Å²	39.6	31%	0.308	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	129	173.7	174.2	169.1	175.8	0	0	111.5	F402 S454 M455 L456	E393-F402 HydrophobicContact CB-CE2 3.78Å; E393-F402 HydrophobicContact CB-CZ 3.84Å; E393-F402 HydrophobicContact CG-CE2 4.48Å; E393-S454 VanDerWaalsContact OE2-CA 3.29Å; E393-S454 WeakPolarHBondContact OE2-CA 3.04Å; E393-S454 WeakPolarHBondContact OE2-CB 3.36Å; E393-S454 PolarHBondContact OE2-OG 2.79Å; E393-M455 PolarHBondContact OE2-N 3.23Å; E393-M455 VanDerWaalsContact OE2-N 3.07Å; E393-L456 HydrophobicContact CG-CD1 3.88Å; E393-L456 HydrophobicContact CG-CG 4.24Å; E393-L456 PolarHBondContact OE2-N 3.28Å
394	S	91.1	Very high	91	Very high	26 Å²	26	41.9 Å²	41.9	18%	0.182	20%	0.197	C	C	.	.			trans	-148	165.5	173.6	-173.7	0	0	0	0	111.9	F392 Y396 F402	F392-S394 PolarHBondContact O-N 3.17Å; S394-Y396 VanDerWaalsContact C-N 3.3Å; S394-Y396 WeakPolarHBondContact OG-CD1 3.3Å; S394-Y396 WeakPolarHBondContact OG-CE1 3.29Å; S394-Y396 PolarHBondContact OG-N 2.67Å; S394-F402 PolarHBondContact N-O 2.73Å
395	E	86.2	Confident	91.2	Very high	190 Å²	190	45.1 Å²	45.1	89%	0.888	21%	0.214	S	C	*	.	S	Bend	trans	-72.8	-24.5	172.8	-62.1	-166.8	158.1	0	0	112.7
396	Y	86.3	Confident	91.2	Very high	134 Å²	134	44 Å²	44	53%	0.525	21%	0.208	S	C	.	.	S	Bend	trans	-113.1	162.9	178.6	58.8	-90.6	0	0	0	111.3	S394 D398 H401	S394-Y396 VanDerWaalsContact C-N 3.3Å; S394-Y396 WeakPolarHBondContact OG-CD1 3.3Å; S394-Y396 WeakPolarHBondContact OG-CE1 3.29Å; S394-Y396 PolarHBondContact OG-N 2.67Å; Y396-D398 VanDerWaalsContact CE2-OD2 3.29Å; Y396-D398 WeakPolarHBondContact CE2-OD2 3.44Å; Y396-H401 AromaticContact CE2-ND1 3.72Å; Y396-H401 PolarHBondContact OH-CE1 3.29Å
397	E	85	Confident	91.2	Very high	93 Å²	93	44 Å²	44	44%	0.435	21%	0.208	S	C	.	.			trans	-112.8	119.9	-178.2	-168.2	169.8	-165.5	0	0	110.5	K374 T406	K374-E397 IonicContact NZ-OE1 3.32Å; K374-E397 PolarHBondContact NZ-OE1 2.85Å; E397-T406 PolarHBondContact OE1-OG1 3.18Å; E397-T406 PolarHBondContact OE2-OG1 3.4Å
398	D	86.4	Confident	91.2	Very high	42 Å²	42	46.9 Å²	46.9	23%	0.225	22%	0.223	C	C	.	.			trans	-135.6	-159.8	174.1	68.8	19.8	0	0	0	111.2	K374 Y396 F400 H401	K374-D398 WeakPolarHBondContact CE-O 3.41Å; K374-D398 PolarHBondContact NZ-O 3.07Å; Y396-D398 VanDerWaalsContact CE2-OD2 3.29Å; Y396-D398 WeakPolarHBondContact CE2-OD2 3.44Å; D398-F400 PolarHBondContact OD1-N 3.36Å; D398-F400 WeakPolarHBondContact OD2-CE2 3.42Å; D398-F400 VanDerWaalsContact OD2-CZ 3.24Å; D398-F400 WeakPolarHBondContact OD2-CZ 3.29Å; D398-H401 VanDerWaalsContact CG-ND1 3.32Å; D398-H401 PolarHBondContact N-O 3.39Å; D398-H401 WeakPolarHBondContact OD1-CA 3.25Å; D398-H401 VanDerWaalsContact OD1-CB 3.26Å; D398-H401 WeakPolarHBondContact OD1-CB 3.41Å; D398-H401 IonicContact OD1-CG 2.83Å; D398-H401 PolarHBondContact OD1-N 3.19Å; D398-H401 IonicContact OD1-ND1 4Å; D398-H401 PolarHBondContact OD1-ND1 2.78Å; D398-H401 VanDerWaalsContact OD1-ND1 3.14Å; D398-H401 IonicContact OD2-CE1 3.72Å; D398-H401 IonicContact OD2-CG 3.59Å; D398-H401 IonicContact OD2-ND1 3.65Å; D398-H401 PolarHBondContact OD2-ND1 3.4Å
399	E	84.6	Confident	91	Very high	107 Å²	107	52.7 Å²	52.7	50%	0.5	25%	0.245	S	C	.	.	S	Bend	trans	-72.8	-23.7	-178.3	-66	178.2	179.6	0	0	114.2	A354	A354-E399 WeakPolarHBondContact CB-OE2 3.44Å
400	F	88.2	Confident	90.9	Very high	41 Å²	41	52.7 Å²	52.7	18%	0.18	25%	0.245	C	C	.	.	S	Bend	trans	-124.1	1.7	-173.4	48.6	-84.2	0	0	0	113.3	P348 P351 G391 F392 D398	P348-F400 HydrophobicContact CG-CB 4.48Å; P348-F400 WeakPolarHBondContact O-CA 3.34Å; P348-F400 WeakPolarHBondContact O-CB 3.47Å; P351-F400 HydrophobicContact CB-CE1 4.29Å; P351-F400 HydrophobicContact CB-CZ 4.32Å; P351-F400 HydrophobicContact CG-CE1 4.13Å; P351-F400 HydrophobicContact CG-CE2 3.9Å; P351-F400 HydrophobicContact CG-CZ 3.73Å; G391-F400 CarbonylContact C-O 3.53Å; G391-F400 WeakPolarHBondContact CA-O 3.43Å; F392-F400 PolarHBondContact N-O 3.34Å; D398-F400 PolarHBondContact OD1-N 3.36Å; D398-F400 WeakPolarHBondContact OD2-CE2 3.42Å; D398-F400 VanDerWaalsContact OD2-CZ 3.24Å; D398-F400 WeakPolarHBondContact OD2-CZ 3.29Å
401	H	91.6	Very high	91	Very high	30 Å²	30	53.8 Å²	53.8	14%	0.139	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	143.6	175	-63.1	108.8	0	0	0	112.8	K374 F392 Y396 D398	K374-H401 WeakPolarHBondContact CE-O 3.32Å; K374-H401 PolarHBondContact NZ-O 3.01Å; F392-H401 CarbonylContact O-C 3.48Å; F392-H401 WeakPolarHBondContact O-CA 3.31Å; Y396-H401 AromaticContact CE2-ND1 3.72Å; Y396-H401 PolarHBondContact OH-CE1 3.29Å; D398-H401 VanDerWaalsContact CG-ND1 3.32Å; D398-H401 PolarHBondContact N-O 3.39Å; D398-H401 WeakPolarHBondContact OD1-CA 3.25Å; D398-H401 VanDerWaalsContact OD1-CB 3.26Å; D398-H401 WeakPolarHBondContact OD1-CB 3.41Å; D398-H401 IonicContact OD1-CG 2.83Å; D398-H401 PolarHBondContact OD1-N 3.19Å; D398-H401 IonicContact OD1-ND1 4Å; D398-H401 PolarHBondContact OD1-ND1 2.78Å; D398-H401 VanDerWaalsContact OD1-ND1 3.14Å; D398-H401 IonicContact OD2-CE1 3.72Å; D398-H401 IonicContact OD2-CG 3.59Å; D398-H401 IonicContact OD2-ND1 3.65Å; D398-H401 PolarHBondContact OD2-ND1 3.4Å
402	F	93.2	Very high	91.1	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	150	173.4	63.1	-99.8	0	0	0	111.4	L389 G391 F392 E393 S394 T406 V407 L456 V457	L389-F402 HydrophobicContact CD1-CB 4.15Å; L389-F402 HydrophobicContact CD1-CD1 4.26Å; L389-F402 HydrophobicContact CD1-CG 4.12Å; L389-F402 HydrophobicContact CD2-CD1 3.94Å; L389-F402 HydrophobicContact CD2-CD2 4.02Å; L389-F402 HydrophobicContact CD2-CE1 3.86Å; L389-F402 HydrophobicContact CD2-CE2 3.97Å; L389-F402 HydrophobicContact CD2-CG 4.03Å; L389-F402 HydrophobicContact CD2-CZ 3.91Å; L389-F402 HydrophobicContact CG-CD1 3.98Å; L389-F402 HydrophobicContact CG-CE1 4.23Å; L389-F402 HydrophobicContact CG-CG 4.24Å; G391-F402 VanDerWaalsContact O-CE1 3.28Å; G391-F402 WeakPolarHBondContact O-CE1 3.43Å; F392-F402 PolarHBondContact O-N 3.16Å; E393-F402 HydrophobicContact CB-CE2 3.78Å; E393-F402 HydrophobicContact CB-CZ 3.84Å; E393-F402 HydrophobicContact CG-CE2 4.48Å; S394-F402 PolarHBondContact N-O 2.73Å; F402-T406 HydrophobicContact CB-CG2 3.94Å; F402-V407 HydrophobicContact CD2-CG2 3.88Å; F402-V407 HydrophobicContact CE2-CG2 4.21Å; F402-L456 HydrophobicContact CD2-CD1 4.25Å; F402-L456 HydrophobicContact CE2-CB 3.94Å; F402-L456 HydrophobicContact CE2-CD1 4.1Å; F402-V457 HydrophobicContact CE1-CG2 4.47Å; F402-V457 HydrophobicContact CE2-CG2 4.41Å; F402-V457 HydrophobicContact CZ-CG2 3.73Å
403	S	93.8	Very high	91	Very high	17 Å²	17	58.6 Å²	58.6	12%	0.119	29%	0.29	C	S	.	.			trans	-108.6	173.3	179.7	75.6	0	0	0	0	112	D405 T406 V407	S403-D405 VanDerWaalsContact C-N 3.31Å; S403-D405 PolarHBondContact O-N 2.94Å; S403-T406 PolarHBondContact N-OG1 2.84Å; S403-T406 VanDerWaalsContact N-OG1 3.16Å; S403-T406 VanDerWaalsContact O-CB 3.23Å; S403-T406 WeakPolarHBondContact O-CB 3.45Å; S403-T406 PolarHBondContact O-N 2.9Å; S403-T406 VanDerWaalsContact O-N 3.13Å; S403-T406 PolarHBondContact OG-N 2.97Å; S403-T406 PolarHBondContact OG-OG1 3.38Å; S403-V407 PolarHBondContact O-N 2.93Å
404	E	92.5	Very high	90.9	Very high	59 Å²	59	55.5 Å²	55.5	28%	0.276	28%	0.275	S	S	.	.	H	α-helix	trans	-58.5	-41.6	175.2	179.7	167.9	-158.2	0	0	112.5	T406 V407 D408 L456 K459 K553	E404-T406 VanDerWaalsContact C-N 3.27Å; E404-T406 PolarHBondContact O-N 3.43Å; E404-V407 PolarHBondContact O-N 3.38Å; E404-D408 PolarHBondContact O-N 3.04Å; E404-L456 HydrophobicContact CB-CD1 4.16Å; E404-L456 HydrophobicContact CB-CD2 3.9Å; E404-L456 HydrophobicContact CG-CD2 3.92Å; E404-K459 IonicContact OE1-NZ 2.72Å; E404-K459 PolarHBondContact OE1-NZ 3.24Å; E404-K553 WeakPolarHBondContact OE1-CE 3.25Å; E404-K553 IonicContact OE1-NZ 2.85Å; E404-K553 PolarHBondContact OE1-NZ 2.83Å
405	D	92.2	Very high	90.8	Very high	68 Å²	68	56.8 Å²	56.8	36%	0.364	28%	0.282	S	S	.	.	H	α-helix	trans	-65.2	-33.9	177.7	168.5	81.7	0	0	0	111.5	S403 V407 D408 R409	S403-D405 VanDerWaalsContact C-N 3.31Å; S403-D405 PolarHBondContact O-N 2.94Å; D405-V407 VanDerWaalsContact C-N 3.31Å; D405-V407 PolarHBondContact O-N 3.48Å; D405-D408 PolarHBondContact O-N 3.27Å; D405-R409 VanDerWaalsContact CG-NE 3.31Å; D405-R409 WeakPolarHBondContact O-CB 3.49Å; D405-R409 VanDerWaalsContact O-CG 3.28Å; D405-R409 WeakPolarHBondContact O-CG 3.46Å; D405-R409 PolarHBondContact O-N 3.47Å; D405-R409 IonicContact OD1-CZ 3.6Å; D405-R409 IonicContact OD1-NE 2.78Å; D405-R409 PolarHBondContact OD1-NE 3.4Å; D405-R409 VanDerWaalsContact OD1-NE 3.07Å; D405-R409 IonicContact OD1-NH2 2.71Å; D405-R409 PolarHBondContact OD1-NH2 3.15Å; D405-R409 IonicContact OD2-CZ 3.94Å; D405-R409 IonicContact OD2-NE 3.25Å; D405-R409 PolarHBondContact OD2-NE 3.47Å; D405-R409 IonicContact OD2-NH2 2.91Å; D405-R409 PolarHBondContact OD2-NH2 3.39Å
406	T	92.8	Very high	90.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.2	-46.5	174.6	-50.8	0	0	0	0	110.9	K375 L389 E397 F402 S403 E404 L410	K375-T406 HydrophobicContact CD-CG2 3.47Å; K375-T406 VanDerWaalsContact CD-CG2 3.47Å; K375-T406 WeakPolarHBondContact CD-O 3.35Å; K375-T406 PolarHBondContact NZ-O 3.2Å; L389-T406 HydrophobicContact CD1-CG2 4.45Å; E397-T406 PolarHBondContact OE1-OG1 3.18Å; E397-T406 PolarHBondContact OE2-OG1 3.4Å; F402-T406 HydrophobicContact CB-CG2 3.94Å; S403-T406 PolarHBondContact N-OG1 2.84Å; S403-T406 VanDerWaalsContact N-OG1 3.16Å; S403-T406 VanDerWaalsContact O-CB 3.23Å; S403-T406 WeakPolarHBondContact O-CB 3.45Å; S403-T406 PolarHBondContact O-N 2.9Å; S403-T406 VanDerWaalsContact O-N 3.13Å; S403-T406 PolarHBondContact OG-N 2.97Å; S403-T406 PolarHBondContact OG-OG1 3.38Å; E404-T406 VanDerWaalsContact C-N 3.27Å; E404-T406 PolarHBondContact O-N 3.43Å; T406-L410 PolarHBondContact O-N 3.23Å
407	V	94.3	Very high	90.7	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-71	-43.7	179.7	171.6	0	0	0	0	111.8	L389 F402 S403 E404 D405 R409 L410 I411 L456 L460	L389-V407 HydrophobicContact CD2-CG2 3.97Å; F402-V407 HydrophobicContact CD2-CG2 3.88Å; F402-V407 HydrophobicContact CE2-CG2 4.21Å; S403-V407 PolarHBondContact O-N 2.93Å; E404-V407 PolarHBondContact O-N 3.38Å; D405-V407 VanDerWaalsContact C-N 3.31Å; D405-V407 PolarHBondContact O-N 3.48Å; V407-R409 VanDerWaalsContact C-N 3.33Å; V407-R409 PolarHBondContact O-N 2.72Å; V407-L410 WeakPolarHBondContact O-CB 3.39Å; V407-L410 PolarHBondContact O-N 3.05Å; V407-L410 VanDerWaalsContact O-N 3.08Å; V407-I411 HydrophobicContact CG1-CD1 3.83Å; V407-I411 HydrophobicContact CG1-CG1 4.35Å; V407-I411 WeakPolarHBondContact O-CG1 3.2Å; V407-I411 PolarHBondContact O-N 3.39Å; V407-L456 HydrophobicContact CG2-CB 4.12Å; V407-L460 HydrophobicContact CG1-CB 4Å; V407-L460 HydrophobicContact CG1-CD1 4.33Å
408	D	94.3	Very high	90.3	Very high	61 Å²	61	52.2 Å²	52.2	33%	0.326	28%	0.281	S	S	.	.	H	α-helix	trans	-62.4	-39.9	179.2	-80	-23.5	0	0	0	112.6	E404 D405 L410 I411 A412 K459	E404-D408 PolarHBondContact O-N 3.04Å; D405-D408 PolarHBondContact O-N 3.27Å; D408-L410 VanDerWaalsContact C-N 3.33Å; D408-L410 PolarHBondContact O-N 3.27Å; D408-I411 PolarHBondContact O-N 3.11Å; D408-A412 WeakPolarHBondContact O-CB 3.2Å; D408-A412 PolarHBondContact O-N 3.19Å; D408-K459 WeakPolarHBondContact OD1-CE 3.49Å; D408-K459 IonicContact OD1-NZ 3.26Å; D408-K459 PolarHBondContact OD1-NZ 3.11Å; D408-K459 IonicContact OD2-NZ 3.15Å; D408-K459 PolarHBondContact OD2-NZ 3.24Å
409	R	93.4	Very high	89.7	Confident	146 Å²	146	55.9 Å²	55.9	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-65.2	-35.5	173.6	-68.3	-177.6	-156.3	-179.3	11	112.6	D405 V407 S413	D405-R409 VanDerWaalsContact CG-NE 3.31Å; D405-R409 WeakPolarHBondContact O-CB 3.49Å; D405-R409 VanDerWaalsContact O-CG 3.28Å; D405-R409 WeakPolarHBondContact O-CG 3.46Å; D405-R409 PolarHBondContact O-N 3.47Å; D405-R409 IonicContact OD1-CZ 3.6Å; D405-R409 IonicContact OD1-NE 2.78Å; D405-R409 PolarHBondContact OD1-NE 3.4Å; D405-R409 VanDerWaalsContact OD1-NE 3.07Å; D405-R409 IonicContact OD1-NH2 2.71Å; D405-R409 PolarHBondContact OD1-NH2 3.15Å; D405-R409 IonicContact OD2-CZ 3.94Å; D405-R409 IonicContact OD2-NE 3.25Å; D405-R409 PolarHBondContact OD2-NE 3.47Å; D405-R409 IonicContact OD2-NH2 2.91Å; D405-R409 PolarHBondContact OD2-NH2 3.39Å; V407-R409 VanDerWaalsContact C-N 3.33Å; V407-R409 PolarHBondContact O-N 2.72Å; R409-S413 WeakPolarHBondContact O-CB 3.48Å; R409-S413 PolarHBondContact O-N 3.12Å; R409-S413 PolarHBondContact O-OG 2.77Å
410	L	93.4	Very high	89.6	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-69.8	-42.1	176.7	179.2	61.5	0	0	0	111.2	K375 L389 T406 V407 D408 S413 V414 L460	K375-L410 HydrophobicContact CB-CD2 4.34Å; K375-L410 HydrophobicContact CD-CB 4.45Å; L389-L410 HydrophobicContact CB-CD2 4.47Å; T406-L410 PolarHBondContact O-N 3.23Å; V407-L410 WeakPolarHBondContact O-CB 3.39Å; V407-L410 PolarHBondContact O-N 3.05Å; V407-L410 VanDerWaalsContact O-N 3.08Å; D408-L410 VanDerWaalsContact C-N 3.33Å; D408-L410 PolarHBondContact O-N 3.27Å; L410-S413 PolarHBondContact O-N 2.95Å; L410-S413 PolarHBondContact O-OG 3.38Å; L410-S413 VanDerWaalsContact O-OG 3.06Å; L410-V414 HydrophobicContact CD1-CG2 4Å; L410-V414 WeakPolarHBondContact O-CG2 3.24Å; L410-V414 PolarHBondContact O-N 3.48Å; L410-V414 VanDerWaalsContact O-N 3.12Å; L410-L460 HydrophobicContact CD2-CD1 3.8Å; L410-L460 HydrophobicContact CD2-CD2 3.89Å; L410-L460 HydrophobicContact CG-CD1 4.09Å
411	I	94.7	Very high	89.2	Confident	24 Å²	24	54.6 Å²	54.6	12%	0.123	31%	0.311	C	S	.	.	H	α-helix	trans	-59.2	-51.1	173.7	-68.1	169.3	0	0	0	109.3	V407 D408 S413 V414 T415 K459 L460 A463	V407-I411 HydrophobicContact CG1-CD1 3.83Å; V407-I411 HydrophobicContact CG1-CG1 4.35Å; V407-I411 WeakPolarHBondContact O-CG1 3.2Å; V407-I411 PolarHBondContact O-N 3.39Å; D408-I411 PolarHBondContact O-N 3.11Å; I411-S413 VanDerWaalsContact C-N 3.35Å; I411-S413 PolarHBondContact O-N 3.13Å; I411-V414 PolarHBondContact O-N 2.65Å; I411-T415 HydrophobicContact CG2-CG2 4.08Å; I411-T415 VanDerWaalsContact O-CB 3.31Å; I411-T415 WeakPolarHBondContact O-CB 3.43Å; I411-T415 VanDerWaalsContact O-CG2 3.28Å; I411-T415 WeakPolarHBondContact O-CG2 3.49Å; I411-T415 PolarHBondContact O-N 2.74Å; I411-T415 PolarHBondContact O-OG1 3.07Å; I411-K459 HydrophobicContact CD1-CG 4.16Å; I411-L460 HydrophobicContact CD1-CD1 4.43Å; I411-L460 HydrophobicContact CG1-CD1 3.68Å; I411-A463 HydrophobicContact CB-CB 4.42Å; I411-A463 HydrophobicContact CD1-CB 3.81Å; I411-A463 HydrophobicContact CG1-CB 3.86Å; I411-A463 HydrophobicContact CG2-CB 3.7Å
412	A	93	Very high	89	Confident	56 Å²	56	53.6 Å²	53.6	46%	0.463	31%	0.309	S	S	.	.	H	α-helix	trans	-59.3	-43.3	-179.9	0	0	0	0	0	112.3	D408 V414 S416	D408-A412 WeakPolarHBondContact O-CB 3.2Å; D408-A412 PolarHBondContact O-N 3.19Å; A412-V414 PolarHBondContact O-N 3.3Å; A412-S416 WeakPolarHBondContact O-CB 3.5Å; A412-S416 PolarHBondContact O-N 2.75Å; A412-S416 PolarHBondContact O-OG 2.95Å
413	S	91.1	Very high	88.9	Confident	66 Å²	66	53.6 Å²	53.6	46%	0.462	31%	0.309	S	S	.	.	H	α-helix	trans	-69.7	-30.5	-177.9	69.5	0	0	0	0	114.1	R409 L410 I411 S416	R409-S413 WeakPolarHBondContact O-CB 3.48Å; R409-S413 PolarHBondContact O-N 3.12Å; R409-S413 PolarHBondContact O-OG 2.77Å; L410-S413 PolarHBondContact O-N 2.95Å; L410-S413 PolarHBondContact O-OG 3.38Å; L410-S413 VanDerWaalsContact O-OG 3.06Å; I411-S413 VanDerWaalsContact C-N 3.35Å; I411-S413 PolarHBondContact O-N 3.13Å; S413-S416 PolarHBondContact O-OG 2.89Å
414	V	90.1	Very high	88.8	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-86.4	-40.4	179.5	178.4	0	0	0	0	111.3	M377 L410 I411 A412 R417 F420 L464	M377-V414 HydrophobicContact CB-CG2 4.12Å; M377-V414 HydrophobicContact CE-CG2 4.36Å; M377-V414 HydrophobicContact SD-CG1 3.93Å; M377-V414 HydrophobicContact SD-CG2 4.2Å; L410-V414 HydrophobicContact CD1-CG2 4Å; L410-V414 WeakPolarHBondContact O-CG2 3.24Å; L410-V414 PolarHBondContact O-N 3.48Å; L410-V414 VanDerWaalsContact O-N 3.12Å; I411-V414 PolarHBondContact O-N 2.65Å; A412-V414 PolarHBondContact O-N 3.3Å; V414-R417 WeakPolarHBondContact O-CG 3.39Å; V414-F420 HydrophobicContact CG1-CD2 4.25Å; V414-F420 HydrophobicContact CG1-CE2 3.62Å; V414-F420 HydrophobicContact CG1-CZ 4.22Å; V414-F420 WeakPolarHBondContact O-CD2 3.26Å; V414-L464 HydrophobicContact CB-CD2 3.67Å; V414-L464 HydrophobicContact CG1-CD2 3.61Å; V414-L464 HydrophobicContact CG2-CD2 4.35Å
415	T	89.8	Confident	89	Confident	53 Å²	53	50 Å²	50	33%	0.325	29%	0.29	S	S	.	.	H	α-helix	trans	-80.4	-20.8	-176.1	59.7	0	0	0	0	113.9	I411 R417 F420 L464	I411-T415 HydrophobicContact CG2-CG2 4.08Å; I411-T415 VanDerWaalsContact O-CB 3.31Å; I411-T415 WeakPolarHBondContact O-CB 3.43Å; I411-T415 VanDerWaalsContact O-CG2 3.28Å; I411-T415 WeakPolarHBondContact O-CG2 3.49Å; I411-T415 PolarHBondContact O-N 2.74Å; I411-T415 PolarHBondContact O-OG1 3.07Å; T415-R417 PolarHBondContact O-N 2.7Å; T415-F420 HydrophobicContact CG2-CD1 4.07Å; T415-F420 HydrophobicContact CG2-CE1 3.75Å; T415-F420 HydrophobicContact CG2-CZ 4.24Å; T415-L464 HydrophobicContact CG2-CD2 4.19Å
416	S	87.5	Confident	89.2	Confident	92 Å²	92	46.7 Å²	46.7	64%	0.643	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-8.1	176.2	63.3	0	0	0	0	114.1	A412 S413	A412-S416 WeakPolarHBondContact O-CB 3.5Å; A412-S416 PolarHBondContact O-N 2.75Å; A412-S416 PolarHBondContact O-OG 2.95Å; S413-S416 PolarHBondContact O-OG 2.89Å
417	R	82.9	Confident	89.4	Confident	110 Å²	110	46.7 Å²	46.7	42%	0.415	27%	0.273	S	S	.	.	S	Bend	trans	-69.9	134.5	-178.9	-61.1	176.8	85.6	-171.3	7.1	110.6	M377 V414 T415 S419 F420	M377-R417 PolarHBondContact SD-NH1 2.94Å; V414-R417 WeakPolarHBondContact O-CG 3.39Å; T415-R417 PolarHBondContact O-N 2.7Å; R417-S419 PolarHBondContact O-N 3.36Å; R417-F420 WeakPolarHBondContact O-CB 3.33Å; R417-F420 PolarHBondContact O-N 3.02Å
418	P	75.9	Confident	89.4	Confident	119 Å²	119	46.8 Å²	46.8	77%	0.773	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	139.9	173.7	24.2	-31.7	0	0	0	109.5	F420	P418-F420 VanDerWaalsContact C-N 3.29Å; P418-F420 PolarHBondContact O-N 2.75Å
419	S	74.2	Confident	89.4	Confident	119 Å²	119	43.9 Å²	43.9	83%	0.832	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	20.9	-176.8	70.8	0	0	0	0	116.5	R417 S421	R417-S419 PolarHBondContact O-N 3.36Å; S419-S421 PolarHBondContact O-N 3.47Å; S419-S421 VanDerWaalsContact O-N 3.07Å; S419-S421 PolarHBondContact O-OG 3.32Å
420	F	82.9	Confident	89.3	Confident	60 Å²	60	37.5 Å²	37.5	26%	0.263	23%	0.234	S	C	.	.			trans	-58.5	115.1	172.9	-178.3	-101.4	0	0	0	111.5	V414 T415 R417 P418 G422 L464	V414-F420 HydrophobicContact CG1-CD2 4.25Å; V414-F420 HydrophobicContact CG1-CE2 3.62Å; V414-F420 HydrophobicContact CG1-CZ 4.22Å; V414-F420 WeakPolarHBondContact O-CD2 3.26Å; T415-F420 HydrophobicContact CG2-CD1 4.07Å; T415-F420 HydrophobicContact CG2-CE1 3.75Å; T415-F420 HydrophobicContact CG2-CZ 4.24Å; R417-F420 WeakPolarHBondContact O-CB 3.33Å; R417-F420 PolarHBondContact O-N 3.02Å; P418-F420 VanDerWaalsContact C-N 3.29Å; P418-F420 PolarHBondContact O-N 2.75Å; F420-G422 WeakPolarHBondContact CE2-O 3.47Å; F420-L464 HydrophobicContact CZ-CD2 4.32Å; F420-L464 WeakPolarHBondContact CZ-O 3.44Å
421	S	80.2	Confident	89.3	Confident	61 Å²	61	37.6 Å²	37.6	43%	0.427	23%	0.234	S	C	.	.			trans	-118.7	-9.3	179.7	38.6	0	0	0	0	112.7	S419 F522	S419-S421 PolarHBondContact O-N 3.47Å; S419-S421 VanDerWaalsContact O-N 3.07Å; S419-S421 PolarHBondContact O-OG 3.32Å; S421-F522 WeakPolarHBondContact OG-CE1 3.49Å
422	G	86.8	Confident	89.3	Confident	10 Å²	10	36.4 Å²	36.4	10%	0.103	23%	0.228	C	C	.	.			trans	147.1	-174.6	-176.5	0	0	0	0	0	110.5	F420 L464	F420-G422 WeakPolarHBondContact CE2-O 3.47Å; G422-L464 WeakPolarHBondContact CA-O 3.49Å
423	I	91.2	Very high	89.3	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	154.2	176.5	-162	170.2	0	0	0	111.3	M377 T385 A387 L464 P466 R467	M377-I423 HydrophobicContact CG-CD1 3.95Å; M377-I423 HydrophobicContact SD-CD1 3.88Å; T385-I423 WeakPolarHBondContact O-CG1 3.47Å; T385-I423 WeakPolarHBondContact OG1-CG1 3.42Å; A387-I423 HydrophobicContact CB-CD1 3.3Å; I423-L464 HydrophobicContact CG2-CB 4.25Å; I423-L464 PolarHBondContact N-O 3.22Å; I423-P466 HydrophobicContact CG2-CB 3.66Å; I423-P466 CarbonylContact O-C 3.59Å; I423-P466 VanDerWaalsContact O-CA 3.29Å; I423-P466 WeakPolarHBondContact O-CA 3.48Å; I423-R467 PolarHBondContact O-N 3.36Å
424	D	92.4	Very high	89.1	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	-49.3	178	-63.7	-68.9	0	0	0	112	L384 T385 R467 Y468 I519 P521 F522	L384-D424 HydrophobicContact CD1-CB 3.43Å; L384-D424 VanDerWaalsContact CD1-CB 3.43Å; L384-D424 HydrophobicContact CG-CB 4.09Å; T385-D424 PolarHBondContact N-OD2 3.01Å; T385-D424 WeakPolarHBondContact O-CB 3.24Å; T385-D424 PolarHBondContact O-N 3.11Å; T385-D424 PolarHBondContact OG1-N 3.44Å; T385-D424 VanDerWaalsContact OG1-N 3.07Å; T385-D424 PolarHBondContact OG1-OD2 3.21Å; D424-R467 WeakPolarHBondContact O-CB 3.22Å; D424-R467 PolarHBondContact O-N 2.86Å; D424-R467 IonicContact OD1-NH1 3.33Å; D424-Y468 PolarHBondContact O-N 3.29Å; D424-I519 HydrophobicContact CB-CD1 4.31Å; D424-P521 WeakPolarHBondContact OD1-CA 3.36Å; D424-F522 WeakPolarHBondContact OD1-CB 3.23Å; D424-F522 PolarHBondContact OD1-N 2.94Å; D424-F522 PolarHBondContact OD2-N 3.32Å
425	I	95.2	Very high	89.2	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	134.3	-175.4	-54.1	-179.6	0	0	0	110.8	L316 L384 T385 V386 A387 L427 Y468 F470 F517	L316-I425 HydrophobicContact CD1-CD1 4.04Å; L384-I425 HydrophobicContact CD2-CD1 3.51Å; L384-I425 HydrophobicContact CD2-CG1 4.34Å; L384-I425 HydrophobicContact CG-CD1 4.26Å; T385-I425 PolarHBondContact O-N 3.31Å; V386-I425 CarbonylContact C-O 3.53Å; V386-I425 WeakPolarHBondContact CA-O 3.46Å; V386-I425 HydrophobicContact CG1-CB 4.22Å; V386-I425 HydrophobicContact CG1-CG2 4.25Å; V386-I425 HydrophobicContact CG2-CB 4.19Å; V386-I425 HydrophobicContact CG2-CD1 4.3Å; A387-I425 PolarHBondContact N-O 3.03Å; I425-L427 HydrophobicContact CG2-CD2 3.81Å; I425-L427 HydrophobicContact CG2-CG 4.01Å; I425-Y468 CarbonylContact C-O 3.38Å; I425-Y468 WeakPolarHBondContact CA-O 3.44Å; I425-F470 HydrophobicContact CG2-CD2 3.78Å; I425-F470 HydrophobicContact CG2-CE2 4.05Å; I425-F517 HydrophobicContact CD1-CE2 3.84Å; I425-F517 HydrophobicContact CD1-CZ 3.53Å
426	L	96.7	Very high	89	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.3	163.5	176.9	59.6	0	0	0	109.2	A387 T428 L460 A461 L464 P466 Y468 H469 F470	A387-L426 HydrophobicContact CB-CD1 4.05Å; A387-L426 WeakPolarHBondContact O-CA 3.4Å; L426-T428 HydrophobicContact CD1-CG2 3.95Å; L426-T428 HydrophobicContact CD2-CG2 4.37Å; L426-T428 HydrophobicContact CG-CG2 3.94Å; L426-L460 HydrophobicContact CD1-CD2 4.03Å; L426-L460 HydrophobicContact CD1-CG 4.42Å; L426-L460 HydrophobicContact CD2-CG 4.46Å; L426-A461 HydrophobicContact CD2-CB 4Å; L426-L464 HydrophobicContact CD1-CD1 4.19Å; L426-P466 HydrophobicContact CB-CB 3.64Å; L426-P466 HydrophobicContact CB-CG 3.82Å; L426-P466 HydrophobicContact CD2-CG 4.09Å; L426-Y468 PolarHBondContact N-O 3.14Å; L426-H469 HydrophobicContact CB-CB 4.47Å; L426-H469 WeakPolarHBondContact O-CA 3.17Å; L426-H469 PolarHBondContact O-CD2 3.33Å; L426-F470 PolarHBondContact O-N 3.41Å
427	L	96.5	Very high	89	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.8	174.4	-62.7	178.3	0	0	0	109.6	L316 C318 L346 L372 V386 A387 Y388 L389 I425 F470	L316-L427 HydrophobicContact CB-CD1 4.08Å; L316-L427 HydrophobicContact CB-CD2 4.36Å; L316-L427 HydrophobicContact CD1-CD1 4.03Å; L316-L427 HydrophobicContact CD1-CD2 4.18Å; L316-L427 HydrophobicContact CD2-CD1 3.78Å; L316-L427 HydrophobicContact CG-CD1 4.16Å; C318-L427 HydrophobicContact CB-CD2 4.47Å; L346-L427 HydrophobicContact CD1-CB 4.43Å; L346-L427 HydrophobicContact CD2-CB 4.29Å; L372-L427 HydrophobicContact CD1-CD1 4.19Å; V386-L427 HydrophobicContact CG1-CD1 3.62Å; V386-L427 HydrophobicContact CG1-CG 3.86Å; A387-L427 PolarHBondContact O-N 3.33Å; Y388-L427 CarbonylContact C-O 3.59Å; Y388-L427 WeakPolarHBondContact CA-O 3.4Å; L389-L427 PolarHBondContact N-O 2.78Å; I425-L427 HydrophobicContact CG2-CD2 3.81Å; I425-L427 HydrophobicContact CG2-CG 4.01Å; L427-F470 HydrophobicContact CD2-CB 3.87Å; L427-F470 HydrophobicContact CD2-CD2 4.01Å; L427-F470 HydrophobicContact CD2-CG 4.36Å
428	T	96.2	Very high	89	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.006	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	137.4	177.8	54.5	0	0	0	0	111.2	L389 L426 Q430 V457 L460 H469 F470 S471	L389-T428 HydrophobicContact CB-CG2 4.18Å; L389-T428 WeakPolarHBondContact O-CA 3.38Å; L426-T428 HydrophobicContact CD1-CG2 3.95Å; L426-T428 HydrophobicContact CD2-CG2 4.37Å; L426-T428 HydrophobicContact CG-CG2 3.94Å; T428-Q430 PolarHBondContact O-N 2.85Å; T428-Q430 PolarHBondContact OG1-O 3.35Å; T428-V457 HydrophobicContact CG2-CG1 3.99Å; T428-L460 HydrophobicContact CG2-CD2 4.47Å; T428-H469 PolarHBondContact OG1-NE2 3.36Å; T428-F470 PolarHBondContact N-O 3.24Å; T428-S471 VanDerWaalsContact O-CA 3.3Å; T428-S471 WeakPolarHBondContact O-CA 3.16Å; T428-S471 PolarHBondContact OG1-OG 2.73Å
429	S	93.1	Very high	89.4	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.162	C	C	.	.	S	Bend	trans	-63.2	-34.4	175.4	-60.3	0	0	0	0	111.8	C318 L346 L389 G391 A472 N473	C318-S429 WeakPolarHBondContact O-CA 3.41Å; L346-S429 WeakPolarHBondContact CD1-OG 3.31Å; L389-S429 PolarHBondContact O-N 3.34Å; L389-S429 VanDerWaalsContact O-N 3.16Å; G391-S429 PolarHBondContact N-OG 3.31Å; S429-A472 CarbonylContact O-C 3.51Å; S429-N473 PolarHBondContact O-ND2 2.92Å
430	Q	92.5	Very high	89.7	Confident	12 Å²	12	28 Å²	28	6%	0.056	15%	0.153	C	C	.	.	S	Bend	trans	-106.1	152.4	-176.8	-161.9	171.5	11.2	0	0	111.9	F392 T428 R452 S453 V457 S471	F392-Q430 HydrophobicContact CD1-CB 3.91Å; F392-Q430 VanDerWaalsContact CD1-CD 3.46Å; F392-Q430 HydrophobicContact CD1-CG 3.73Å; F392-Q430 HydrophobicContact CE1-CB 4.22Å; F392-Q430 HydrophobicContact CE1-CG 3.97Å; T428-Q430 PolarHBondContact O-N 2.85Å; T428-Q430 PolarHBondContact OG1-O 3.35Å; Q430-R452 WeakPolarHBondContact CG-O 3.27Å; Q430-R452 PolarHBondContact NE2-O 3.39Å; Q430-S453 PolarHBondContact NE2-O 2.89Å; Q430-V457 HydrophobicContact CB-CG2 4.37Å; Q430-S471 PolarHBondContact O-OG 3.18Å
431	W	93.3	Very high	89.7	Confident	4 Å²	4	28.3 Å²	28.3	2%	0.015	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	144.4	176.3	-75.7	40.4	0	0	0	111.4	V435 P443 S453 S454 A472 T474 C476 F478 F499	W431-V435 HydrophobicContact CE3-CG1 3.9Å; W431-P443 HydrophobicContact CZ3-CB 4.43Å; W431-P443 HydrophobicContact CZ3-CG 4.35Å; W431-S453 CarbonylContact O-C 3.57Å; W431-S453 WeakPolarHBondContact O-CA 3.21Å; W431-S454 PolarHBondContact O-N 3.46Å; W431-A472 VanDerWaalsContact CD1-O 3.22Å; W431-A472 PolarHBondContact NE1-O 2.81Å; W431-T474 HydrophobicContact CB-CG2 4.4Å; W431-T474 VanDerWaalsContact CD1-CG2 3.45Å; W431-T474 HydrophobicContact CD2-CG2 3.89Å; W431-T474 HydrophobicContact CG-CG2 3.71Å; W431-T474 HydrophobicContact CZ2-CG2 4.4Å; W431-T474 WeakPolarHBondContact CZ2-OG1 3.44Å; W431-T474 PolarHBondContact NE1-OG1 2.87Å; W431-C476 HydrophobicContact CH2-CB 4.25Å; W431-C476 HydrophobicContact CZ2-CB 4.43Å; W431-F478 HydrophobicContact CH2-CB 3.29Å; W431-F478 HydrophobicContact CH2-CD1 4.24Å; W431-F478 HydrophobicContact CH2-CG 4.21Å; W431-F478 HydrophobicContact CZ2-CB 4.31Å; W431-F478 HydrophobicContact CZ3-CB 3.66Å; W431-F478 AromaticContact CZ3-CD1 3.7Å; W431-F478 HydrophobicContact CZ3-CD1 3.7Å; W431-F478 HydrophobicContact CZ3-CG 4.09Å; W431-F499 HydrophobicContact CD2-CE1 4.08Å; W431-F499 AromaticContact CD2-CZ 3.69Å; W431-F499 HydrophobicContact CD2-CZ 3.69Å; W431-F499 AromaticContact CE3-CE1 3.79Å; W431-F499 HydrophobicContact CE3-CE1 3.79Å; W431-F499 AromaticContact CE3-CZ 3.81Å; W431-F499 HydrophobicContact CE3-CZ 3.81Å; W431-F499 HydrophobicContact CG-CZ 4.03Å; W431-F499 HydrophobicContact CH2-CE1 4.42Å; W431-F499 AromaticContact CZ3-CE1 3.98Å; W431-F499 HydrophobicContact CZ3-CE1 3.98Å; W431-F499 HydrophobicContact CZ3-CZ 4.43Å
432	P	94.2	Very high	89.7	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	137.3	166.9	21.5	-24.2	0	0	0	110.8	V435 V457 T458 H469 F499 Y542	P432-V435 HydrophobicContact CB-CB 4.46Å; P432-V435 HydrophobicContact CG-CB 3.85Å; P432-V435 HydrophobicContact CG-CG1 4.43Å; P432-V435 HydrophobicContact CG-CG2 3.86Å; P432-V435 WeakPolarHBondContact O-CB 3.32Å; P432-V435 WeakPolarHBondContact O-CG1 3.02Å; P432-V457 HydrophobicContact CB-CG1 3.94Å; P432-V457 HydrophobicContact CG-CG1 4.37Å; P432-T458 WeakPolarHBondContact CB-OG1 3.45Å; P432-H469 VanDerWaalsContact CG-CE1 3.49Å; P432-H469 WeakPolarHBondContact CG-CE1 3.49Å; P432-F499 VanDerWaalsContact CD-CE2 3.48Å; P432-F499 HydrophobicContact CG-CD2 4.2Å; P432-F499 HydrophobicContact CG-CE2 3.78Å; P432-F499 HydrophobicContact CG-CZ 4.45Å; P432-Y542 HydrophobicContact CB-CE1 3.83Å; P432-Y542 HydrophobicContact CG-CE1 4.27Å; P432-Y542 WeakPolarHBondContact CG-OH 3.36Å
433	Q	91.7	Very high	89.4	Confident	56 Å²	56	29.7 Å²	29.7	26%	0.262	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	130.4	174.5	-176.7	175.1	-10.3	0	0	112.1	S454 T458 T545	Q433-S454 PolarHBondContact N-O 3.46Å; Q433-T458 PolarHBondContact N-OG1 3.4Å; Q433-T458 PolarHBondContact O-OG1 3.08Å; Q433-T545 HydrophobicContact CB-CG2 4.05Å; Q433-T545 HydrophobicContact CG-CG2 4.14Å; Q433-T545 PolarHBondContact O-OG1 2.95Å
434	G	88.7	Confident	88.6	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.4	12.4	-178.7	0	0	0	0	0	113.8	E436 H437 P541	G434-E436 PolarHBondContact O-N 2.85Å; G434-E436 VanDerWaalsContact O-N 3.13Å; G434-H437 VanDerWaalsContact O-CB 3.24Å; G434-H437 WeakPolarHBondContact O-CB 3.47Å; G434-H437 PolarHBondContact O-N 3.33Å; G434-P541 WeakPolarHBondContact O-CB 3.42Å
435	V	90.6	Very high	87.2	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.006	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-9.1	-179.4	73.4	0	0	0	0	114.1	W431 P432 F478 R480 F499 Y542	W431-V435 HydrophobicContact CE3-CG1 3.9Å; P432-V435 HydrophobicContact CB-CB 4.46Å; P432-V435 HydrophobicContact CG-CB 3.85Å; P432-V435 HydrophobicContact CG-CG1 4.43Å; P432-V435 HydrophobicContact CG-CG2 3.86Å; P432-V435 WeakPolarHBondContact O-CB 3.32Å; P432-V435 WeakPolarHBondContact O-CG1 3.02Å; V435-F478 HydrophobicContact CG1-CE1 4.34Å; V435-R480 VanDerWaalsContact C-NH1 3.31Å; V435-R480 WeakPolarHBondContact O-CD 3.47Å; V435-R480 PolarHBondContact O-NH1 3.47Å; V435-F499 HydrophobicContact CG1-CD1 4.37Å; V435-F499 HydrophobicContact CG1-CE1 3.97Å; V435-F499 HydrophobicContact CG1-CZ 4.17Å; V435-F499 HydrophobicContact CG2-CB 3.98Å; V435-F499 HydrophobicContact CG2-CD1 3.54Å; V435-F499 HydrophobicContact CG2-CD2 3.68Å; V435-F499 HydrophobicContact CG2-CE1 3.9Å; V435-F499 HydrophobicContact CG2-CE2 4.03Å; V435-F499 HydrophobicContact CG2-CG 3.42Å; V435-F499 VanDerWaalsContact CG2-CG 3.42Å; V435-F499 HydrophobicContact CG2-CZ 4.12Å; V435-Y542 HydrophobicContact CB-CE1 4.14Å; V435-Y542 HydrophobicContact CG2-CE1 4.35Å
436	E	87.2	Confident	85.4	Confident	82 Å²	82	43.3 Å²	43.3	38%	0.383	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-17.2	174.1	63	-81.1	-165.4	0	0	111.7	G434 L438 S439 P443 F478	G434-E436 PolarHBondContact O-N 2.85Å; G434-E436 VanDerWaalsContact O-N 3.13Å; E436-L438 PolarHBondContact O-N 3.33Å; E436-S439 WeakPolarHBondContact O-CB 3.43Å; E436-S439 PolarHBondContact O-N 3.15Å; E436-S439 VanDerWaalsContact O-N 3.13Å; E436-P443 HydrophobicContact CB-CG 4.37Å; E436-F478 HydrophobicContact CB-CE1 4.44Å; E436-F478 HydrophobicContact CB-CZ 4.49Å
437	H	85.9	Confident	83.4	Confident	63 Å²	63	47.5 Å²	47.5	29%	0.292	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	136	-177	-65.7	-169.9	0	0	0	111.1	G434 S439 R480 P541 E544	G434-H437 VanDerWaalsContact O-CB 3.24Å; G434-H437 WeakPolarHBondContact O-CB 3.47Å; G434-H437 PolarHBondContact O-N 3.33Å; H437-S439 PolarHBondContact O-N 3.01Å; H437-S439 VanDerWaalsContact O-N 3.14Å; H437-R480 VanDerWaalsContact O-CZ 3.24Å; H437-R480 PolarHBondContact O-NH1 3.32Å; H437-R480 PolarHBondContact O-NH2 3.2Å; H437-P541 HydrophobicContact CB-CB 4.38Å; H437-P541 WeakPolarHBondContact O-CB 3.4Å; H437-E544 IonicContact CE1-OE2 3.14Å; H437-E544 PolarHBondContact CE1-OE2 2.72Å; H437-E544 IonicContact ND1-OE2 3.19Å; H437-E544 PolarHBondContact ND1-OE2 2.95Å
438	L	83.2	Confident	81.1	Confident	114 Å²	114	56.7 Å²	56.7	60%	0.597	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	11.4	-178.6	-46	173.7	0	0	0	114.5	E436 T538 E539	E436-L438 PolarHBondContact O-N 3.33Å; L438-T538 WeakPolarHBondContact O-CG2 3.27Å; L438-E539 HydrophobicContact CD1-CB 3.91Å
439	S	84.8	Confident	78.9	Confident	23 Å²	23	65.4 Å²	65.4	16%	0.161	35%	0.345	C	S	.	.			trans	-85.6	136.6	171.1	-178.8	0	0	0	0	110	E436 H437 V441	E436-S439 WeakPolarHBondContact O-CB 3.43Å; E436-S439 PolarHBondContact O-N 3.15Å; E436-S439 VanDerWaalsContact O-N 3.13Å; H437-S439 PolarHBondContact O-N 3.01Å; H437-S439 VanDerWaalsContact O-N 3.14Å; S439-V441 WeakPolarHBondContact CB-O 3.44Å; S439-V441 PolarHBondContact O-N 2.9Å; S439-V441 PolarHBondContact OG-N 3.33Å; S439-V441 VanDerWaalsContact OG-N 3.12Å; S439-V441 PolarHBondContact OG-O 3.09Å
440	P	80.6	Confident	77.1	Confident	99 Å²	99	68 Å²	68	64%	0.643	36%	0.359	S	S	*	.	S	Bend	trans	-74.7	-12.9	169.2	31.4	-34.3	0	0	0	112.6	P481	P440-P481 HydrophobicContact CG-CG 3.93Å
441	V	82.7	Confident	75.5	Confident	68 Å²	68	71.8 Å²	71.8	41%	0.412	38%	0.379	S	S	.	.	S	Bend	trans	-109	135.2	-179.7	-175.6	0	0	0	0	108.9	S439 F478 P481	S439-V441 WeakPolarHBondContact CB-O 3.44Å; S439-V441 PolarHBondContact O-N 2.9Å; S439-V441 PolarHBondContact OG-N 3.33Å; S439-V441 VanDerWaalsContact OG-N 3.12Å; S439-V441 PolarHBondContact OG-O 3.09Å; V441-F478 HydrophobicContact CB-CE2 4.33Å; V441-F478 HydrophobicContact CG1-CE2 4.24Å; V441-F478 VanDerWaalsContact O-CE2 3.26Å; V441-F478 WeakPolarHBondContact O-CE2 3.35Å; V441-P481 HydrophobicContact CG2-CG 4.16Å
442	A	81.2	Confident	74.4	Confident	75 Å²	75	78 Å²	78	62%	0.62	40%	0.403	S	S	*	.			trans	-94.8	151.6	172.4	0	0	0	0	0	111
443	P	79.7	Confident	74	Confident	24 Å²	24	80.2 Å²	80.2	16%	0.156	42%	0.418	C	S	.	.			trans	-59	148.7	170.8	-23.1	33.7	0	0	0	112.9	W431 E436 V445 F478	W431-P443 HydrophobicContact CZ3-CB 4.43Å; W431-P443 HydrophobicContact CZ3-CG 4.35Å; E436-P443 HydrophobicContact CB-CG 4.37Å; P443-V445 PolarHBondContact O-N 2.8Å; P443-F478 HydrophobicContact CB-CB 3.98Å; P443-F478 HydrophobicContact CB-CD2 4.13Å; P443-F478 HydrophobicContact CB-CG 4Å; P443-F478 HydrophobicContact CG-CB 4.29Å; P443-F478 HydrophobicContact CG-CD1 3.97Å; P443-F478 HydrophobicContact CG-CD2 3.92Å; P443-F478 HydrophobicContact CG-CE1 4.24Å; P443-F478 HydrophobicContact CG-CE2 4.2Å; P443-F478 HydrophobicContact CG-CG 3.81Å; P443-F478 HydrophobicContact CG-CZ 4.35Å
444	D	74.2	Confident	74.1	Confident	69 Å²	69	77.5 Å²	77.5	37%	0.369	41%	0.405	S	S	.	.			trans	-69.8	107.5	171.1	-61.8	-42	0	0	0	108.9	C476 H477 L511	D444-C476 VanDerWaalsContact O-CB 3.24Å; D444-C476 WeakPolarHBondContact O-CB 3.29Å; D444-C476 PolarHBondContact O-SG 3.22Å; D444-H477 WeakPolarHBondContact CB-O 3.5Å; D444-H477 PolarHBondContact N-O 2.8Å; D444-H477 IonicContact OD2-CG 3.14Å; D444-H477 IonicContact OD2-ND1 3.51Å; D444-H477 PolarHBondContact OD2-ND1 2.95Å; D444-L511 HydrophobicContact CB-CD1 4.39Å; D444-L511 HydrophobicContact CB-CD2 3.85Å
445	V	63.8	Low	74.2	Confident	115 Å²	115	77.7 Å²	77.7	70%	0.697	41%	0.406	S	S	*	.			trans	-74.9	123.9	-174.5	-177.5	0	0	0	0	111.7	P443	P443-V445 PolarHBondContact O-N 2.8Å
446	Y	57.6	Low	74.4	Confident	103 Å²	103	77.9 Å²	77.9	40%	0.404	41%	0.407	S	S	.	.			trans	-150.7	126.3	160.5	-166	-91.7	0	0	0	110.7
447	E	53.6	Low	74.8	Confident	89 Å²	89	74 Å²	74	42%	0.416	39%	0.389	S	S	.	.			trans	68.8	98.1	-169.8	-69	168.3	176.1	0	0	114.1	E449 D450 R504	E447-E449 PolarHBondContact O-N 3.46Å; E447-D450 PolarHBondContact O-N 3.24Å; E447-R504 IonicContact OE2-CZ 3.76Å; E447-R504 IonicContact OE2-NH1 3.74Å; E447-R504 IonicContact OE2-NH2 2.81Å; E447-R504 PolarHBondContact OE2-NH2 2.58Å
448	E	47.5	Very low	75.2	Confident	192 Å²	192	71 Å²	71	90%	0.897	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-14.2	-177.8	-74.1	-177.9	165.3	0	0	114.5
449	E	51.5	Low	75.8	Confident	185 Å²	185	66.9 Å²	66.9	86%	0.864	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-6.3	-171.7	-65.2	-175.7	160.6	0	0	114.5	E447	E447-E449 PolarHBondContact O-N 3.46Å
450	D	54.2	Low	76.3	Confident	55 Å²	55	65.8 Å²	65.8	29%	0.294	35%	0.345	S	S	.	.			trans	-119.4	12.2	-163	-86.1	-27.8	0	0	0	116.8	E447 R452	E447-D450 PolarHBondContact O-N 3.24Å; D450-R452 PolarHBondContact O-N 3.12Å
451	L	58.4	Low	77	Confident	90 Å²	90	61.1 Å²	61.1	47%	0.471	31%	0.314	S	S	.	.			trans	-73.8	62.4	166.3	-80.9	156.8	0	0	0	110.4	S453 T474	L451-S453 PolarHBondContact O-N 3.26Å; L451-T474 HydrophobicContact CD2-CG2 4.25Å
452	R	71	Confident	77.5	Confident	136 Å²	136	58.9 Å²	58.9	51%	0.513	30%	0.303	S	S	.	.			trans	-66.5	83.7	171.4	-65.9	-172	-177.3	-158.9	-1.9	108.6	F392 Q430 D450	F392-R452 HydrophobicContact CE1-CB 4.36Å; Q430-R452 WeakPolarHBondContact CG-O 3.27Å; Q430-R452 PolarHBondContact NE2-O 3.39Å; D450-R452 PolarHBondContact O-N 3.12Å
453	S	86.3	Confident	78	Confident	45 Å²	45	56.8 Å²	56.8	32%	0.315	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	158	173.3	64.5	0	0	0	0	111.4	Q430 W431 L451	Q430-S453 PolarHBondContact NE2-O 2.89Å; W431-S453 CarbonylContact O-C 3.57Å; W431-S453 WeakPolarHBondContact O-CA 3.21Å; L451-S453 PolarHBondContact O-N 3.26Å
454	S	92.5	Very high	78.6	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	130	-177.3	165.6	0	0	0	0	112	E393 W431 Q433 L456 V457 T458	E393-S454 VanDerWaalsContact OE2-CA 3.29Å; E393-S454 WeakPolarHBondContact OE2-CA 3.04Å; E393-S454 WeakPolarHBondContact OE2-CB 3.36Å; E393-S454 PolarHBondContact OE2-OG 2.79Å; W431-S454 PolarHBondContact O-N 3.46Å; Q433-S454 PolarHBondContact N-O 3.46Å; S454-L456 VanDerWaalsContact C-N 3.34Å; S454-L456 PolarHBondContact OG-N 3.39Å; S454-V457 WeakPolarHBondContact OG-CG2 3.38Å; S454-V457 PolarHBondContact OG-N 3.15Å; S454-T458 PolarHBondContact O-N 3.37Å; S454-T458 PolarHBondContact O-OG1 3.36Å
455	M	92.7	Very high	79.5	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.015	28%	0.278	C	S	.	.	H	α-helix	trans	-68.9	-36	172	-59.3	-173.3	92.2	0	0	110.9	E393 T458 K459 T545 E548 L549 R552	E393-M455 PolarHBondContact OE2-N 3.23Å; E393-M455 VanDerWaalsContact OE2-N 3.07Å; M455-T458 WeakPolarHBondContact O-CA 3.39Å; M455-T458 VanDerWaalsContact O-CB 3.25Å; M455-T458 WeakPolarHBondContact O-CB 3.43Å; M455-T458 PolarHBondContact O-N 2.92Å; M455-K459 PolarHBondContact O-N 3.44Å; M455-T545 HydrophobicContact CB-CG2 4.23Å; M455-T545 HydrophobicContact CE-CG2 3.89Å; M455-T545 VanDerWaalsContact CE-O 3.31Å; M455-T545 WeakPolarHBondContact CE-O 3.44Å; M455-T545 HydrophobicContact CG-CG2 4.03Å; M455-E548 HydrophobicContact CE-CB 3.63Å; M455-E548 HydrophobicContact CE-CG 3.72Å; M455-L549 HydrophobicContact CB-CD1 3.98Å; M455-L549 HydrophobicContact CB-CD2 3.63Å; M455-L549 HydrophobicContact CB-CG 3.87Å; M455-L549 HydrophobicContact CE-CD2 4Å; M455-L549 HydrophobicContact CE-CG 3.72Å; M455-L549 HydrophobicContact CG-CD2 4.34Å; M455-L549 WeakPolarHBondContact O-CD1 3.44Å; M455-L549 HydrophobicContact SD-CD2 3.79Å; M455-L549 HydrophobicContact SD-CG 4.17Å; M455-R552 PolarHBondContact SD-NH1 2.93Å
456	L	94	Very high	80.9	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.031	25%	0.245	C	C	.	.	H	α-helix	trans	-68.1	-36.2	178.6	-66.4	-176.5	0	0	0	112.4	E393 F402 E404 V407 S454 T458 K459 L460	E393-L456 HydrophobicContact CG-CD1 3.88Å; E393-L456 HydrophobicContact CG-CG 4.24Å; E393-L456 PolarHBondContact OE2-N 3.28Å; F402-L456 HydrophobicContact CD2-CD1 4.25Å; F402-L456 HydrophobicContact CE2-CB 3.94Å; F402-L456 HydrophobicContact CE2-CD1 4.1Å; E404-L456 HydrophobicContact CB-CD1 4.16Å; E404-L456 HydrophobicContact CB-CD2 3.9Å; E404-L456 HydrophobicContact CG-CD2 3.92Å; V407-L456 HydrophobicContact CG2-CB 4.12Å; S454-L456 VanDerWaalsContact C-N 3.34Å; S454-L456 PolarHBondContact OG-N 3.39Å; L456-T458 VanDerWaalsContact C-N 3.29Å; L456-K459 WeakPolarHBondContact O-CB 3.25Å; L456-K459 PolarHBondContact O-N 3.18Å; L456-L460 PolarHBondContact O-N 3.04Å
457	V	95.5	Very high	82.6	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.7	-37.1	171.3	176.5	0	0	0	0	110.7	L389 F402 T428 Q430 P432 S454 L460 A461	L389-V457 HydrophobicContact CD2-CG2 4.22Å; F402-V457 HydrophobicContact CE1-CG2 4.47Å; F402-V457 HydrophobicContact CE2-CG2 4.41Å; F402-V457 HydrophobicContact CZ-CG2 3.73Å; T428-V457 HydrophobicContact CG2-CG1 3.99Å; Q430-V457 HydrophobicContact CB-CG2 4.37Å; P432-V457 HydrophobicContact CB-CG1 3.94Å; P432-V457 HydrophobicContact CG-CG1 4.37Å; S454-V457 WeakPolarHBondContact OG-CG2 3.38Å; S454-V457 PolarHBondContact OG-N 3.15Å; V457-L460 WeakPolarHBondContact O-CB 3.29Å; V457-L460 PolarHBondContact O-N 3.23Å; V457-A461 WeakPolarHBondContact O-CB 3.35Å; V457-A461 PolarHBondContact O-N 3.34Å
458	T	95	Very high	84.5	Confident	0 Å²	0	46 Å²	46	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.9	-47.3	171.8	-68	0	0	0	0	112.2	P432 Q433 S454 M455 L456 L460 A461 A462 Y542 T545 L546	P432-T458 WeakPolarHBondContact CB-OG1 3.45Å; Q433-T458 PolarHBondContact N-OG1 3.4Å; Q433-T458 PolarHBondContact O-OG1 3.08Å; S454-T458 PolarHBondContact O-N 3.37Å; S454-T458 PolarHBondContact O-OG1 3.36Å; M455-T458 WeakPolarHBondContact O-CA 3.39Å; M455-T458 VanDerWaalsContact O-CB 3.25Å; M455-T458 WeakPolarHBondContact O-CB 3.43Å; M455-T458 PolarHBondContact O-N 2.92Å; L456-T458 VanDerWaalsContact C-N 3.29Å; T458-L460 VanDerWaalsContact C-N 3.29Å; T458-L460 PolarHBondContact O-N 3.48Å; T458-A461 PolarHBondContact O-N 3.09Å; T458-A462 WeakPolarHBondContact O-CB 3.39Å; T458-A462 PolarHBondContact O-N 3.48Å; T458-Y542 HydrophobicContact CG2-CD1 3.46Å; T458-Y542 VanDerWaalsContact CG2-CD1 3.46Å; T458-Y542 HydrophobicContact CG2-CD2 4.16Å; T458-Y542 HydrophobicContact CG2-CE1 4.25Å; T458-Y542 HydrophobicContact CG2-CG 3.41Å; T458-Y542 VanDerWaalsContact CG2-CG 3.41Å; T458-T545 HydrophobicContact CG2-CG2 3.89Å; T458-L546 HydrophobicContact CG2-CD2 4.25Å; T458-L546 HydrophobicContact CG2-CG 4.42Å
459	K	94.7	Very high	86.8	Confident	28 Å²	28	36.8 Å²	36.8	12%	0.122	18%	0.177	C	C	.	.	H	α-helix	trans	-57.4	-41.8	173.5	-174.9	-173.4	-179.8	-168.1	0	111.9	E404 D408 I411 M455 L456 A463 L546 L549	E404-K459 IonicContact OE1-NZ 2.72Å; E404-K459 PolarHBondContact OE1-NZ 3.24Å; D408-K459 WeakPolarHBondContact OD1-CE 3.49Å; D408-K459 IonicContact OD1-NZ 3.26Å; D408-K459 PolarHBondContact OD1-NZ 3.11Å; D408-K459 IonicContact OD2-NZ 3.15Å; D408-K459 PolarHBondContact OD2-NZ 3.24Å; I411-K459 HydrophobicContact CD1-CG 4.16Å; M455-K459 PolarHBondContact O-N 3.44Å; L456-K459 WeakPolarHBondContact O-CB 3.25Å; L456-K459 PolarHBondContact O-N 3.18Å; K459-A463 WeakPolarHBondContact O-CB 3.21Å; K459-A463 PolarHBondContact O-N 3.3Å; K459-A463 VanDerWaalsContact O-N 3.12Å; K459-L546 HydrophobicContact CB-CD2 4.37Å; K459-L549 HydrophobicContact CB-CD1 4Å
460	L	95.1	Very high	89	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.1	-49.4	177.5	-176.7	64.4	0	0	0	112.2	L389 V407 L410 I411 L426 T428 L456 V457 T458 A462 A463 L464	L389-L460 HydrophobicContact CB-CD2 4.05Å; L389-L460 HydrophobicContact CD2-CD2 3.89Å; V407-L460 HydrophobicContact CG1-CB 4Å; V407-L460 HydrophobicContact CG1-CD1 4.33Å; L410-L460 HydrophobicContact CD2-CD1 3.8Å; L410-L460 HydrophobicContact CD2-CD2 3.89Å; L410-L460 HydrophobicContact CG-CD1 4.09Å; I411-L460 HydrophobicContact CD1-CD1 4.43Å; I411-L460 HydrophobicContact CG1-CD1 3.68Å; L426-L460 HydrophobicContact CD1-CD2 4.03Å; L426-L460 HydrophobicContact CD1-CG 4.42Å; L426-L460 HydrophobicContact CD2-CG 4.46Å; T428-L460 HydrophobicContact CG2-CD2 4.47Å; L456-L460 PolarHBondContact O-N 3.04Å; V457-L460 WeakPolarHBondContact O-CB 3.29Å; V457-L460 PolarHBondContact O-N 3.23Å; T458-L460 VanDerWaalsContact C-N 3.29Å; T458-L460 PolarHBondContact O-N 3.48Å; L460-A462 VanDerWaalsContact C-N 3.33Å; L460-A462 PolarHBondContact O-N 3.15Å; L460-A463 PolarHBondContact O-N 3.47Å; L460-L464 HydrophobicContact CD1-CD1 3.56Å; L460-L464 HydrophobicContact CD1-CG 3.85Å; L460-L464 HydrophobicContact CG-CD1 4.01Å; L460-L464 HydrophobicContact CG-CG 4.39Å; L460-L464 WeakPolarHBondContact O-CB 3.45Å; L460-L464 WeakPolarHBondContact O-CG 3.45Å; L460-L464 PolarHBondContact O-N 3.19Å
461	A	95	Very high	90.9	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.3	-42.1	179.5	0	0	0	0	0	111.6	L426 V457 T458 A463 R465 P466 Y542	L426-A461 HydrophobicContact CD2-CB 4Å; V457-A461 WeakPolarHBondContact O-CB 3.35Å; V457-A461 PolarHBondContact O-N 3.34Å; T458-A461 PolarHBondContact O-N 3.09Å; A461-A463 PolarHBondContact O-N 3.1Å; A461-R465 PolarHBondContact O-N 3.37Å; A461-R465 VanDerWaalsContact O-N 3.11Å; A461-P466 WeakPolarHBondContact O-CD 3.23Å; A461-Y542 HydrophobicContact CB-CE2 3.93Å
462	A	93.1	Very high	92.5	Very high	21 Å²	21	21.1 Å²	21.1	17%	0.174	10%	0.099	C	C	.	.	H	α-helix	trans	-60.8	-42.2	175.8	0	0	0	0	0	112.8	T458 L460 F540 L546	T458-A462 WeakPolarHBondContact O-CB 3.39Å; T458-A462 PolarHBondContact O-N 3.48Å; L460-A462 VanDerWaalsContact C-N 3.33Å; L460-A462 PolarHBondContact O-N 3.15Å; A462-F540 HydrophobicContact CB-CE2 4.42Å; A462-F540 HydrophobicContact CB-CZ 3.78Å; A462-L546 HydrophobicContact CB-CD1 3.92Å; A462-L546 HydrophobicContact CB-CD2 4.42Å
463	A	92.5	Very high	93.3	Very high	31 Å²	31	16.2 Å²	16.2	26%	0.256	8%	0.083	S	C	.	.	H	α-helix	trans	-74.9	-40.4	-178.4	0	0	0	0	0	113.1	I411 K459 L460 A461	I411-A463 HydrophobicContact CB-CB 4.42Å; I411-A463 HydrophobicContact CD1-CB 3.81Å; I411-A463 HydrophobicContact CG1-CB 3.86Å; I411-A463 HydrophobicContact CG2-CB 3.7Å; K459-A463 WeakPolarHBondContact O-CB 3.21Å; K459-A463 PolarHBondContact O-N 3.3Å; K459-A463 VanDerWaalsContact O-N 3.12Å; L460-A463 PolarHBondContact O-N 3.47Å; A461-A463 PolarHBondContact O-N 3.1Å
464	L	92.7	Very high	93.1	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-84.6	-16.8	-174.5	-63.9	-170.1	0	0	0	114.5	A387 V414 T415 F420 G422 I423 L426 L460	A387-L464 HydrophobicContact CB-CD1 3.89Å; V414-L464 HydrophobicContact CB-CD2 3.67Å; V414-L464 HydrophobicContact CG1-CD2 3.61Å; V414-L464 HydrophobicContact CG2-CD2 4.35Å; T415-L464 HydrophobicContact CG2-CD2 4.19Å; F420-L464 HydrophobicContact CZ-CD2 4.32Å; F420-L464 WeakPolarHBondContact CZ-O 3.44Å; G422-L464 WeakPolarHBondContact CA-O 3.49Å; I423-L464 HydrophobicContact CG2-CB 4.25Å; I423-L464 PolarHBondContact N-O 3.22Å; L426-L464 HydrophobicContact CD1-CD1 4.19Å; L460-L464 HydrophobicContact CD1-CD1 3.56Å; L460-L464 HydrophobicContact CD1-CG 3.85Å; L460-L464 HydrophobicContact CG-CD1 4.01Å; L460-L464 HydrophobicContact CG-CG 4.39Å; L460-L464 WeakPolarHBondContact O-CB 3.45Å; L460-L464 WeakPolarHBondContact O-CG 3.45Å; L460-L464 PolarHBondContact O-N 3.19Å
465	R	92.9	Very high	92.7	Very high	96 Å²	96	14.4 Å²	14.4	36%	0.362	7%	0.071	S	C	.	.			trans	46.6	59	178.4	-54	-180	-178	167.8	-0.7	112.2	A461 N485 N495	A461-R465 PolarHBondContact O-N 3.37Å; A461-R465 VanDerWaalsContact O-N 3.11Å; R465-N485 HydrophobicContact CB-CB 4.07Å; R465-N485 HydrophobicContact CG-CB 4.03Å; R465-N495 PolarHBondContact O-ND2 3.19Å
466	P	93.9	Very high	92.3	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	154	-176.1	30.2	-35.1	0	0	0	112.1	I423 L426 A461 H469 T497	I423-P466 HydrophobicContact CG2-CB 3.66Å; I423-P466 CarbonylContact O-C 3.59Å; I423-P466 VanDerWaalsContact O-CA 3.29Å; I423-P466 WeakPolarHBondContact O-CA 3.48Å; L426-P466 HydrophobicContact CB-CB 3.64Å; L426-P466 HydrophobicContact CB-CG 3.82Å; L426-P466 HydrophobicContact CD2-CG 4.09Å; A461-P466 WeakPolarHBondContact O-CD 3.23Å; P466-H469 HydrophobicContact CG-CB 4.18Å; P466-T497 HydrophobicContact CG-CG2 3.97Å; P466-T497 WeakPolarHBondContact O-CA 3.39Å; P466-T497 WeakPolarHBondContact O-CB 3.4Å; P466-T497 WeakPolarHBondContact O-CG2 3.42Å; P466-T497 PolarHBondContact O-OG1 3.4Å
467	R	91.9	Very high	92.1	Very high	48 Å²	48	15 Å²	15	18%	0.181	7%	0.074	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-35.5	169.6	-69.4	-178.1	61.2	-151.1	1.5	112.2	I423 D424 R498 I519 I520 F522	I423-R467 PolarHBondContact O-N 3.36Å; D424-R467 WeakPolarHBondContact O-CB 3.22Å; D424-R467 PolarHBondContact O-N 2.86Å; D424-R467 IonicContact OD1-NH1 3.33Å; R467-R498 PolarHBondContact O-N 3.09Å; R467-I519 HydrophobicContact CB-CD1 4.18Å; R467-I519 VanDerWaalsContact NH1-CD1 3.34Å; R467-I520 PolarHBondContact NH1-O 3.49Å; R467-F522 HydrophobicContact CG-CD2 4.27Å; R467-F522 HydrophobicContact CG-CE2 4.23Å
468	Y	94.8	Very high	91.8	Very high	29 Å²	29	15.2 Å²	15.2	11%	0.114	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	136.6	170.1	-76.3	-98.7	0	0	0	110.4	D424 I425 L426 F470 R498 F515 F517 I519	D424-Y468 PolarHBondContact O-N 3.29Å; I425-Y468 CarbonylContact C-O 3.38Å; I425-Y468 WeakPolarHBondContact CA-O 3.44Å; L426-Y468 PolarHBondContact N-O 3.14Å; Y468-F470 HydrophobicContact CD1-CE1 4.36Å; Y468-F470 HydrophobicContact CD1-CE2 4.02Å; Y468-F470 AromaticContact CD1-CZ 3.57Å; Y468-F470 HydrophobicContact CD1-CZ 3.57Å; Y468-F470 HydrophobicContact CE1-CZ 4.4Å; Y468-F470 HydrophobicContact CG-CE2 4.07Å; Y468-F470 HydrophobicContact CG-CZ 4.09Å; Y468-R498 CarbonylContact C-O 3.56Å; Y468-R498 WeakPolarHBondContact CA-O 3.29Å; Y468-R498 HydrophobicContact CD1-CB 3.89Å; Y468-R498 HydrophobicContact CE1-CB 3.95Å; Y468-R498 HydrophobicContact CE1-CG 4.46Å; Y468-R498 HydrophobicContact CG-CB 4.44Å; Y468-F515 HydrophobicContact CE1-CE1 4.16Å; Y468-F517 HydrophobicContact CE1-CD2 4.39Å; Y468-F517 HydrophobicContact CE2-CD2 4.39Å; Y468-I519 HydrophobicContact CD2-CD1 3.55Å; Y468-I519 HydrophobicContact CD2-CG1 4.5Å; Y468-I519 HydrophobicContact CE2-CB 4.36Å; Y468-I519 HydrophobicContact CE2-CD1 3.65Å; Y468-I519 HydrophobicContact CE2-CG1 4.14Å
469	H	96.2	Very high	91.6	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	115.5	171.2	-175.3	179.4	0	0	0	108.5	L426 T428 P432 P466 S471 T497 R498 F499 V500	L426-H469 HydrophobicContact CB-CB 4.47Å; L426-H469 WeakPolarHBondContact O-CA 3.17Å; L426-H469 PolarHBondContact O-CD2 3.33Å; T428-H469 PolarHBondContact OG1-NE2 3.36Å; P432-H469 VanDerWaalsContact CG-CE1 3.49Å; P432-H469 WeakPolarHBondContact CG-CE1 3.49Å; P466-H469 HydrophobicContact CG-CB 4.18Å; H469-S471 PolarHBondContact NE2-OG 3.21Å; H469-T497 HydrophobicContact CB-CG2 4.07Å; H469-R498 PolarHBondContact N-O 3.03Å; H469-F499 HydrophobicContact CB-CD2 3.99Å; H469-F499 AromaticContact CG-CD2 3.82Å; H469-F499 AromaticContact ND1-CD2 3.86Å; H469-F499 WeakPolarHBondContact O-CA 3.47Å; H469-V500 PolarHBondContact O-N 2.96Å
470	F	96.4	Very high	91.4	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.5	176	-59.2	-83.2	0	0	0	111.2	V287 I425 L426 L427 T428 Y468 V500 F515 F517	V287-F470 HydrophobicContact CB-CD1 4.08Å; V287-F470 HydrophobicContact CB-CE1 4.25Å; V287-F470 HydrophobicContact CB-CG 4.3Å; V287-F470 HydrophobicContact CG1-CB 3.94Å; V287-F470 HydrophobicContact CG1-CD1 3.97Å; V287-F470 HydrophobicContact CG1-CD2 4.37Å; V287-F470 HydrophobicContact CG1-CG 3.85Å; V287-F470 HydrophobicContact CG2-CD1 3.94Å; V287-F470 HydrophobicContact CG2-CD2 3.86Å; V287-F470 HydrophobicContact CG2-CE1 3.81Å; V287-F470 HydrophobicContact CG2-CE2 3.69Å; V287-F470 HydrophobicContact CG2-CG 3.99Å; V287-F470 HydrophobicContact CG2-CZ 3.68Å; I425-F470 HydrophobicContact CG2-CD2 3.78Å; I425-F470 HydrophobicContact CG2-CE2 4.05Å; L426-F470 PolarHBondContact O-N 3.41Å; L427-F470 HydrophobicContact CD2-CB 3.87Å; L427-F470 HydrophobicContact CD2-CD2 4.01Å; L427-F470 HydrophobicContact CD2-CG 4.36Å; T428-F470 PolarHBondContact N-O 3.24Å; Y468-F470 HydrophobicContact CD1-CE1 4.36Å; Y468-F470 HydrophobicContact CD1-CE2 4.02Å; Y468-F470 AromaticContact CD1-CZ 3.57Å; Y468-F470 HydrophobicContact CD1-CZ 3.57Å; Y468-F470 HydrophobicContact CE1-CZ 4.4Å; Y468-F470 HydrophobicContact CG-CE2 4.07Å; Y468-F470 HydrophobicContact CG-CZ 4.09Å; F470-V500 WeakPolarHBondContact CA-O 3.45Å; F470-V500 HydrophobicContact CD1-CB 3.67Å; F470-V500 HydrophobicContact CD1-CG1 4.21Å; F470-V500 HydrophobicContact CD1-CG2 4.35Å; F470-V500 HydrophobicContact CE1-CB 3.74Å; F470-V500 HydrophobicContact CE1-CG1 4.23Å; F470-V500 HydrophobicContact CE1-CG2 3.94Å; F470-F515 HydrophobicContact CE1-CB 4.45Å; F470-F515 AromaticContact CE1-CD1 3.49Å; F470-F515 HydrophobicContact CE1-CD1 3.49Å; F470-F515 VanDerWaalsContact CE1-CD1 3.49Å; F470-F515 AromaticContact CE1-CE1 3.9Å; F470-F515 HydrophobicContact CE1-CE1 3.9Å; F470-F515 HydrophobicContact CE1-CG 4.12Å; F470-F515 AromaticContact CZ-CD1 3.84Å; F470-F515 HydrophobicContact CZ-CD1 3.84Å; F470-F515 HydrophobicContact CZ-CE1 4.02Å; F470-F517 HydrophobicContact CE2-CE1 4.2Å; F470-F517 HydrophobicContact CE2-CE2 4.43Å; F470-F517 HydrophobicContact CE2-CZ 4.01Å; F470-F517 HydrophobicContact CZ-CD1 4.15Å; F470-F517 HydrophobicContact CZ-CE1 4Å; F470-F517 HydrophobicContact CZ-CE2 4.46Å; F470-F517 HydrophobicContact CZ-CZ 4.16Å
471	S	94.8	Very high	91.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	158.6	175.5	-59.6	0	0	0	0	111.9	T428 Q430 H469 V500 G501 L502	T428-S471 VanDerWaalsContact O-CA 3.3Å; T428-S471 WeakPolarHBondContact O-CA 3.16Å; T428-S471 PolarHBondContact OG1-OG 2.73Å; Q430-S471 PolarHBondContact O-OG 3.18Å; H469-S471 PolarHBondContact NE2-OG 3.21Å; S471-V500 PolarHBondContact N-O 2.7Å; S471-G501 WeakPolarHBondContact O-CA 3.38Å; S471-L502 PolarHBondContact O-N 2.87Å
472	A	91.7	Very high	91	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.097	C	C	.	.			trans	-142.6	-155.1	179.4	0	0	0	0	0	111.2	G319 S429 W431 T474	G319-A472 VanDerWaalsContact CA-CB 3.48Å; S429-A472 CarbonylContact O-C 3.51Å; W431-A472 VanDerWaalsContact CD1-O 3.22Å; W431-A472 PolarHBondContact NE1-O 2.81Å; A472-T474 PolarHBondContact O-N 2.81Å
473	N	87.8	Confident	90.9	Very high	34 Å²	34	18.3 Å²	18.3	18%	0.182	9%	0.089	C	C	.	.	S	Bend	trans	66.1	3	178.8	-60.7	-70.9	0	0	0	117.4	D290 E320 F392 S429	D290-N473 WeakPolarHBondContact OD1-CA 3.26Å; D290-N473 PolarHBondContact OD1-N 3.23Å; D290-N473 PolarHBondContact OD1-OD1 3.01Å; D290-N473 WeakPolarHBondContact OD2-CA 3.46Å; D290-N473 PolarHBondContact OD2-N 2.94Å; D290-N473 VanDerWaalsContact OD2-N 3.14Å; E320-N473 PolarHBondContact N-OD1 2.99Å; F392-N473 HydrophobicContact CE1-CB 4.43Å; F392-N473 HydrophobicContact CZ-CB 4.27Å; S429-N473 PolarHBondContact O-ND2 2.92Å
474	T	83	Confident	90.7	Very high	3 Å²	3	19 Å²	19	2%	0.018	9%	0.085	C	C	.	.	S	Bend	trans	-95	-7.3	174.2	56.6	0	0	0	0	112.8	W431 L451 A472 C476	W431-T474 HydrophobicContact CB-CG2 4.4Å; W431-T474 VanDerWaalsContact CD1-CG2 3.45Å; W431-T474 HydrophobicContact CD2-CG2 3.89Å; W431-T474 HydrophobicContact CG-CG2 3.71Å; W431-T474 HydrophobicContact CZ2-CG2 4.4Å; W431-T474 WeakPolarHBondContact CZ2-OG1 3.44Å; W431-T474 PolarHBondContact NE1-OG1 2.87Å; L451-T474 HydrophobicContact CD2-CG2 4.25Å; A472-T474 PolarHBondContact O-N 2.81Å; T474-C476 PolarHBondContact O-N 2.91Å; T474-C476 PolarHBondContact O-SG 3.06Å; T474-C476 VanDerWaalsContact O-SG 3.35Å; T474-C476 PolarHBondContact OG1-N 3.46Å
475	G	83.4	Confident	90.5	Very high	4 Å²	4	19.5 Å²	19.5	4%	0.041	9%	0.087	C	C	.	.	S	Bend	trans	66.5	-6.8	-171.1	0	0	0	0	0	114.8	S503	G475-S503 WeakPolarHBondContact O-CB 3.21Å; G475-S503 PolarHBondContact O-OG 2.64Å
476	C	83.9	Confident	89.5	Confident	4 Å²	4	15.5 Å²	15.5	3%	0.027	7%	0.074	C	C	.	.			trans	-94	154	-178.3	-60.1	0	0	0	0	110.7	W431 D444 T474 L502 S503	W431-C476 HydrophobicContact CH2-CB 4.25Å; W431-C476 HydrophobicContact CZ2-CB 4.43Å; D444-C476 VanDerWaalsContact O-CB 3.24Å; D444-C476 WeakPolarHBondContact O-CB 3.29Å; D444-C476 PolarHBondContact O-SG 3.22Å; T474-C476 PolarHBondContact O-N 2.91Å; T474-C476 PolarHBondContact O-SG 3.06Å; T474-C476 VanDerWaalsContact O-SG 3.35Å; T474-C476 PolarHBondContact OG1-N 3.46Å; C476-L502 CarbonylContact O-C 3.43Å; C476-S503 PolarHBondContact O-N 3.03Å
477	H	89	Confident	88	Confident	18 Å²	18	19 Å²	19	8%	0.083	10%	0.097	C	C	.	.			trans	-106.2	137.8	166	165.1	-97	0	0	0	108.9	D444 G501 L511	D444-H477 WeakPolarHBondContact CB-O 3.5Å; D444-H477 PolarHBondContact N-O 2.8Å; D444-H477 IonicContact OD2-CG 3.14Å; D444-H477 IonicContact OD2-ND1 3.51Å; D444-H477 PolarHBondContact OD2-ND1 2.95Å; H477-G501 WeakPolarHBondContact CA-O 3.26Å; H477-G501 PolarHBondContact CD2-O 2.82Å; H477-L511 HydrophobicContact CB-CB 4.05Å
478	F	90.2	Very high	86.5	Confident	3 Å²	3	21.7 Å²	21.7	1%	0.013	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	114.2	176	-178.7	-137.6	0	0	0	110.9	W431 V435 E436 V441 P443 R480 F499 V500 G501	W431-F478 HydrophobicContact CH2-CB 3.29Å; W431-F478 HydrophobicContact CH2-CD1 4.24Å; W431-F478 HydrophobicContact CH2-CG 4.21Å; W431-F478 HydrophobicContact CZ2-CB 4.31Å; W431-F478 HydrophobicContact CZ3-CB 3.66Å; W431-F478 AromaticContact CZ3-CD1 3.7Å; W431-F478 HydrophobicContact CZ3-CD1 3.7Å; W431-F478 HydrophobicContact CZ3-CG 4.09Å; V435-F478 HydrophobicContact CG1-CE1 4.34Å; E436-F478 HydrophobicContact CB-CE1 4.44Å; E436-F478 HydrophobicContact CB-CZ 4.49Å; V441-F478 HydrophobicContact CB-CE2 4.33Å; V441-F478 HydrophobicContact CG1-CE2 4.24Å; V441-F478 VanDerWaalsContact O-CE2 3.26Å; V441-F478 WeakPolarHBondContact O-CE2 3.35Å; P443-F478 HydrophobicContact CB-CB 3.98Å; P443-F478 HydrophobicContact CB-CD2 4.13Å; P443-F478 HydrophobicContact CB-CG 4Å; P443-F478 HydrophobicContact CG-CB 4.29Å; P443-F478 HydrophobicContact CG-CD1 3.97Å; P443-F478 HydrophobicContact CG-CD2 3.92Å; P443-F478 HydrophobicContact CG-CE1 4.24Å; P443-F478 HydrophobicContact CG-CE2 4.2Å; P443-F478 HydrophobicContact CG-CG 3.81Å; P443-F478 HydrophobicContact CG-CZ 4.35Å; F478-R480 HydrophobicContact CD1-CB 4.47Å; F478-R480 HydrophobicContact CE1-CB 3.82Å; F478-R480 HydrophobicContact CE1-CG 4.16Å; F478-R480 HydrophobicContact CE2-CB 4.38Å; F478-R480 HydrophobicContact CZ-CB 3.76Å; F478-R480 HydrophobicContact CZ-CG 3.88Å; F478-F499 AromaticContact CD1-CD1 3.83Å; F478-F499 HydrophobicContact CD1-CD1 3.83Å; F478-F499 AromaticContact CD1-CE1 3.78Å; F478-F499 HydrophobicContact CD1-CE1 3.78Å; F478-F499 HydrophobicContact CE1-CD1 4.22Å; F478-F499 HydrophobicContact CE1-CE1 4.48Å; F478-V500 CarbonylContact O-C 3.54Å; F478-V500 WeakPolarHBondContact O-CA 3.33Å; F478-G501 PolarHBondContact N-O 2.73Å; F478-G501 PolarHBondContact O-N 3.26Å
479	E	91.4	Very high	84.6	Confident	81 Å²	81	26.9 Å²	26.9	38%	0.379	15%	0.149	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	99.7	172.2	-172.9	170.7	176.7	0	0	108.4	V500	E479-V500 HydrophobicContact CG-CG2 4.41Å
480	R	90.1	Very high	82.7	Confident	6 Å²	6	29.4 Å²	29.4	2%	0.023	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-78.8	138.8	-178.9	-168.4	-160.2	163.1	103.5	0.1	109.7	V435 H437 F478 F499 T538	V435-R480 VanDerWaalsContact C-NH1 3.31Å; V435-R480 WeakPolarHBondContact O-CD 3.47Å; V435-R480 PolarHBondContact O-NH1 3.47Å; H437-R480 VanDerWaalsContact O-CZ 3.24Å; H437-R480 PolarHBondContact O-NH1 3.32Å; H437-R480 PolarHBondContact O-NH2 3.2Å; F478-R480 HydrophobicContact CD1-CB 4.47Å; F478-R480 HydrophobicContact CE1-CB 3.82Å; F478-R480 HydrophobicContact CE1-CG 4.16Å; F478-R480 HydrophobicContact CE2-CB 4.38Å; F478-R480 HydrophobicContact CZ-CB 3.76Å; F478-R480 HydrophobicContact CZ-CG 3.88Å; R480-F499 HydrophobicContact CB-CB 4.11Å; R480-F499 HydrophobicContact CB-CD1 4.43Å; R480-F499 PolarHBondContact N-O 2.86Å; R480-T538 PolarHBondContact NH2-OG1 3.12Å
481	P	89.2	Confident	80.5	Confident	19 Å²	19	40.8 Å²	40.8	12%	0.123	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-52.2	146.7	163.2	-26.5	36.2	0	0	0	111.5	P440 V441 Y483 V536 T538	P440-P481 HydrophobicContact CG-CG 3.93Å; V441-P481 HydrophobicContact CG2-CG 4.16Å; P481-Y483 PolarHBondContact O-N 3.12Å; P481-V536 HydrophobicContact CB-CG1 4.15Å; P481-V536 HydrophobicContact CG-CG1 4.43Å; P481-T538 HydrophobicContact CB-CG2 4.3Å
482	P	91.4	Very high	78.4	Confident	9 Å²	9	47 Å²	47	6%	0.058	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-54.3	143.4	-177.7	-18.9	26.4	0	0	0	111.7	T497 R498 T537 T538	P482-T497 CarbonylContact C-O 3.58Å; P482-T497 WeakPolarHBondContact CA-O 3.28Å; P482-R498 HydrophobicContact CB-CG 4.11Å; P482-R498 HydrophobicContact CG-CG 3.93Å; P482-T537 CarbonylContact O-C 3.59Å; P482-T537 VanDerWaalsContact O-CA 3.26Å; P482-T537 WeakPolarHBondContact O-CA 2.94Å; P482-T538 PolarHBondContact O-N 3.11Å; P482-T538 PolarHBondContact O-OG1 3.48Å
483	Y	91.5	Very high	76.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	151.8	172.9	64.3	-93.7	0	0	0	111.9	P481 N485 T496 T497 F499 T538 F540 P541 Y542	P481-Y483 PolarHBondContact O-N 3.12Å; Y483-N485 VanDerWaalsContact CE2-OD1 3.29Å; Y483-N485 WeakPolarHBondContact CE2-OD1 3.47Å; Y483-T496 CarbonylContact O-C 3.54Å; Y483-T496 VanDerWaalsContact O-CA 3.26Å; Y483-T496 WeakPolarHBondContact O-CA 3.44Å; Y483-T497 HydrophobicContact CE1-CG2 3.69Å; Y483-T497 HydrophobicContact CE2-CG2 4.32Å; Y483-T497 PolarHBondContact N-O 3.35Å; Y483-T497 PolarHBondContact O-N 3.08Å; Y483-T497 VanDerWaalsContact OH-CG2 3.29Å; Y483-T497 WeakPolarHBondContact OH-CG2 3.32Å; Y483-F499 HydrophobicContact CE1-CB 4.3Å; Y483-T538 VanDerWaalsContact CA-O 3.29Å; Y483-T538 WeakPolarHBondContact CA-O 3.35Å; Y483-T538 WeakPolarHBondContact CB-OG1 3.37Å; Y483-F540 HydrophobicContact CD2-CD2 4.28Å; Y483-F540 HydrophobicContact CE2-CD2 4.33Å; Y483-P541 HydrophobicContact CD1-CG 4.2Å; Y483-P541 HydrophobicContact CD2-CG 4.04Å; Y483-P541 HydrophobicContact CE1-CG 4.34Å; Y483-P541 HydrophobicContact CE2-CG 4.19Å; Y483-P541 HydrophobicContact CG-CG 4.04Å; Y483-Y542 AromaticContact CE2-CE2 3.98Å; Y483-Y542 HydrophobicContact CE2-CE2 3.98Å; Y483-Y542 AromaticContact CZ-CE2 3.78Å; Y483-Y542 WeakPolarHBondContact OH-CE2 3.33Å; Y483-Y542 PolarHBondContact OH-OH 2.68Å; Y483-Y542 VanDerWaalsContact OH-OH 3.08Å
484	R	89	Confident	75.8	Confident	46 Å²	46	51 Å²	51	17%	0.174	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	134	175.8	-65.4	177.5	171.1	135.9	-0.3	110.7	S486 E533 T537 T538 E539 F540	R484-S486 VanDerWaalsContact C-N 3.32Å; R484-E533 IonicContact CZ-OE1 2.84Å; R484-E533 IonicContact CZ-OE2 2.86Å; R484-E533 IonicContact NE-OE1 3.07Å; R484-E533 PolarHBondContact NE-OE1 3.4Å; R484-E533 IonicContact NE-OE2 2.95Å; R484-E533 PolarHBondContact NE-OE2 3.03Å; R484-E533 IonicContact NH2-OE1 2.56Å; R484-E533 IonicContact NH2-OE2 3.97Å; R484-E533 PolarHBondContact NH2-OE2 3.06Å; R484-T537 HydrophobicContact CG-CG2 3.66Å; R484-T538 PolarHBondContact N-O 3.14Å; R484-E539 IonicContact CZ-OE1 2.99Å; R484-E539 IonicContact NH1-OE1 3.47Å; R484-E539 PolarHBondContact NH1-OE1 3.25Å; R484-F540 WeakPolarHBondContact O-CB 3.35Å; R484-F540 WeakPolarHBondContact O-CD2 3.34Å
485	N	87.3	Confident	75.7	Confident	9 Å²	9	51.2 Å²	51.2	5%	0.048	27%	0.272	C	S	.	.	S	Bend	trans	-84.4	-5.1	172.6	-70.1	-35.6	0	0	0	113.8	R465 Y483 N495 T497	R465-N485 HydrophobicContact CB-CB 4.07Å; R465-N485 HydrophobicContact CG-CB 4.03Å; Y483-N485 VanDerWaalsContact CE2-OD1 3.29Å; Y483-N485 WeakPolarHBondContact CE2-OD1 3.47Å; N485-N495 WeakPolarHBondContact CB-O 3.31Å; N485-N495 PolarHBondContact N-O 2.86Å; N485-N495 VanDerWaalsContact N-O 3.14Å; N485-N495 PolarHBondContact ND2-O 3.15Å; N485-N495 PolarHBondContact ND2-OD1 3.22Å; N485-T497 PolarHBondContact ND2-OG1 2.75Å; N485-T497 PolarHBondContact OD1-OG1 3.11Å
486	S	73.6	Confident	76	Confident	13 Å²	13	51.9 Å²	51.9	9%	0.091	28%	0.275	C	S	.	.	S	Bend	trans	-126.9	129.8	178.4	-64.8	0	0	0	0	109.2	R484 G494	R484-S486 VanDerWaalsContact C-N 3.32Å; S486-G494 WeakPolarHBondContact OG-CA 3.19Å
487	P	62.6	Low	76.5	Confident	74 Å²	74	51.7 Å²	51.7	48%	0.481	27%	0.274	S	S	.	.			trans	-62.3	140.7	175.5	-3.3	9.7	0	0	0	110.1	V489 A490	P487-V489 PolarHBondContact O-N 3.2Å; P487-A490 WeakPolarHBondContact O-CB 3.35Å; P487-A490 PolarHBondContact O-N 3.38Å
488	L	59.4	Low	76.7	Confident	104 Å²	104	55.7 Å²	55.7	55%	0.545	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-49.8	-33	178.1	-81	172.7	0	0	0	113.7	A490 E539	L488-A490 VanDerWaalsContact C-N 3.29Å; L488-A490 PolarHBondContact O-N 3.41Å; L488-E539 WeakPolarHBondContact CD1-OE1 3.46Å
489	V	54.4	Low	76.9	Confident	138 Å²	138	55.5 Å²	55.5	84%	0.836	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-67.1	-29.2	-178.5	-175.5	0	0	0	0	112.2	P487 R491	P487-V489 PolarHBondContact O-N 3.2Å; V489-R491 VanDerWaalsContact C-N 3.26Å; V489-R491 PolarHBondContact O-N 3.1Å
490	A	57.6	Low	77.1	Confident	53 Å²	53	51.8 Å²	51.8	44%	0.438	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-74.3	-13	-175	0	0	0	0	0	113.7	P487 L488 Q492	P487-A490 WeakPolarHBondContact O-CB 3.35Å; P487-A490 PolarHBondContact O-N 3.38Å; L488-A490 VanDerWaalsContact C-N 3.29Å; L488-A490 PolarHBondContact O-N 3.41Å; A490-Q492 WeakPolarHBondContact O-CG 3.26Å; A490-Q492 PolarHBondContact O-N 3.31Å
491	R	48.4	Very low	77.2	Confident	238 Å²	238	51.5 Å²	51.5	90%	0.898	27%	0.269	S	S	*	.			trans	47.7	16.8	-176.4	-68.8	-171	177.2	-175.4	0.3	115.3	V489	V489-R491 VanDerWaalsContact C-N 3.26Å; V489-R491 PolarHBondContact O-N 3.1Å
492	Q	52.2	Low	77.4	Confident	131 Å²	131	50.6 Å²	50.6	61%	0.612	26%	0.264	S	S	*	.			trans	-90.6	132.5	174.9	-67.5	-164.5	-6.7	0	0	108.9	A490 G494	A490-Q492 WeakPolarHBondContact O-CG 3.26Å; A490-Q492 PolarHBondContact O-N 3.31Å; Q492-G494 PolarHBondContact O-N 3.47Å
493	P	56.4	Low	77.4	Confident	108 Å²	108	50.2 Å²	50.2	70%	0.701	26%	0.261	S	S	*	.			trans	-63.8	106	175	25	-31	0	0	0	109.1	T531	P493-T531 HydrophobicContact CB-CG2 3.68Å
494	G	67	Low	77.3	Confident	11 Å²	11	53.5 Å²	53.5	11%	0.113	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-99.8	150.4	175.3	0	0	0	0	0	111	S486 Q492 T531	S486-G494 WeakPolarHBondContact OG-CA 3.19Å; Q492-G494 PolarHBondContact O-N 3.47Å; G494-T531 WeakPolarHBondContact O-CG2 3.22Å
495	N	82.8	Confident	77.2	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.037	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-76.3	161.4	168.5	63.1	-17.8	0	0	0	111.4	R465 N485 A530	R465-N495 PolarHBondContact O-ND2 3.19Å; N485-N495 WeakPolarHBondContact CB-O 3.31Å; N485-N495 PolarHBondContact N-O 2.86Å; N485-N495 VanDerWaalsContact N-O 3.14Å; N485-N495 PolarHBondContact ND2-O 3.15Å; N485-N495 PolarHBondContact ND2-OD1 3.22Å; N495-A530 VanDerWaalsContact CA-O 3.27Å; N495-A530 WeakPolarHBondContact CA-O 2.96Å; N495-A530 HydrophobicContact CB-CB 4.27Å
496	T	89.3	Confident	77	Confident	17 Å²	17	53.7 Å²	53.7	10%	0.104	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	142.3	172.6	64.4	0	0	0	0	111.4	Y483 E533 T537	Y483-T496 CarbonylContact O-C 3.54Å; Y483-T496 VanDerWaalsContact O-CA 3.26Å; Y483-T496 WeakPolarHBondContact O-CA 3.44Å; T496-E533 HydrophobicContact CG2-CG 4.07Å; T496-T537 HydrophobicContact CG2-CG2 4.01Å
497	T	93.1	Very high	77.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	134.8	174	-53.6	0	0	0	0	111.2	P466 H469 P482 Y483 N485	P466-T497 HydrophobicContact CG-CG2 3.97Å; P466-T497 WeakPolarHBondContact O-CA 3.39Å; P466-T497 WeakPolarHBondContact O-CB 3.4Å; P466-T497 WeakPolarHBondContact O-CG2 3.42Å; P466-T497 PolarHBondContact O-OG1 3.4Å; H469-T497 HydrophobicContact CB-CG2 4.07Å; P482-T497 CarbonylContact C-O 3.58Å; P482-T497 WeakPolarHBondContact CA-O 3.28Å; Y483-T497 HydrophobicContact CE1-CG2 3.69Å; Y483-T497 HydrophobicContact CE2-CG2 4.32Å; Y483-T497 PolarHBondContact N-O 3.35Å; Y483-T497 PolarHBondContact O-N 3.08Å; Y483-T497 VanDerWaalsContact OH-CG2 3.29Å; Y483-T497 WeakPolarHBondContact OH-CG2 3.32Å; N485-T497 PolarHBondContact ND2-OG1 2.75Å; N485-T497 PolarHBondContact OD1-OG1 3.11Å
498	R	93.7	Very high	78.4	Confident	102 Å²	102	54.9 Å²	54.9	39%	0.385	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	115.2	166.2	-68.4	174.4	-172.9	-95.6	0.5	109.4	R467 Y468 H469 P482	R467-R498 PolarHBondContact O-N 3.09Å; Y468-R498 CarbonylContact C-O 3.56Å; Y468-R498 WeakPolarHBondContact CA-O 3.29Å; Y468-R498 HydrophobicContact CD1-CB 3.89Å; Y468-R498 HydrophobicContact CE1-CB 3.95Å; Y468-R498 HydrophobicContact CE1-CG 4.46Å; Y468-R498 HydrophobicContact CG-CB 4.44Å; H469-R498 PolarHBondContact N-O 3.03Å; P482-R498 HydrophobicContact CB-CG 4.11Å; P482-R498 HydrophobicContact CG-CG 3.93Å
499	F	95	Very high	79.5	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.3	174.9	179	-94.5	0	0	0	110.4	W431 P432 V435 H469 F478 R480 Y483	W431-F499 HydrophobicContact CD2-CE1 4.08Å; W431-F499 AromaticContact CD2-CZ 3.69Å; W431-F499 HydrophobicContact CD2-CZ 3.69Å; W431-F499 AromaticContact CE3-CE1 3.79Å; W431-F499 HydrophobicContact CE3-CE1 3.79Å; W431-F499 AromaticContact CE3-CZ 3.81Å; W431-F499 HydrophobicContact CE3-CZ 3.81Å; W431-F499 HydrophobicContact CG-CZ 4.03Å; W431-F499 HydrophobicContact CH2-CE1 4.42Å; W431-F499 AromaticContact CZ3-CE1 3.98Å; W431-F499 HydrophobicContact CZ3-CE1 3.98Å; W431-F499 HydrophobicContact CZ3-CZ 4.43Å; P432-F499 VanDerWaalsContact CD-CE2 3.48Å; P432-F499 HydrophobicContact CG-CD2 4.2Å; P432-F499 HydrophobicContact CG-CE2 3.78Å; P432-F499 HydrophobicContact CG-CZ 4.45Å; V435-F499 HydrophobicContact CG1-CD1 4.37Å; V435-F499 HydrophobicContact CG1-CE1 3.97Å; V435-F499 HydrophobicContact CG1-CZ 4.17Å; V435-F499 HydrophobicContact CG2-CB 3.98Å; V435-F499 HydrophobicContact CG2-CD1 3.54Å; V435-F499 HydrophobicContact CG2-CD2 3.68Å; V435-F499 HydrophobicContact CG2-CE1 3.9Å; V435-F499 HydrophobicContact CG2-CE2 4.03Å; V435-F499 HydrophobicContact CG2-CG 3.42Å; V435-F499 VanDerWaalsContact CG2-CG 3.42Å; V435-F499 HydrophobicContact CG2-CZ 4.12Å; H469-F499 HydrophobicContact CB-CD2 3.99Å; H469-F499 AromaticContact CG-CD2 3.82Å; H469-F499 AromaticContact ND1-CD2 3.86Å; H469-F499 WeakPolarHBondContact O-CA 3.47Å; F478-F499 AromaticContact CD1-CD1 3.83Å; F478-F499 HydrophobicContact CD1-CD1 3.83Å; F478-F499 AromaticContact CD1-CE1 3.78Å; F478-F499 HydrophobicContact CD1-CE1 3.78Å; F478-F499 HydrophobicContact CE1-CD1 4.22Å; F478-F499 HydrophobicContact CE1-CE1 4.48Å; R480-F499 HydrophobicContact CB-CB 4.11Å; R480-F499 HydrophobicContact CB-CD1 4.43Å; R480-F499 PolarHBondContact N-O 2.86Å; Y483-F499 HydrophobicContact CE1-CB 4.3Å
500	V	94.6	Very high	81	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.012	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	109.1	177.1	-174.8	0	0	0	0	109.4	H469 F470 S471 F478 E479 L502 F515	H469-V500 PolarHBondContact O-N 2.96Å; F470-V500 WeakPolarHBondContact CA-O 3.45Å; F470-V500 HydrophobicContact CD1-CB 3.67Å; F470-V500 HydrophobicContact CD1-CG1 4.21Å; F470-V500 HydrophobicContact CD1-CG2 4.35Å; F470-V500 HydrophobicContact CE1-CB 3.74Å; F470-V500 HydrophobicContact CE1-CG1 4.23Å; F470-V500 HydrophobicContact CE1-CG2 3.94Å; S471-V500 PolarHBondContact N-O 2.7Å; F478-V500 CarbonylContact O-C 3.54Å; F478-V500 WeakPolarHBondContact O-CA 3.33Å; E479-V500 HydrophobicContact CG-CG2 4.41Å; V500-L502 HydrophobicContact CG1-CD2 3.88Å; V500-L502 HydrophobicContact CG1-CG 4.27Å; V500-F515 HydrophobicContact CG1-CD2 4.01Å; V500-F515 HydrophobicContact CG1-CE2 4.38Å; V500-F515 HydrophobicContact CG1-CG 4.26Å; V500-F515 HydrophobicContact CG2-CE1 4.47Å; V500-F515 HydrophobicContact CG2-CE2 4.26Å; V500-F515 HydrophobicContact CG2-CZ 4.19Å
501	G	93.1	Very high	82.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	125.8	168.5	0	0	0	0	0	111.1	S471 H477 F478	S471-G501 WeakPolarHBondContact O-CA 3.38Å; H477-G501 WeakPolarHBondContact CA-O 3.26Å; H477-G501 PolarHBondContact CD2-O 2.82Å; F478-G501 PolarHBondContact N-O 2.73Å; F478-G501 PolarHBondContact O-N 3.26Å
502	L	92.7	Very high	84.4	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.234	C	C	.	.			trans	-109.3	138.1	-178.2	-63.8	174.3	0	0	0	112	V287 S471 C476 V500 F515	V287-L502 HydrophobicContact CB-CD1 3.93Å; V287-L502 HydrophobicContact CG1-CD1 3.71Å; S471-L502 PolarHBondContact O-N 2.87Å; C476-L502 CarbonylContact O-C 3.43Å; V500-L502 HydrophobicContact CG1-CD2 3.88Å; V500-L502 HydrophobicContact CG1-CG 4.27Å; L502-F515 HydrophobicContact CD1-CB 4.34Å; L502-F515 HydrophobicContact CD2-CB 3.97Å
503	S	90.8	Very high	86.2	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.007	21%	0.21	C	C	.	.			trans	-79.9	-176.4	178.9	-173.8	0	0	0	0	112.4	D290 G475 C476 K512 Y513	D290-S503 PolarHBondContact N-O 3.36Å; G475-S503 WeakPolarHBondContact O-CB 3.21Å; G475-S503 PolarHBondContact O-OG 2.64Å; C476-S503 PolarHBondContact O-N 3.03Å; S503-K512 PolarHBondContact N-O 2.96Å; S503-K512 VanDerWaalsContact N-O 3.11Å; S503-Y513 WeakPolarHBondContact O-CB 3.41Å
504	R	89.7	Confident	87.8	Confident	70 Å²	70	34.6 Å²	34.6	26%	0.264	19%	0.189	S	C	.	.	B	Isolated β-bridge	trans	-81.6	141.7	178.6	66.9	-173.4	93.4	168.9	1.4	112.5	D290 L292 E447 G506 N507	D290-R504 HydrophobicContact CB-CB 3.94Å; D290-R504 CarbonylContact O-C 3.45Å; L292-R504 HydrophobicContact CD1-CB 4.07Å; E447-R504 IonicContact OE2-CZ 3.76Å; E447-R504 IonicContact OE2-NH1 3.74Å; E447-R504 IonicContact OE2-NH2 2.81Å; E447-R504 PolarHBondContact OE2-NH2 2.58Å; R504-G506 PolarHBondContact O-N 3.45Å; R504-N507 HydrophobicContact CG-CB 3.66Å; R504-N507 WeakPolarHBondContact O-CB 3.45Å; R504-N507 PolarHBondContact O-N 2.92Å; R504-N507 PolarHBondContact O-ND2 3.26Å
505	C	87.9	Confident	89	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.02	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	125.2	176.5	-175.3	0	0	0	0	110.1	D290 N294 Y513	D290-C505 VanDerWaalsContact O-CB 3.29Å; D290-C505 WeakPolarHBondContact O-CB 3.46Å; D290-C505 PolarHBondContact O-N 3.05Å; N294-C505 HydrophobicContact CB-CB 4.4Å; N294-C505 PolarHBondContact ND2-O 2.88Å; N294-C505 VanDerWaalsContact ND2-O 3.07Å; C505-Y513 HydrophobicContact CB-CD2 3.78Å; C505-Y513 HydrophobicContact CB-CE2 4.16Å; C505-Y513 HydrophobicContact CB-CG 4.36Å
506	G	81.9	Confident	89.2	Confident	56 Å²	56	38.5 Å²	38.5	58%	0.577	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.9	21.1	-177.9	0	0	0	0	0	114	R504	R504-G506 PolarHBondContact O-N 3.45Å
507	N	84.4	Confident	89.1	Confident	15 Å²	15	38 Å²	38	8%	0.08	21%	0.211	C	C	.	.			trans	-61.3	143.7	174.6	70.8	87.6	0	0	0	111.9	R504 S509 K510 L511	R504-N507 HydrophobicContact CG-CB 3.66Å; R504-N507 WeakPolarHBondContact O-CB 3.45Å; R504-N507 PolarHBondContact O-N 2.92Å; R504-N507 PolarHBondContact O-ND2 3.26Å; N507-S509 VanDerWaalsContact C-N 3.31Å; N507-S509 PolarHBondContact O-N 3.28Å; N507-K510 PolarHBondContact O-N 2.86Å; N507-K510 WeakPolarHBondContact OD1-CA 3.33Å; N507-K510 PolarHBondContact OD1-N 2.99Å; N507-L511 PolarHBondContact ND2-O 3.2Å; N507-L511 WeakPolarHBondContact OD1-CB 3.45Å; N507-L511 PolarHBondContact OD1-N 3.23Å
508	P	83	Confident	88.8	Confident	97 Å²	97	41.8 Å²	41.8	63%	0.63	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-33.6	-175.1	25.1	-34.1	0	0	0	112.9	K510	P508-K510 PolarHBondContact O-N 3.3Å
509	S	82.4	Confident	88.4	Confident	63 Å²	63	37.3 Å²	37.3	44%	0.441	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-1	-178.5	-53.7	0	0	0	0	113.8	N507 L511	N507-S509 VanDerWaalsContact C-N 3.31Å; N507-S509 PolarHBondContact O-N 3.28Å; S509-L511 PolarHBondContact O-N 3.33Å; S509-L511 VanDerWaalsContact O-N 3.16Å
510	K	85.4	Confident	87.9	Confident	93 Å²	93	41.1 Å²	41.1	40%	0.404	23%	0.234	S	C	.	.			trans	54.9	29.9	179.7	-61.5	142	170.2	-166	0	113.9	Y7 N507 P508	Y7-K510 VanDerWaalsContact CD1-NZ 3.28Å; Y7-K510 HydrophobicContact CD2-CD 4.26Å; Y7-K510 HydrophobicContact CE1-CD 3.75Å; Y7-K510 HydrophobicContact CE1-CG 4.03Å; Y7-K510 HydrophobicContact CE2-CD 3.44Å; Y7-K510 VanDerWaalsContact CE2-CD 3.44Å; Y7-K510 VanDerWaalsContact CE2-CE 3.42Å; Y7-K510 HydrophobicContact CE2-CG 4.34Å; Y7-K510 VanDerWaalsContact CZ-NZ 3.29Å; Y7-K510 WeakPolarHBondContact OH-CB 3.25Å; Y7-K510 WeakPolarHBondContact OH-CD 3.17Å; Y7-K510 WeakPolarHBondContact OH-CG 3.4Å; N507-K510 PolarHBondContact O-N 2.86Å; N507-K510 WeakPolarHBondContact OD1-CA 3.33Å; N507-K510 PolarHBondContact OD1-N 2.99Å; P508-K510 PolarHBondContact O-N 3.3Å
511	L	87.2	Confident	87.5	Confident	29 Å²	29	41.5 Å²	41.5	15%	0.152	24%	0.237	C	C	.	.			trans	-58.4	148.7	170.5	-60.2	178.8	0	0	0	110.3	D444 H477 N507 S509 Y513	D444-L511 HydrophobicContact CB-CD1 4.39Å; D444-L511 HydrophobicContact CB-CD2 3.85Å; H477-L511 HydrophobicContact CB-CB 4.05Å; N507-L511 PolarHBondContact ND2-O 3.2Å; N507-L511 WeakPolarHBondContact OD1-CB 3.45Å; N507-L511 PolarHBondContact OD1-N 3.23Å; S509-L511 PolarHBondContact O-N 3.33Å; S509-L511 VanDerWaalsContact O-N 3.16Å; L511-Y513 PolarHBondContact O-N 2.99Å
512	K	89.8	Confident	87	Confident	88 Å²	88	43.4 Å²	43.4	38%	0.383	25%	0.245	S	C	.	.			trans	-67.5	122	-179.8	-60	-179.7	-174.6	171.7	0	109.8	W16 S503	W16-K512 HydrophobicContact CZ3-CG 4.44Å; S503-K512 PolarHBondContact N-O 2.96Å; S503-K512 VanDerWaalsContact N-O 3.11Å
513	Y	90.1	Very high	86.3	Confident	25 Å²	25	50.7 Å²	50.7	10%	0.098	28%	0.276	C	S	.	.			trans	-116.4	-4.7	174.4	67.7	-81.4	0	0	0	111.8	C288 G289 R301 S503 C505 L511	C288-Y513 CarbonylContact C-O 3.43Å; C288-Y513 WeakPolarHBondContact CA-O 3.32Å; G289-Y513 PolarHBondContact N-O 3.14Å; R301-Y513 WeakPolarHBondContact CD-OH 3.39Å; R301-Y513 VanDerWaalsContact CZ-CZ 3.47Å; R301-Y513 PolarHBondContact NE-OH 2.9Å; R301-Y513 PolarHBondContact NH1-OH 3.08Å; S503-Y513 WeakPolarHBondContact O-CB 3.41Å; C505-Y513 HydrophobicContact CB-CD2 3.78Å; C505-Y513 HydrophobicContact CB-CE2 4.16Å; C505-Y513 HydrophobicContact CB-CG 4.36Å; L511-Y513 PolarHBondContact O-N 2.99Å
514	L	90.8	Very high	85.9	Confident	48 Å²	48	55.8 Å²	55.8	25%	0.251	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	138	174	-81.2	171.6	0	0	0	110.3	V287 C288 L298 R301 M315	V287-L514 CarbonylContact O-C 3.49Å; V287-L514 WeakPolarHBondContact O-CA 3.4Å; C288-L514 HydrophobicContact CB-CD2 3.74Å; L298-L514 HydrophobicContact CD1-CD1 4.41Å; L298-L514 HydrophobicContact CD1-CD2 3.87Å; R301-L514 HydrophobicContact CB-CD1 4.27Å; M315-L514 HydrophobicContact CE-CD2 4.17Å; M315-L514 HydrophobicContact SD-CD2 4.27Å
515	F	90.8	Very high	85.4	Confident	35 Å²	35	53.8 Å²	53.8	15%	0.154	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	126.8	174.4	-170.1	-97.8	0	0	0	109.8	G286 V287 Y468 F470 V500 L502 F517	G286-F515 CarbonylContact C-O 3.57Å; G286-F515 WeakPolarHBondContact CA-O 3.33Å; V287-F515 PolarHBondContact N-O 3.01Å; V287-F515 PolarHBondContact O-N 2.79Å; Y468-F515 HydrophobicContact CE1-CE1 4.16Å; F470-F515 HydrophobicContact CE1-CB 4.45Å; F470-F515 AromaticContact CE1-CD1 3.49Å; F470-F515 HydrophobicContact CE1-CD1 3.49Å; F470-F515 VanDerWaalsContact CE1-CD1 3.49Å; F470-F515 AromaticContact CE1-CE1 3.9Å; F470-F515 HydrophobicContact CE1-CE1 3.9Å; F470-F515 HydrophobicContact CE1-CG 4.12Å; F470-F515 AromaticContact CZ-CD1 3.84Å; F470-F515 HydrophobicContact CZ-CD1 3.84Å; F470-F515 HydrophobicContact CZ-CE1 4.02Å; V500-F515 HydrophobicContact CG1-CD2 4.01Å; V500-F515 HydrophobicContact CG1-CE2 4.38Å; V500-F515 HydrophobicContact CG1-CG 4.26Å; V500-F515 HydrophobicContact CG2-CE1 4.47Å; V500-F515 HydrophobicContact CG2-CE2 4.26Å; V500-F515 HydrophobicContact CG2-CZ 4.19Å; L502-F515 HydrophobicContact CD1-CB 4.34Å; L502-F515 HydrophobicContact CD2-CB 3.97Å; F515-F517 HydrophobicContact CD1-CB 4.07Å; F515-F517 AromaticContact CD1-CD1 3.88Å; F515-F517 HydrophobicContact CD1-CD1 3.88Å; F515-F517 HydrophobicContact CD1-CG 4.21Å; F515-F517 HydrophobicContact CE1-CB 3.62Å; F515-F517 HydrophobicContact CE1-CD1 4.16Å; F515-F517 HydrophobicContact CE1-CG 4.02Å
516	A	87.8	Confident	84.6	Confident	65 Å²	65	55.9 Å²	55.9	54%	0.537	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.1	177.3	0	0	0	0	0	109.3	R285	R285-A516 WeakPolarHBondContact O-CA 3.29Å
517	F	87.9	Confident	83.8	Confident	7 Å²	7	59.8 Å²	59.8	3%	0.031	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	160.1	-174.4	69	-67.7	0	0	0	112	R285 V287 I425 Y468 F470 F515 I519	R285-F517 HydrophobicContact CB-CD1 4.49Å; R285-F517 HydrophobicContact CB-CE1 3.89Å; R285-F517 HydrophobicContact CB-CZ 4.06Å; R285-F517 PolarHBondContact N-O 3.5Å; R285-F517 WeakPolarHBondContact O-CD1 3.47Å; R285-F517 PolarHBondContact O-N 3.42Å; V287-F517 HydrophobicContact CG2-CD1 4.16Å; V287-F517 HydrophobicContact CG2-CE1 3.44Å; V287-F517 VanDerWaalsContact CG2-CE1 3.44Å; V287-F517 HydrophobicContact CG2-CZ 4.22Å; I425-F517 HydrophobicContact CD1-CE2 3.84Å; I425-F517 HydrophobicContact CD1-CZ 3.53Å; Y468-F517 HydrophobicContact CE1-CD2 4.39Å; Y468-F517 HydrophobicContact CE2-CD2 4.39Å; F470-F517 HydrophobicContact CE2-CE1 4.2Å; F470-F517 HydrophobicContact CE2-CE2 4.43Å; F470-F517 HydrophobicContact CE2-CZ 4.01Å; F470-F517 HydrophobicContact CZ-CD1 4.15Å; F470-F517 HydrophobicContact CZ-CE1 4Å; F470-F517 HydrophobicContact CZ-CE2 4.46Å; F470-F517 HydrophobicContact CZ-CZ 4.16Å; F515-F517 HydrophobicContact CD1-CB 4.07Å; F515-F517 AromaticContact CD1-CD1 3.88Å; F515-F517 HydrophobicContact CD1-CD1 3.88Å; F515-F517 HydrophobicContact CD1-CG 4.21Å; F515-F517 HydrophobicContact CE1-CB 3.62Å; F515-F517 HydrophobicContact CE1-CD1 4.16Å; F515-F517 HydrophobicContact CE1-CG 4.02Å; F517-I519 HydrophobicContact CD2-CB 4.16Å; F517-I519 HydrophobicContact CD2-CG2 4Å; F517-I519 HydrophobicContact CE2-CB 4.2Å; F517-I519 HydrophobicContact CE2-CG2 3.58Å
518	N	85.8	Confident	83	Confident	79 Å²	79	61.4 Å²	61.4	42%	0.422	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	128	172.8	58.2	-37.2	0	0	0	108.2	L282	L282-N518 HydrophobicContact CB-CB 4.48Å; L282-N518 HydrophobicContact CD2-CB 4.09Å
519	I	85.1	Confident	82.4	Confident	8 Å²	8	60.7 Å²	60.7	4%	0.041	33%	0.332	C	S	.	.			trans	-139.1	131.2	177.7	-170.9	-175.7	0	0	0	109.2	R285 L384 D424 R467 Y468 F517 P521	R285-I519 PolarHBondContact NH1-O 3.29Å; R285-I519 VanDerWaalsContact NH1-O 3.09Å; L384-I519 HydrophobicContact CD1-CG2 3.64Å; D424-I519 HydrophobicContact CB-CD1 4.31Å; R467-I519 HydrophobicContact CB-CD1 4.18Å; R467-I519 VanDerWaalsContact NH1-CD1 3.34Å; Y468-I519 HydrophobicContact CD2-CD1 3.55Å; Y468-I519 HydrophobicContact CD2-CG1 4.5Å; Y468-I519 HydrophobicContact CE2-CB 4.36Å; Y468-I519 HydrophobicContact CE2-CD1 3.65Å; Y468-I519 HydrophobicContact CE2-CG1 4.14Å; F517-I519 HydrophobicContact CD2-CB 4.16Å; F517-I519 HydrophobicContact CD2-CG2 4Å; F517-I519 HydrophobicContact CE2-CB 4.2Å; F517-I519 HydrophobicContact CE2-CG2 3.58Å; I519-P521 WeakPolarHBondContact O-CD 3.33Å
520	I	85	Confident	81.6	Confident	79 Å²	79	58.5 Å²	58.5	41%	0.405	32%	0.318	S	S	.	.			trans	-74.9	120.4	169.1	-59.8	172.2	0	0	0	107.1	L282 R467 L525	L282-I520 HydrophobicContact CD2-CG1 4.29Å; R467-I520 PolarHBondContact NH1-O 3.49Å; I520-L525 HydrophobicContact CB-CD1 4.14Å; I520-L525 HydrophobicContact CG2-CD1 4.17Å
521	P	86.5	Confident	80.9	Confident	11 Å²	11	56.3 Å²	56.3	7%	0.071	31%	0.312	C	S	.	.			trans	-55.2	146.5	177.4	-26	33.8	0	0	0	112.9	S382 G383 L384 D424 I519 K523 Y524 L525	S382-P521 WeakPolarHBondContact O-CG 3.39Å; G383-P521 WeakPolarHBondContact O-CB 3.45Å; L384-P521 HydrophobicContact CB-CG 4.33Å; L384-P521 HydrophobicContact CD1-CB 4.41Å; L384-P521 HydrophobicContact CD1-CG 4.25Å; D424-P521 WeakPolarHBondContact OD1-CA 3.36Å; I519-P521 WeakPolarHBondContact O-CD 3.33Å; P521-K523 PolarHBondContact O-N 3.34Å; P521-K523 VanDerWaalsContact O-N 3.13Å; P521-Y524 HydrophobicContact CB-CD2 3.92Å; P521-Y524 HydrophobicContact CB-CE2 4.33Å; P521-Y524 HydrophobicContact CG-CD2 3.96Å; P521-Y524 HydrophobicContact CG-CE2 4.26Å; P521-Y524 PolarHBondContact O-N 3.13Å; P521-L525 PolarHBondContact O-N 3.16Å
522	F	82.5	Confident	79.9	Confident	39 Å²	39	61.4 Å²	61.4	17%	0.171	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-53.2	-39	-175.7	-145.2	-78.7	0	0	0	112.2	S421 D424 R467 Y524 L525 A530	S421-F522 WeakPolarHBondContact OG-CE1 3.49Å; D424-F522 WeakPolarHBondContact OD1-CB 3.23Å; D424-F522 PolarHBondContact OD1-N 2.94Å; D424-F522 PolarHBondContact OD2-N 3.32Å; R467-F522 HydrophobicContact CG-CD2 4.27Å; R467-F522 HydrophobicContact CG-CE2 4.23Å; F522-Y524 PolarHBondContact O-N 2.84Å; F522-Y524 VanDerWaalsContact O-N 3.14Å; F522-L525 WeakPolarHBondContact O-CB 3.22Å; F522-L525 PolarHBondContact O-N 3.36Å; F522-L525 VanDerWaalsContact O-N 3.13Å; F522-A530 HydrophobicContact CE2-CB 4.26Å; F522-A530 HydrophobicContact CZ-CB 3.98Å
523	K	78.1	Confident	79.1	Confident	153 Å²	153	61.5 Å²	61.5	67%	0.665	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-56.9	-27.1	177	-172.5	178.6	-178.5	179.7	0	113.9	P521	P521-K523 PolarHBondContact O-N 3.34Å; P521-K523 VanDerWaalsContact O-N 3.13Å
524	Y	81.8	Confident	78.3	Confident	108 Å²	108	63.1 Å²	63.1	42%	0.424	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-108.1	3.8	-177.5	-54.5	-55.6	0	0	0	113.4	S382 P521 F522	S382-Y524 WeakPolarHBondContact O-CE2 2.84Å; P521-Y524 HydrophobicContact CB-CD2 3.92Å; P521-Y524 HydrophobicContact CB-CE2 4.33Å; P521-Y524 HydrophobicContact CG-CD2 3.96Å; P521-Y524 HydrophobicContact CG-CE2 4.26Å; P521-Y524 PolarHBondContact O-N 3.13Å; F522-Y524 PolarHBondContact O-N 2.84Å; F522-Y524 VanDerWaalsContact O-N 3.14Å
525	L	78.5	Confident	77.4	Confident	28 Å²	28	66.1 Å²	66.1	15%	0.147	38%	0.384	C	S	.	.	S	Bend	trans	-77.5	136.8	179.7	-149.5	82.6	0	0	0	109.5	I520 P521 F522 Q529 A530	I520-L525 HydrophobicContact CB-CD1 4.14Å; I520-L525 HydrophobicContact CG2-CD1 4.17Å; P521-L525 PolarHBondContact O-N 3.16Å; F522-L525 WeakPolarHBondContact O-CB 3.22Å; F522-L525 PolarHBondContact O-N 3.36Å; F522-L525 VanDerWaalsContact O-N 3.13Å; L525-Q529 HydrophobicContact CD1-CB 4.42Å; L525-Q529 HydrophobicContact CD2-CB 3.9Å; L525-Q529 HydrophobicContact CG-CB 3.81Å; L525-A530 VanDerWaalsContact CD2-CA 3.41Å; L525-A530 HydrophobicContact CD2-CB 3.49Å; L525-A530 VanDerWaalsContact CD2-CB 3.49Å
526	A	71.5	Confident	77	Confident	47 Å²	47	68.6 Å²	68.6	39%	0.388	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-68.3	148.3	175.3	0	0	0	0	0	110.2	G528 Q529	A526-G528 PolarHBondContact O-N 3.47Å; A526-Q529 HydrophobicContact CB-CG 4.11Å; A526-Q529 PolarHBondContact O-N 3.36Å; A526-Q529 VanDerWaalsContact O-N 3.14Å
527	P	65.5	Low	76.8	Confident	139 Å²	139	66.5 Å²	66.5	90%	0.903	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	127.5	174.3	-24.3	33.4	0	0	0	111
528	G	67.1	Low	76.8	Confident	48 Å²	48	67 Å²	67	50%	0.495	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.9	-24.8	-179.8	0	0	0	0	0	115.9	A526 A530 T531 E532	A526-G528 PolarHBondContact O-N 3.47Å; G528-A530 PolarHBondContact O-N 3.49Å; G528-T531 WeakPolarHBondContact O-CB 3.04Å; G528-T531 PolarHBondContact O-N 3.36Å; G528-E532 PolarHBondContact O-N 2.98Å
529	Q	71.4	Confident	76.9	Confident	82 Å²	82	66.4 Å²	66.4	38%	0.383	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-65.2	-25.6	177.9	-78.2	-176.4	-18.2	0	0	113.1	L525 A526 T531 E532	L525-Q529 HydrophobicContact CD1-CB 4.42Å; L525-Q529 HydrophobicContact CD2-CB 3.9Å; L525-Q529 HydrophobicContact CG-CB 3.81Å; A526-Q529 HydrophobicContact CB-CG 4.11Å; A526-Q529 PolarHBondContact O-N 3.36Å; A526-Q529 VanDerWaalsContact O-N 3.14Å; Q529-T531 PolarHBondContact O-N 2.95Å; Q529-E532 PolarHBondContact O-N 3.03Å
530	A	65.7	Low	77.1	Confident	18 Å²	18	67.3 Å²	67.3	15%	0.149	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-67	-24.5	175.6	0	0	0	0	0	111.9	N495 F522 L525 G528	N495-A530 VanDerWaalsContact CA-O 3.27Å; N495-A530 WeakPolarHBondContact CA-O 2.96Å; N495-A530 HydrophobicContact CB-CB 4.27Å; F522-A530 HydrophobicContact CE2-CB 4.26Å; F522-A530 HydrophobicContact CZ-CB 3.98Å; L525-A530 VanDerWaalsContact CD2-CA 3.41Å; L525-A530 HydrophobicContact CD2-CB 3.49Å; L525-A530 VanDerWaalsContact CD2-CB 3.49Å; G528-A530 PolarHBondContact O-N 3.49Å
531	T	69.5	Low	77.4	Confident	46 Å²	46	63.7 Å²	63.7	28%	0.282	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-98.2	5.1	-176.5	-38.2	0	0	0	0	111.3	P493 G494 G528 Q529 E533	P493-T531 HydrophobicContact CB-CG2 3.68Å; G494-T531 WeakPolarHBondContact O-CG2 3.22Å; G528-T531 WeakPolarHBondContact O-CB 3.04Å; G528-T531 PolarHBondContact O-N 3.36Å; Q529-T531 PolarHBondContact O-N 2.95Å; T531-E533 PolarHBondContact O-N 3.46Å; T531-E533 VanDerWaalsContact O-N 3.16Å
532	E	67.1	Low	77.6	Confident	136 Å²	136	63.1 Å²	63.1	64%	0.636	36%	0.362	S	S	*	.			trans	-68.9	113.3	174	-78.3	179.2	-169.5	0	0	109.8	G528 Q529	G528-E532 PolarHBondContact O-N 2.98Å; Q529-E532 PolarHBondContact O-N 3.03Å
533	E	72.7	Confident	78	Confident	91 Å²	91	64.6 Å²	64.6	43%	0.425	37%	0.374	S	S	.	.			trans	-94.2	143.7	-179	-64.5	175.4	163.7	0	0	110.8	R484 T496 T531	R484-E533 IonicContact CZ-OE1 2.84Å; R484-E533 IonicContact CZ-OE2 2.86Å; R484-E533 IonicContact NE-OE1 3.07Å; R484-E533 PolarHBondContact NE-OE1 3.4Å; R484-E533 IonicContact NE-OE2 2.95Å; R484-E533 PolarHBondContact NE-OE2 3.03Å; R484-E533 IonicContact NH2-OE1 2.56Å; R484-E533 IonicContact NH2-OE2 3.97Å; R484-E533 PolarHBondContact NH2-OE2 3.06Å; T496-E533 HydrophobicContact CG2-CG 4.07Å; T531-E533 PolarHBondContact O-N 3.46Å; T531-E533 VanDerWaalsContact O-N 3.16Å
534	S	72.7	Confident	78.4	Confident	58 Å²	58	63.3 Å²	63.3	41%	0.406	37%	0.371	S	S	.	.			trans	-87.5	155.7	170.7	-177.1	0	0	0	0	109.4	V536 T537	S534-V536 PolarHBondContact O-N 2.75Å; S534-T537 PolarHBondContact N-OG1 3.36Å; S534-T537 VanDerWaalsContact N-OG1 3.14Å; S534-T537 VanDerWaalsContact O-CB 3.29Å; S534-T537 WeakPolarHBondContact O-CB 3.02Å; S534-T537 PolarHBondContact O-N 3.42Å; S534-T537 PolarHBondContact O-OG1 2.8Å; S534-T537 VanDerWaalsContact O-OG1 3.11Å
535	A	72	Confident	78.8	Confident	112 Å²	112	58.4 Å²	58.4	93%	0.926	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.8	175	0	0	0	0	0	113.6
536	V	82.6	Confident	79.4	Confident	87 Å²	87	59 Å²	59	53%	0.527	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	8.6	-179.1	-152.3	0	0	0	0	112.3	P481 S534 T538	P481-V536 HydrophobicContact CB-CG1 4.15Å; P481-V536 HydrophobicContact CG-CG1 4.43Å; S534-V536 PolarHBondContact O-N 2.75Å; V536-T538 PolarHBondContact O-N 2.75Å
537	T	84.4	Confident	80.3	Confident	20 Å²	20	61.8 Å²	61.8	12%	0.123	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-68.5	125.9	-178.3	-67.8	0	0	0	0	110.8	P482 R484 T496 S534	P482-T537 CarbonylContact O-C 3.59Å; P482-T537 VanDerWaalsContact O-CA 3.26Å; P482-T537 WeakPolarHBondContact O-CA 2.94Å; R484-T537 HydrophobicContact CG-CG2 3.66Å; T496-T537 HydrophobicContact CG2-CG2 4.01Å; S534-T537 PolarHBondContact N-OG1 3.36Å; S534-T537 VanDerWaalsContact N-OG1 3.14Å; S534-T537 VanDerWaalsContact O-CB 3.29Å; S534-T537 WeakPolarHBondContact O-CB 3.02Å; S534-T537 PolarHBondContact O-N 3.42Å; S534-T537 PolarHBondContact O-OG1 2.8Å; S534-T537 VanDerWaalsContact O-OG1 3.11Å
538	T	87.4	Confident	81.4	Confident	18 Å²	18	58.8 Å²	58.8	11%	0.11	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-91.8	163.9	179.6	58.9	0	0	0	0	112.1	L438 R480 P481 P482 Y483 R484 V536	L438-T538 WeakPolarHBondContact O-CG2 3.27Å; R480-T538 PolarHBondContact NH2-OG1 3.12Å; P481-T538 HydrophobicContact CB-CG2 4.3Å; P482-T538 PolarHBondContact O-N 3.11Å; P482-T538 PolarHBondContact O-OG1 3.48Å; Y483-T538 VanDerWaalsContact CA-O 3.29Å; Y483-T538 WeakPolarHBondContact CA-O 3.35Å; Y483-T538 WeakPolarHBondContact CB-OG1 3.37Å; R484-T538 PolarHBondContact N-O 3.14Å; V536-T538 PolarHBondContact O-N 2.75Å
539	E	87.7	Confident	82.4	Confident	66 Å²	66	57.3 Å²	57.3	31%	0.308	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-71.9	166.7	173.4	-71.8	-58.1	132.1	0	0	112.3	L438 R484 L488 P541	L438-E539 HydrophobicContact CD1-CB 3.91Å; R484-E539 IonicContact CZ-OE1 2.99Å; R484-E539 IonicContact NH1-OE1 3.47Å; R484-E539 PolarHBondContact NH1-OE1 3.25Å; L488-E539 WeakPolarHBondContact CD1-OE1 3.46Å; E539-P541 WeakPolarHBondContact O-CD 3.28Å
540	F	89.7	Confident	83.2	Confident	27 Å²	27	59.2 Å²	59.2	12%	0.118	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-62.4	119.2	-177.2	-176.4	-108.2	0	0	0	112	A462 Y483 R484 Y542 L546	A462-F540 HydrophobicContact CB-CE2 4.42Å; A462-F540 HydrophobicContact CB-CZ 3.78Å; Y483-F540 HydrophobicContact CD2-CD2 4.28Å; Y483-F540 HydrophobicContact CE2-CD2 4.33Å; R484-F540 WeakPolarHBondContact O-CB 3.35Å; R484-F540 WeakPolarHBondContact O-CD2 3.34Å; F540-Y542 HydrophobicContact CD2-CD2 4.44Å; F540-Y542 HydrophobicContact CE1-CD2 4.36Å; F540-Y542 HydrophobicContact CE1-CG 4.47Å; F540-Y542 AromaticContact CE2-CD2 3.66Å; F540-Y542 HydrophobicContact CE2-CD2 3.66Å; F540-Y542 HydrophobicContact CE2-CE2 4.44Å; F540-Y542 HydrophobicContact CE2-CG 4.49Å; F540-Y542 AromaticContact CZ-CD2 3.63Å; F540-Y542 HydrophobicContact CZ-CD2 3.63Å; F540-Y542 HydrophobicContact CZ-CG 4.15Å; F540-Y542 PolarHBondContact O-N 3.39Å; F540-L546 HydrophobicContact CE1-CD1 3.86Å; F540-L546 HydrophobicContact CZ-CD1 4.06Å
541	P	90.6	Very high	84.3	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.019	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-20.5	-169.4	27.3	-33.4	0	0	0	114.9	G434 H437 Y483 E539 T543	G434-P541 WeakPolarHBondContact O-CB 3.42Å; H437-P541 HydrophobicContact CB-CB 4.38Å; H437-P541 WeakPolarHBondContact O-CB 3.4Å; Y483-P541 HydrophobicContact CD1-CG 4.2Å; Y483-P541 HydrophobicContact CD2-CG 4.04Å; Y483-P541 HydrophobicContact CE1-CG 4.34Å; Y483-P541 HydrophobicContact CE2-CG 4.19Å; Y483-P541 HydrophobicContact CG-CG 4.04Å; E539-P541 WeakPolarHBondContact O-CD 3.28Å; P541-T543 PolarHBondContact O-N 3.43Å
542	Y	91.8	Very high	85.2	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	6.1	-163.4	-55.1	-47.8	0	0	0	115.2	P432 V435 T458 A461 Y483 F540 E544 T545 L546	P432-Y542 HydrophobicContact CB-CE1 3.83Å; P432-Y542 HydrophobicContact CG-CE1 4.27Å; P432-Y542 WeakPolarHBondContact CG-OH 3.36Å; V435-Y542 HydrophobicContact CB-CE1 4.14Å; V435-Y542 HydrophobicContact CG2-CE1 4.35Å; T458-Y542 HydrophobicContact CG2-CD1 3.46Å; T458-Y542 VanDerWaalsContact CG2-CD1 3.46Å; T458-Y542 HydrophobicContact CG2-CD2 4.16Å; T458-Y542 HydrophobicContact CG2-CE1 4.25Å; T458-Y542 HydrophobicContact CG2-CG 3.41Å; T458-Y542 VanDerWaalsContact CG2-CG 3.41Å; A461-Y542 HydrophobicContact CB-CE2 3.93Å; Y483-Y542 AromaticContact CE2-CE2 3.98Å; Y483-Y542 HydrophobicContact CE2-CE2 3.98Å; Y483-Y542 AromaticContact CZ-CE2 3.78Å; Y483-Y542 WeakPolarHBondContact OH-CE2 3.33Å; Y483-Y542 PolarHBondContact OH-OH 2.68Å; Y483-Y542 VanDerWaalsContact OH-OH 3.08Å; F540-Y542 HydrophobicContact CD2-CD2 4.44Å; F540-Y542 HydrophobicContact CE1-CD2 4.36Å; F540-Y542 HydrophobicContact CE1-CG 4.47Å; F540-Y542 AromaticContact CE2-CD2 3.66Å; F540-Y542 HydrophobicContact CE2-CD2 3.66Å; F540-Y542 HydrophobicContact CE2-CE2 4.44Å; F540-Y542 HydrophobicContact CE2-CG 4.49Å; F540-Y542 AromaticContact CZ-CD2 3.63Å; F540-Y542 HydrophobicContact CZ-CD2 3.63Å; F540-Y542 HydrophobicContact CZ-CG 4.15Å; F540-Y542 PolarHBondContact O-N 3.39Å; Y542-E544 PolarHBondContact O-N 2.88Å; Y542-T545 PolarHBondContact O-N 3.06Å; Y542-L546 WeakPolarHBondContact O-CB 3.39Å; Y542-L546 VanDerWaalsContact O-CG 3.3Å; Y542-L546 WeakPolarHBondContact O-CG 3.36Å; Y542-L546 PolarHBondContact O-N 3.28Å
543	T	89.4	Confident	86	Confident	69 Å²	69	62.7 Å²	62.7	42%	0.423	33%	0.329	S	S	.	.	H	α-helix	trans	-54.7	-49.9	-172.5	-53.7	0	0	0	0	112.5	P541 Q547	P541-T543 PolarHBondContact O-N 3.43Å; T543-Q547 WeakPolarHBondContact O-CG 3.49Å; T543-Q547 PolarHBondContact O-N 2.97Å; T543-Q547 VanDerWaalsContact O-N 3.13Å
544	E	88.4	Confident	86.4	Confident	127 Å²	127	63.7 Å²	63.7	59%	0.593	33%	0.334	S	S	*	.	H	α-helix	trans	-67.3	-46.1	-178.4	-64.5	172.9	177.1	0	0	111.6	H437 Y542 L546 Q547 E548	H437-E544 IonicContact CE1-OE2 3.14Å; H437-E544 PolarHBondContact CE1-OE2 2.72Å; H437-E544 IonicContact ND1-OE2 3.19Å; H437-E544 PolarHBondContact ND1-OE2 2.95Å; Y542-E544 PolarHBondContact O-N 2.88Å; E544-L546 VanDerWaalsContact C-N 3.3Å; E544-L546 PolarHBondContact O-N 3.45Å; E544-Q547 PolarHBondContact O-N 3.06Å; E544-E548 PolarHBondContact O-N 3.48Å
545	T	89.3	Confident	86.8	Confident	4 Å²	4	65.4 Å²	65.4	3%	0.025	34%	0.336	C	S	.	.	H	α-helix	trans	-60.5	-39.1	178.8	-46.9	0	0	0	0	112	Q433 M455 T458 Y542 E548 L549	Q433-T545 HydrophobicContact CB-CG2 4.05Å; Q433-T545 HydrophobicContact CG-CG2 4.14Å; Q433-T545 PolarHBondContact O-OG1 2.95Å; M455-T545 HydrophobicContact CB-CG2 4.23Å; M455-T545 HydrophobicContact CE-CG2 3.89Å; M455-T545 VanDerWaalsContact CE-O 3.31Å; M455-T545 WeakPolarHBondContact CE-O 3.44Å; M455-T545 HydrophobicContact CG-CG2 4.03Å; T458-T545 HydrophobicContact CG2-CG2 3.89Å; Y542-T545 PolarHBondContact O-N 3.06Å; T545-E548 PolarHBondContact O-N 2.91Å; T545-L549 PolarHBondContact O-N 2.84Å; T545-L549 VanDerWaalsContact O-N 3.08Å
546	L	90.3	Very high	87.1	Confident	41 Å²	41	66.8 Å²	66.8	22%	0.215	32%	0.321	C	S	.	.	H	α-helix	trans	-69.7	-40.3	177.3	-69.2	177.3	0	0	0	112.1	T458 K459 A462 F540 Y542 E544 E548 L549 E550	T458-L546 HydrophobicContact CG2-CD2 4.25Å; T458-L546 HydrophobicContact CG2-CG 4.42Å; K459-L546 HydrophobicContact CB-CD2 4.37Å; A462-L546 HydrophobicContact CB-CD1 3.92Å; A462-L546 HydrophobicContact CB-CD2 4.42Å; F540-L546 HydrophobicContact CE1-CD1 3.86Å; F540-L546 HydrophobicContact CZ-CD1 4.06Å; Y542-L546 WeakPolarHBondContact O-CB 3.39Å; Y542-L546 VanDerWaalsContact O-CG 3.3Å; Y542-L546 WeakPolarHBondContact O-CG 3.36Å; Y542-L546 PolarHBondContact O-N 3.28Å; E544-L546 VanDerWaalsContact C-N 3.3Å; E544-L546 PolarHBondContact O-N 3.45Å; L546-E548 VanDerWaalsContact C-N 3.31Å; L546-E548 PolarHBondContact O-N 3.08Å; L546-L549 HydrophobicContact CD2-CD1 4.29Å; L546-L549 WeakPolarHBondContact O-CB 3.33Å; L546-L549 PolarHBondContact O-N 2.93Å; L546-E550 WeakPolarHBondContact O-CG 3.46Å; L546-E550 PolarHBondContact O-N 2.89Å
547	Q	90.3	Very high	86.8	Confident	105 Å²	105	70.4 Å²	70.4	49%	0.491	33%	0.329	S	S	.	.	H	α-helix	trans	-61.1	-41.9	173.7	-73.1	172.8	1.2	0	0	111.2	T543 E544 L549 E550 I551	T543-Q547 WeakPolarHBondContact O-CG 3.49Å; T543-Q547 PolarHBondContact O-N 2.97Å; T543-Q547 VanDerWaalsContact O-N 3.13Å; E544-Q547 PolarHBondContact O-N 3.06Å; Q547-L549 VanDerWaalsContact C-N 3.33Å; Q547-L549 PolarHBondContact O-N 3.24Å; Q547-E550 WeakPolarHBondContact O-CB 3.29Å; Q547-E550 PolarHBondContact O-N 3.37Å; Q547-I551 VanDerWaalsContact O-CG1 3.31Å; Q547-I551 WeakPolarHBondContact O-CG1 3.29Å; Q547-I551 PolarHBondContact O-N 2.8Å
548	E	90.1	Very high	85.8	Confident	77 Å²	77	77 Å²	77	36%	0.36	36%	0.359	S	S	.	.	H	α-helix	trans	-62.8	-39.9	176.2	-170.7	-173.6	166	0	0	111.8	M455 E544 T545 L546 E550 I551 R552	M455-E548 HydrophobicContact CE-CB 3.63Å; M455-E548 HydrophobicContact CE-CG 3.72Å; E544-E548 PolarHBondContact O-N 3.48Å; T545-E548 PolarHBondContact O-N 2.91Å; L546-E548 VanDerWaalsContact C-N 3.31Å; L546-E548 PolarHBondContact O-N 3.08Å; E548-E550 VanDerWaalsContact C-N 3.33Å; E548-E550 PolarHBondContact O-N 2.93Å; E548-I551 PolarHBondContact O-N 2.87Å; E548-R552 WeakPolarHBondContact O-CG 3.42Å; E548-R552 PolarHBondContact O-N 2.78Å; E548-R552 IonicContact OE1-CZ 2.68Å; E548-R552 VanDerWaalsContact OE1-CZ 3.32Å; E548-R552 IonicContact OE1-NE 3.86Å; E548-R552 PolarHBondContact OE1-NE 2.83Å; E548-R552 IonicContact OE1-NH2 3.65Å; E548-R552 PolarHBondContact OE1-NH2 2.89Å
549	L	87.7	Confident	84.5	Confident	17 Å²	17	84.2 Å²	84.2	9%	0.089	39%	0.388	C	S	.	.	H	α-helix	trans	-60.8	-40.7	173.6	-82.3	176.6	0	0	0	112.6	M455 K459 T545 L546 Q547 R552 K553	M455-L549 HydrophobicContact CB-CD1 3.98Å; M455-L549 HydrophobicContact CB-CD2 3.63Å; M455-L549 HydrophobicContact CB-CG 3.87Å; M455-L549 HydrophobicContact CE-CD2 4Å; M455-L549 HydrophobicContact CE-CG 3.72Å; M455-L549 HydrophobicContact CG-CD2 4.34Å; M455-L549 WeakPolarHBondContact O-CD1 3.44Å; M455-L549 HydrophobicContact SD-CD2 3.79Å; M455-L549 HydrophobicContact SD-CG 4.17Å; K459-L549 HydrophobicContact CB-CD1 4Å; T545-L549 PolarHBondContact O-N 2.84Å; T545-L549 VanDerWaalsContact O-N 3.08Å; L546-L549 HydrophobicContact CD2-CD1 4.29Å; L546-L549 WeakPolarHBondContact O-CB 3.33Å; L546-L549 PolarHBondContact O-N 2.93Å; Q547-L549 VanDerWaalsContact C-N 3.33Å; Q547-L549 PolarHBondContact O-N 3.24Å; L549-R552 PolarHBondContact O-N 2.7Å; L549-K553 WeakPolarHBondContact O-CG 3.38Å; L549-K553 PolarHBondContact O-N 3.32Å
550	E	88.1	Confident	82.4	Confident	122 Å²	122	89.1 Å²	89.1	57%	0.57	41%	0.409	S	S	*	.	H	α-helix	trans	-64.2	-46.7	176.8	-71.4	174.5	173.7	0	0	111.1	L546 Q547 E548 R552 K553 E554	L546-E550 WeakPolarHBondContact O-CG 3.46Å; L546-E550 PolarHBondContact O-N 2.89Å; Q547-E550 WeakPolarHBondContact O-CB 3.29Å; Q547-E550 PolarHBondContact O-N 3.37Å; E548-E550 VanDerWaalsContact C-N 3.33Å; E548-E550 PolarHBondContact O-N 2.93Å; E550-R552 VanDerWaalsContact C-N 3.33Å; E550-R552 PolarHBondContact O-N 2.91Å; E550-K553 WeakPolarHBondContact O-CB 3.45Å; E550-K553 PolarHBondContact O-N 2.83Å; E550-K553 VanDerWaalsContact O-N 3.09Å; E550-E554 WeakPolarHBondContact O-CG 3.36Å; E550-E554 PolarHBondContact O-N 2.82Å
551	I	89.7	Confident	80	Confident	85 Å²	85	92.9 Å²	92.9	44%	0.436	44%	0.436	S	S	.	.	H	α-helix	trans	-59.2	-44.4	175.9	-66	165	0	0	0	110.6	Q547 E548 K553 E554 Q555	Q547-I551 VanDerWaalsContact O-CG1 3.31Å; Q547-I551 WeakPolarHBondContact O-CG1 3.29Å; Q547-I551 PolarHBondContact O-N 2.8Å; E548-I551 PolarHBondContact O-N 2.87Å; I551-K553 VanDerWaalsContact C-N 3.29Å; I551-K553 PolarHBondContact O-N 3.12Å; I551-E554 PolarHBondContact O-N 3.04Å; I551-Q555 HydrophobicContact CG2-CG 4.38Å; I551-Q555 WeakPolarHBondContact O-CG 3.29Å; I551-Q555 PolarHBondContact O-N 3.38Å
552	R	86.9	Confident	77.4	Confident	113 Å²	113	99.8 Å²	99.8	43%	0.426	47%	0.473	S	S	.	.	H	α-helix	trans	-60.5	-37.4	176.7	-75	179.4	-177.1	-161	2.9	112	M455 E548 L549 E550 K556	M455-R552 PolarHBondContact SD-NH1 2.93Å; E548-R552 WeakPolarHBondContact O-CG 3.42Å; E548-R552 PolarHBondContact O-N 2.78Å; E548-R552 IonicContact OE1-CZ 2.68Å; E548-R552 VanDerWaalsContact OE1-CZ 3.32Å; E548-R552 IonicContact OE1-NE 3.86Å; E548-R552 PolarHBondContact OE1-NE 2.83Å; E548-R552 IonicContact OE1-NH2 3.65Å; E548-R552 PolarHBondContact OE1-NH2 2.89Å; L549-R552 PolarHBondContact O-N 2.7Å; E550-R552 VanDerWaalsContact C-N 3.33Å; E550-R552 PolarHBondContact O-N 2.91Å; R552-K556 WeakPolarHBondContact O-CG 3.48Å; R552-K556 PolarHBondContact O-N 2.86Å
553	K	83.9	Confident	75	Confident	75 Å²	75	106.4 Å²	106.4	33%	0.326	51%	0.508	S	S	.	.	H	α-helix	trans	-66.6	-41.8	175.4	-75.2	176.1	177.1	-165.7	0	112.2	E404 L549 E550 I551 K556 K557	E404-K553 WeakPolarHBondContact OE1-CE 3.25Å; E404-K553 IonicContact OE1-NZ 2.85Å; E404-K553 PolarHBondContact OE1-NZ 2.83Å; L549-K553 WeakPolarHBondContact O-CG 3.38Å; L549-K553 PolarHBondContact O-N 3.32Å; E550-K553 WeakPolarHBondContact O-CB 3.45Å; E550-K553 PolarHBondContact O-N 2.83Å; E550-K553 VanDerWaalsContact O-N 3.09Å; I551-K553 VanDerWaalsContact C-N 3.29Å; I551-K553 PolarHBondContact O-N 3.12Å; K553-K556 PolarHBondContact O-N 2.98Å; K553-K557 WeakPolarHBondContact O-CG 3.36Å; K553-K557 PolarHBondContact O-N 3.48Å; K553-K557 VanDerWaalsContact O-N 3.08Å
554	E	82.2	Confident	72.4	Confident	112 Å²	112	109.5 Å²	109.5	52%	0.523	52%	0.522	S	S	.	.	H	α-helix	trans	-65.5	-43.7	177.2	-69.3	-178.1	167.4	0	0	111.7	E550 I551 K556 K557 Q558	E550-E554 WeakPolarHBondContact O-CG 3.36Å; E550-E554 PolarHBondContact O-N 2.82Å; I551-E554 PolarHBondContact O-N 3.04Å; E554-K556 VanDerWaalsContact C-N 3.33Å; E554-K556 PolarHBondContact O-N 3.36Å; E554-K557 WeakPolarHBondContact O-CB 3.4Å; E554-K557 PolarHBondContact O-N 3.35Å; E554-K557 VanDerWaalsContact O-N 3.08Å; E554-Q558 WeakPolarHBondContact O-CG 3.28Å; E554-Q558 PolarHBondContact O-N 3.21Å
555	Q	81.1	Confident	70.1	Confident	94 Å²	94	110.5 Å²	110.5	44%	0.439	53%	0.53	S	S	.	.	H	α-helix	trans	-61.6	-39.5	175.2	-69.7	179.3	10.4	0	0	112.3	I551 K557 Q558 K559	I551-Q555 HydrophobicContact CG2-CG 4.38Å; I551-Q555 WeakPolarHBondContact O-CG 3.29Å; I551-Q555 PolarHBondContact O-N 3.38Å; Q555-K557 VanDerWaalsContact C-N 3.3Å; Q555-K557 PolarHBondContact O-N 3.22Å; Q555-Q558 PolarHBondContact O-N 3.3Å; Q555-K559 WeakPolarHBondContact O-CB 3.35Å; Q555-K559 WeakPolarHBondContact O-CG 3.39Å; Q555-K559 PolarHBondContact O-N 3.47Å
556	K	78.8	Confident	67.8	Low	140 Å²	140	119.4 Å²	119.4	61%	0.609	57%	0.569	S	S	*	*	H	α-helix	trans	-64.9	-32.1	173.9	-77.4	179.7	178.7	-177.9	0	112.6	R552 K553 E554	R552-K556 WeakPolarHBondContact O-CG 3.48Å; R552-K556 PolarHBondContact O-N 2.86Å; K553-K556 PolarHBondContact O-N 2.98Å; E554-K556 VanDerWaalsContact C-N 3.33Å; E554-K556 PolarHBondContact O-N 3.36Å
557	K	75.1	Confident	65.3	Low	164 Å²	164	120.4 Å²	120.4	71%	0.713	59%	0.588	S	S	*	*	H	α-helix	trans	-70	-37.9	172.8	-72	175.7	-178.6	176.9	0	111.8	K553 E554 Q555	K553-K557 WeakPolarHBondContact O-CG 3.36Å; K553-K557 PolarHBondContact O-N 3.48Å; K553-K557 VanDerWaalsContact O-N 3.08Å; E554-K557 WeakPolarHBondContact O-CB 3.4Å; E554-K557 PolarHBondContact O-N 3.35Å; E554-K557 VanDerWaalsContact O-N 3.08Å; Q555-K557 VanDerWaalsContact C-N 3.3Å; Q555-K557 PolarHBondContact O-N 3.22Å
558	Q	64.3	Low	62.9	Low	158 Å²	158	120.8 Å²	120.8	74%	0.738	59%	0.588	S	S	*	*	H	α-helix	trans	-77.2	-30.7	-179.9	-67.5	179.6	20.1	0	0	113.9	E554 Q555 K560	E554-Q558 WeakPolarHBondContact O-CG 3.28Å; E554-Q558 PolarHBondContact O-N 3.21Å; Q555-Q558 PolarHBondContact O-N 3.3Å; Q558-K560 VanDerWaalsContact C-N 3.34Å; Q558-K560 PolarHBondContact O-N 3.47Å
559	K	59.7	Low	60.4	Low	169 Å²	169	126.3 Å²	126.3	74%	0.735	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-5	179.3	-75.7	-178	178.7	176.9	0	114.8	Q555 P561	Q555-K559 WeakPolarHBondContact O-CB 3.35Å; Q555-K559 WeakPolarHBondContact O-CG 3.39Å; Q555-K559 PolarHBondContact O-N 3.47Å; K559-P561 VanDerWaalsContact O-CD 3.28Å; K559-P561 WeakPolarHBondContact O-CD 3.17Å
560	K	42.9	Very low	58	Low	169 Å²	169	131.5 Å²	131.5	74%	0.735	64%	0.636	S	S	*	*	S	Bend	trans	-69.4	114.2	170.4	-84.2	-173.8	175.5	-178.3	0	108.2	Q558 N562	Q558-K560 VanDerWaalsContact C-N 3.34Å; Q558-K560 PolarHBondContact O-N 3.47Å; K560-N562 PolarHBondContact O-N 3.02Å
561	P	39.5	Very low	55.5	Low	106 Å²	106	133.3 Å²	133.3	69%	0.688	64%	0.642	S	S	*	*			trans	-61.7	136.9	-179.6	4.3	3.1	0	0	0	109.4	K559 D563	K559-P561 VanDerWaalsContact O-CD 3.28Å; K559-P561 WeakPolarHBondContact O-CD 3.17Å; P561-D563 PolarHBondContact O-N 3.44Å
562	N	36.9	Very low	52.8	Low	148 Å²	148	133.4 Å²	133.4	79%	0.791	64%	0.64	S	S	*	*			trans	-74.9	53.5	179.3	-152.5	10.4	0	0	0	110.5	K560	K560-N562 PolarHBondContact O-N 3.02Å
563	D	40.3	Very low	50.5	Low	139 Å²	139	133.1 Å²	133.1	74%	0.743	65%	0.647	S	S	*	*			trans	-94.9	113.5	176.6	-95.4	-28.7	0	0	0	110.7	P561	P561-D563 PolarHBondContact O-N 3.44Å
564	N	35.8	Very low	47.9	Very low	135 Å²	135	137.9 Å²	137.9	72%	0.722	67%	0.668	S	S	*	*			trans	76.4	71.4	169.7	-74.9	-46.6	0	0	0	118.6	K566	N564-K566 PolarHBondContact O-N 2.85Å
565	I	39.5	Very low	45.9	Very low	148 Å²	148	136.3 Å²	136.3	76%	0.759	67%	0.674	S	S	*	*				-46.2	87.6	124.6	-63.2	163.4	0	0	0	109.5
566	K	40.8	Very low	43.9	Very low	191 Å²	191	137.1 Å²	137.1	83%	0.83	69%	0.69	S	S	*	*			trans	-145	80.8	147.9	-86.9	-164.9	-179.5	176.4	0	109.1	N564	N564-K566 PolarHBondContact O-N 2.85Å
567	G	37.8	Very low	41.8	Very low	61 Å²	61	136.2 Å²	136.2	63%	0.629	70%	0.696	S	S	*	*			trans	68.8	106.4	138	0	0	0	0	0	118.3
568	K	39.4	Very low	40	Very low	114 Å²	114	137 Å²	137	50%	0.496	70%	0.702	S	S	.	*				-159.4	90.6	119.8	-106.8	153.7	-174.1	130	0	112.3	F570 R594	K568-F570 HydrophobicContact CB-CD2 4.07Å; K568-F570 HydrophobicContact CB-CE2 3.58Å; K568-F570 HydrophobicContact CB-CZ 4.29Å; K568-F570 HydrophobicContact CD-CE2 3.73Å; K568-F570 HydrophobicContact CD-CZ 3.78Å; K568-F570 HydrophobicContact CG-CD2 4.4Å; K568-F570 HydrophobicContact CG-CE2 3.56Å; K568-F570 HydrophobicContact CG-CZ 3.75Å; K568-F570 PolarHBondContact O-N 3.12Å; K568-R594 VanDerWaalsContact CD-NH1 3.31Å; K568-R594 VanDerWaalsContact CE-CZ 3.49Å; K568-R594 VanDerWaalsContact NZ-CZ 3.34Å
569	Q	38.3	Very low	38.7	Very low	193 Å²	193	133.8 Å²	133.8	90%	0.902	70%	0.702	S	S	*	*			trans	-59.7	125.4	150.7	-76.1	165.3	-41.6	0	0	107.8
570	F	36.6	Very low	37.4	Very low	125 Å²	125	130.6 Å²	130.6	55%	0.548	70%	0.702	S	S	.	*			trans	-116.3	89.4	161.7	-78.1	-74.6	0	0	0	107.4	K568 N595	K568-F570 HydrophobicContact CB-CD2 4.07Å; K568-F570 HydrophobicContact CB-CE2 3.58Å; K568-F570 HydrophobicContact CB-CZ 4.29Å; K568-F570 HydrophobicContact CD-CE2 3.73Å; K568-F570 HydrophobicContact CD-CZ 3.78Å; K568-F570 HydrophobicContact CG-CD2 4.4Å; K568-F570 HydrophobicContact CG-CE2 3.56Å; K568-F570 HydrophobicContact CG-CZ 3.75Å; K568-F570 PolarHBondContact O-N 3.12Å; F570-N595 WeakPolarHBondContact CE1-ND2 3.45Å; F570-N595 WeakPolarHBondContact CZ-ND2 3.24Å
571	F	36.1	Very low	37.2	Very low	160 Å²	160	128.3 Å²	128.3	70%	0.702	71%	0.707	S	S	*	*			trans	-86.5	114	161	-170.7	-111.3	0	0	0	105.8	D573	F571-D573 HydrophobicContact CD1-CB 3.63Å; F571-D573 HydrophobicContact CE1-CB 3.15Å; F571-D573 WeakPolarHBondContact CE1-OD2 3.42Å; F571-D573 HydrophobicContact CE2-CB 4.49Å; F571-D573 HydrophobicContact CG-CB 4.47Å; F571-D573 HydrophobicContact CZ-CB 3.64Å; F571-D573 VanDerWaalsContact CZ-OD2 3.23Å; F571-D573 WeakPolarHBondContact CZ-OD2 3.47Å
572	F	34	Very low	37.1	Very low	87 Å²	87	127 Å²	127	38%	0.382	71%	0.705	S	S	.	*			trans	-106.5	99.8	167.4	-151.6	-72.2	0	0	0	106	F574 R596 E598	F572-F574 AromaticContact CD1-CD2 3.99Å; F572-F574 HydrophobicContact CD1-CD2 3.99Å; F572-F574 HydrophobicContact CD1-CE2 4.28Å; F572-F574 AromaticContact CE1-CD2 3.57Å; F572-F574 HydrophobicContact CE1-CD2 3.57Å; F572-F574 AromaticContact CE1-CE2 3.51Å; F572-F574 HydrophobicContact CE1-CE2 3.51Å; F572-F574 HydrophobicContact CE1-CZ 4.41Å; F572-F574 HydrophobicContact CZ-CE2 4.4Å; F572-R596 HydrophobicContact CE2-CG 4.26Å; F572-E598 HydrophobicContact CD1-CG 4.35Å; F572-E598 WeakPolarHBondContact CD1-OE1 3.44Å; F572-E598 VanDerWaalsContact CD2-CD 3.49Å; F572-E598 HydrophobicContact CD2-CG 3.64Å; F572-E598 HydrophobicContact CE1-CG 4.35Å; F572-E598 VanDerWaalsContact CE1-OE1 3.22Å; F572-E598 WeakPolarHBondContact CE1-OE1 3.35Å; F572-E598 WeakPolarHBondContact CE1-OE2 3.28Å; F572-E598 VanDerWaalsContact CE2-CD 3.4Å; F572-E598 HydrophobicContact CE2-CG 3.64Å; F572-E598 VanDerWaalsContact CG-CD 3.44Å; F572-E598 HydrophobicContact CG-CG 4.01Å; F572-E598 WeakPolarHBondContact CG-OE1 3.45Å; F572-E598 HydrophobicContact CZ-CG 4Å; F572-E598 WeakPolarHBondContact CZ-OE2 3.49Å
573	D	36.6	Very low	37.3	Very low	108 Å²	108	125.4 Å²	125.4	58%	0.578	70%	0.701	S	S	*	*			trans	-119.7	125.5	176.1	-162.9	7.5	0	0	0	106.6	F571 A575	F571-D573 HydrophobicContact CD1-CB 3.63Å; F571-D573 HydrophobicContact CE1-CB 3.15Å; F571-D573 WeakPolarHBondContact CE1-OD2 3.42Å; F571-D573 HydrophobicContact CE2-CB 4.49Å; F571-D573 HydrophobicContact CG-CB 4.47Å; F571-D573 HydrophobicContact CZ-CB 3.64Å; F571-D573 VanDerWaalsContact CZ-OD2 3.23Å; F571-D573 WeakPolarHBondContact CZ-OD2 3.47Å; D573-A575 PolarHBondContact O-N 2.94Å
574	F	31	Very low	37.3	Very low	175 Å²	175	125.1 Å²	125.1	77%	0.768	70%	0.699	S	S	*	*			trans	-89.6	88.5	-175.9	-114.8	-84.9	0	0	0	107.7	F572	F572-F574 AromaticContact CD1-CD2 3.99Å; F572-F574 HydrophobicContact CD1-CD2 3.99Å; F572-F574 HydrophobicContact CD1-CE2 4.28Å; F572-F574 AromaticContact CE1-CD2 3.57Å; F572-F574 HydrophobicContact CE1-CD2 3.57Å; F572-F574 AromaticContact CE1-CE2 3.51Å; F572-F574 HydrophobicContact CE1-CE2 3.51Å; F572-F574 HydrophobicContact CE1-CZ 4.41Å; F572-F574 HydrophobicContact CZ-CE2 4.4Å
575	A	39.9	Very low	37.4	Very low	78 Å²	78	125.1 Å²	125.1	65%	0.645	70%	0.699	S	S	*	*			trans	-163.8	132.9	163	0	0	0	0	0	112.4	D573	D573-A575 PolarHBondContact O-N 2.94Å
576	S	38.4	Very low	37.3	Very low	111 Å²	111	125.3 Å²	125.3	78%	0.776	70%	0.697	S	S	*	*			trans	62.1	105.2	164.9	54.3	0	0	0	0	117.2
577	V	35.9	Very low	37.2	Very low	122 Å²	122	125 Å²	125	74%	0.739	70%	0.698	S	S	*	*				59	114.4	61.8	-170	0	0	0	0	112.9
578	E	36.9	Very low	37.1	Very low	181 Å²	181	125.4 Å²	125.4	85%	0.846	70%	0.702	S	S	*	*			trans	98.6	126.6	155.8	-77.2	161.6	-152.8	0	0	122.5
579	A	36.8	Very low	36.8	Very low	89 Å²	89	125.9 Å²	125.9	74%	0.736	72%	0.72	S	S	*	*			trans	71.7	103.1	150	0	0	0	0	0	118.7
580	S	32.8	Very low	36.7	Very low	103 Å²	103	122 Å²	122	72%	0.72	71%	0.714	S	S	*	*				97.4	130.8	56.3	63.6	0	0	0	0	114.3
581	S	37.3	Very low	36.5	Very low	120 Å²	120	124.9 Å²	124.9	84%	0.839	73%	0.727	S	S	*	*			trans	76.1	138.6	159.7	78.5	0	0	0	0	116.7
582	A	38.4	Very low	36.4	Very low	78 Å²	78	128.4 Å²	128.4	65%	0.645	74%	0.735	S	S	*	*			cis	-167.7	153.1	10.6	0	0	0	0	0	110.4
583	T	40.5	Very low	36.4	Very low	116 Å²	116	133 Å²	133	71%	0.712	76%	0.755	S	S	*	*			trans	54.6	138.8	133.9	56.2	0	0	0	0	120.3
584	D	39.9	Very low	36.3	Very low	133 Å²	133	134.5 Å²	134.5	71%	0.711	75%	0.753	S	S	*	*			cis	-172.2	162.5	17.1	-95	-22.9	0	0	0	110.8
585	N	38.8	Very low	36.5	Very low	135 Å²	135	130.8 Å²	130.8	72%	0.722	74%	0.741	S	S	*	*			trans	71.7	140.4	152.4	-71.6	-6.4	0	0	0	120.9
586	E	37.7	Very low	36.2	Very low	151 Å²	151	135.2 Å²	135.2	71%	0.706	74%	0.741	S	S	*	*			cis	-174	157.2	-15.7	-127.7	-173.9	172.9	0	0	107
587	Q	38.3	Very low	36.1	Very low	186 Å²	186	140.9 Å²	140.9	87%	0.869	75%	0.745	S	S	*	*			trans	79.9	119.3	164.3	-59.1	175	26.8	0	0	120.4
588	G	35	Very low	36	Very low	69 Å²	69	139.4 Å²	139.4	71%	0.711	73%	0.73	S	S	*	*			trans	130.6	76.9	148.3	0	0	0	0	0	118
589	S	34.3	Very low	35.9	Very low	123 Å²	123	139.5 Å²	139.5	86%	0.86	73%	0.73	S	S	*	*			trans	52.2	115.4	148.9	58.6	0	0	0	0	122.2
590	S	35.5	Very low	35.8	Very low	113 Å²	113	138.5 Å²	138.5	79%	0.79	73%	0.729	S	S	*	*			trans	75.2	98.8	138.7	-100.6	0	0	0	0	121
591	F	33.1	Very low	35.6	Very low	184 Å²	184	137.9 Å²	137.9	81%	0.807	74%	0.739	S	S	*	*			trans	65.6	75.5	130.7	-96.3	-96.7	0	0	0	118.8
592	R	32.8	Very low	35.6	Very low	234 Å²	234	140.7 Å²	140.7	88%	0.883	74%	0.739	S	S	*	*				48.5	88.5	116.8	-67.6	-175.7	177.1	175	0	116.7
593	K	33.7	Very low	35.5	Very low	184 Å²	184	145.7 Å²	145.7	80%	0.8	75%	0.749	S	S	*	*			trans	-108.9	132.4	149.8	-140.1	-179.1	-171.7	166.1	0	108.6
594	R	34.3	Very low	35.3	Very low	140 Å²	140	150.2 Å²	150.2	53%	0.528	76%	0.759	S	S	.	*			trans	125.1	118.7	133.7	-78.5	178.4	147.9	142.4	-17.6	119	K568	K568-R594 VanDerWaalsContact CD-NH1 3.31Å; K568-R594 VanDerWaalsContact CE-CZ 3.49Å; K568-R594 VanDerWaalsContact NZ-CZ 3.34Å
595	N	35.4	Very low	35.2	Very low	97 Å²	97	152.1 Å²	152.1	52%	0.519	76%	0.761	S	S	.	*				82.4	124.2	120.7	-68	7.1	0	0	0	119.7	F570	F570-N595 WeakPolarHBondContact CE1-ND2 3.45Å; F570-N595 WeakPolarHBondContact CZ-ND2 3.24Å
596	R	33.9	Very low	35.4	Very low	171 Å²	171	148.7 Å²	148.7	65%	0.645	75%	0.751	S	S	*	*				-178.5	159.7	101.3	-121.6	176.1	166.4	168.2	-5.5	112.3	F572	F572-R596 HydrophobicContact CE2-CG 4.26Å
597	R	36.7	Very low	35.5	Very low	229 Å²	229	149.6 Å²	149.6	86%	0.864	76%	0.761	S	S	*	*			trans	106.8	93.4	171.4	-62.1	175	-177.7	-164.9	0.4	111.8
598	E	33.4	Very low	36.2	Very low	91 Å²	91	147.5 Å²	147.5	43%	0.425	75%	0.746	S	S	.	*				69.6	136.5	78.9	-76.7	-161.7	126.4	0	0	114.5	F572	F572-E598 HydrophobicContact CD1-CG 4.35Å; F572-E598 WeakPolarHBondContact CD1-OE1 3.44Å; F572-E598 VanDerWaalsContact CD2-CD 3.49Å; F572-E598 HydrophobicContact CD2-CG 3.64Å; F572-E598 HydrophobicContact CE1-CG 4.35Å; F572-E598 VanDerWaalsContact CE1-OE1 3.22Å; F572-E598 WeakPolarHBondContact CE1-OE1 3.35Å; F572-E598 WeakPolarHBondContact CE1-OE2 3.28Å; F572-E598 VanDerWaalsContact CE2-CD 3.4Å; F572-E598 HydrophobicContact CE2-CG 3.64Å; F572-E598 VanDerWaalsContact CG-CD 3.44Å; F572-E598 HydrophobicContact CG-CG 4.01Å; F572-E598 WeakPolarHBondContact CG-OE1 3.45Å; F572-E598 HydrophobicContact CZ-CG 4Å; F572-E598 WeakPolarHBondContact CZ-OE2 3.49Å
599	H	35.6	Very low	37.6	Very low	183 Å²	183	146.5 Å²	146.5	85%	0.847	74%	0.735	S	S	*	*			trans	91.4	128.5	172.4	-66.6	9.6	0	0	0	118.4
600	G	33.7	Very low	39.5	Very low	69 Å²	69	144.3 Å²	144.3	71%	0.711	72%	0.718	S	S	*	*			trans	90.2	109.4	151.5	0	0	0	0	0	115.7	Q602	G600-Q602 PolarHBondContact O-N 3Å
601	G	29.7	Very low	41.7	Very low	89 Å²	89	139.7 Å²	139.7	92%	0.918	69%	0.685	S	S	*	*			trans	-59.1	107.9	167.2	0	0	0	0	0	110.4
602	Q	36.2	Very low	44.1	Very low	179 Å²	179	138.3 Å²	138.3	84%	0.836	68%	0.675	S	S	*	*			trans	-92.8	111.9	170.2	-80.9	-176.7	-18.4	0	0	109.4	G600	G600-Q602 PolarHBondContact O-N 3Å
603	E	37.8	Very low	46.8	Very low	184 Å²	184	129.5 Å²	129.5	86%	0.86	64%	0.643	S	S	*	*			trans	-52.6	136.9	163.6	-68.4	-178.3	146.3	0	0	110.5	K605	E603-K605 PolarHBondContact O-N 3.17Å
604	K	35.3	Very low	49.4	Very low	211 Å²	211	121.2 Å²	121.2	92%	0.917	61%	0.608	S	S	*	*			trans	-67	107.1	-178.6	-70.2	177.4	178.2	175.6	0	109.6	A606	K604-A606 PolarHBondContact O-N 2.86Å
605	K	38.4	Very low	51.9	Low	173 Å²	173	116.3 Å²	116.3	75%	0.752	59%	0.592	S	S	*	*			trans	-51.3	124.5	173.9	-65.8	-179.3	176.3	-176.6	0	111.1	E603 N607	E603-K605 PolarHBondContact O-N 3.17Å; K605-N607 PolarHBondContact O-N 3.22Å
606	A	43.5	Very low	54.2	Low	62 Å²	62	116.6 Å²	116.6	51%	0.512	60%	0.602	S	S	.	*			trans	-60.5	132.2	161.1	0	0	0	0	0	108.5	K604 Y608	K604-A606 PolarHBondContact O-N 2.86Å; A606-Y608 HydrophobicContact CB-CD2 4.04Å; A606-Y608 HydrophobicContact CB-CE2 3.52Å; A606-Y608 WeakPolarHBondContact O-CD2 3.45Å; A606-Y608 PolarHBondContact O-N 3.05Å
607	N	38.6	Very low	56.7	Low	171 Å²	171	109.1 Å²	109.1	91%	0.914	58%	0.576	S	S	*	*			trans	-67.9	79.2	-179.9	-81.6	-19.8	0	0	0	110.6	K605	K605-N607 PolarHBondContact O-N 3.22Å
608	Y	52.8	Low	58.9	Low	142 Å²	142	104 Å²	104	56%	0.557	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-82.4	144	157	-59.9	-76.6	0	0	0	107.5	A606 H653	A606-Y608 HydrophobicContact CB-CD2 4.04Å; A606-Y608 HydrophobicContact CB-CE2 3.52Å; A606-Y608 WeakPolarHBondContact O-CD2 3.45Å; A606-Y608 PolarHBondContact O-N 3.05Å; Y608-H653 AromaticContact CD2-NE2 3.9Å
609	G	64.5	Low	61.3	Low	47 Å²	47	103.8 Å²	103.8	49%	0.485	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-55.2	173.5	170.8	0	0	0	0	0	111.4	C611	G609-C611 PolarHBondContact O-N 3.44Å; G609-C611 VanDerWaalsContact O-N 3.11Å
610	P	75.7	Confident	63.7	Low	78 Å²	78	95.7 Å²	95.7	51%	0.506	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-55.1	125.1	178.4	26.9	-34.8	0	0	0	109.7	E619	P610-E619 HydrophobicContact CB-CG 4.09Å; P610-E619 VanDerWaalsContact CB-OE1 3.3Å; P610-E619 WeakPolarHBondContact CB-OE1 3.06Å; P610-E619 WeakPolarHBondContact CB-OE2 3.47Å; P610-E619 VanDerWaalsContact CG-CD 3.41Å; P610-E619 WeakPolarHBondContact CG-OE1 3.28Å; P610-E619 VanDerWaalsContact CG-OE2 3.28Å; P610-E619 WeakPolarHBondContact CG-OE2 3.43Å
611	C	81.4	Confident	66.3	Low	15 Å²	15	95.9 Å²	95.9	10%	0.101	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-89	127.7	-176.8	-177.6	0	0	0	0	109.4	G609 F613 C614 S617 H697	G609-C611 PolarHBondContact O-N 3.44Å; G609-C611 VanDerWaalsContact O-N 3.11Å; C611-F613 VanDerWaalsContact C-N 3.28Å; C611-F613 PolarHBondContact O-N 3.48Å; C611-C614 HydrophobicContact CB-CB 4.15Å; C611-S617 WeakPolarHBondContact O-CB 3.3Å; C611-S617 PolarHBondContact O-OG 3.14Å; C611-H697 PolarHBondContact SG-ND1 3.08Å; C611-H697 VanDerWaalsContact SG-ND1 3.36Å
612	W	83.6	Confident	69.2	Low	156 Å²	156	98.1 Å²	98.1	59%	0.591	50%	0.502	S	S	*	.	S	Bend	trans	-76.4	-11.3	-179	-61.5	-15.9	0	0	0	114.6	E619 V620	W612-E619 PolarHBondContact NE1-OE2 2.98Å; W612-V620 WeakPolarHBondContact O-CG2 3.47Å
613	F	89.6	Confident	71.8	Confident	49 Å²	49	91.4 Å²	91.4	22%	0.215	47%	0.47	C	S	.	.	S	Bend	trans	-111.3	-17.6	-175	-57.9	-79.1	0	0	0	113.5	C611 L615 Y633 L647 H697 Q699	C611-F613 VanDerWaalsContact C-N 3.28Å; C611-F613 PolarHBondContact O-N 3.48Å; F613-L615 PolarHBondContact O-N 3.28Å; F613-Y633 WeakPolarHBondContact O-CE1 3.37Å; F613-Y633 PolarHBondContact O-OH 3.35Å; F613-L647 HydrophobicContact CD1-CD2 3.83Å; F613-L647 HydrophobicContact CE1-CD2 3.52Å; F613-H697 HydrophobicContact CB-CB 3.95Å; F613-H697 VanDerWaalsContact CB-CD2 3.49Å; F613-H697 WeakPolarHBondContact CB-CD2 3.21Å; F613-H697 HydrophobicContact CD2-CB 3.89Å; F613-H697 HydrophobicContact CG-CB 4.25Å; F613-Q699 HydrophobicContact CD1-CG 4.25Å; F613-Q699 HydrophobicContact CD2-CG 4.49Å; F613-Q699 HydrophobicContact CE1-CG 4Å; F613-Q699 VanDerWaalsContact CE2-CD 3.5Å; F613-Q699 HydrophobicContact CE2-CG 4.27Å; F613-Q699 HydrophobicContact CG-CG 4.49Å; F613-Q699 HydrophobicContact CZ-CG 4.01Å
614	C	88.4	Confident	74.5	Confident	10 Å²	10	83.1 Å²	83.1	7%	0.068	43%	0.431	C	S	.	.			trans	-68.8	122.4	174	-70.1	0	0	0	0	109.6	C611 S616 S617 H653 H697	C611-C614 HydrophobicContact CB-CB 4.15Å; C614-S616 PolarHBondContact O-N 3.01Å; C614-S616 VanDerWaalsContact O-N 3.09Å; C614-S617 WeakPolarHBondContact O-CB 3.08Å; C614-S617 PolarHBondContact O-N 3.41Å; C614-H653 VanDerWaalsContact SG-CB 3.59Å; C614-H697 PolarHBondContact SG-CE1 2.61Å; C614-H697 PolarHBondContact SG-ND1 2.85Å
615	L	86.6	Confident	77.2	Confident	36 Å²	36	73.5 Å²	73.5	19%	0.188	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-22.5	178.1	-65.8	-171.9	0	0	0	113	F613 S617 V620 I625 I628 Y633 I651	F613-L615 PolarHBondContact O-N 3.28Å; L615-S617 VanDerWaalsContact C-N 3.28Å; L615-V620 HydrophobicContact CD2-CG2 4.19Å; L615-I625 HydrophobicContact CD2-CD1 3.49Å; L615-I625 VanDerWaalsContact CD2-CD1 3.49Å; L615-I628 HydrophobicContact CD1-CD1 4.3Å; L615-I628 HydrophobicContact CD1-CG2 4.3Å; L615-Y633 HydrophobicContact CD1-CD1 3.89Å; L615-Y633 HydrophobicContact CD1-CE1 4.48Å; L615-Y633 HydrophobicContact CD1-CG 4.19Å; L615-Y633 HydrophobicContact CD2-CD1 3.9Å; L615-Y633 HydrophobicContact CD2-CD2 4.3Å; L615-Y633 HydrophobicContact CD2-CE1 3.79Å; L615-Y633 HydrophobicContact CD2-CE2 4.21Å; L615-Y633 HydrophobicContact CD2-CG 4.16Å; L615-Y633 HydrophobicContact CG-CD1 3.78Å; L615-Y633 HydrophobicContact CG-CE1 3.86Å; L615-Y633 HydrophobicContact CG-CG 4.37Å; L615-I651 HydrophobicContact CB-CG2 4.21Å; L615-I651 HydrophobicContact CD1-CB 4.3Å; L615-I651 HydrophobicContact CD1-CD1 4.22Å; L615-I651 HydrophobicContact CD1-CG1 3.75Å; L615-I651 HydrophobicContact CD1-CG2 4.03Å; L615-I651 HydrophobicContact CG-CG1 4.44Å; L615-I651 HydrophobicContact CG-CG2 4.31Å; L615-I651 PolarHBondContact N-O 2.71Å
616	S	83.3	Confident	79.7	Confident	104 Å²	104	65.8 Å²	65.8	73%	0.727	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-13.1	173.9	65.7	0	0	0	0	114.2	C614	C614-S616 PolarHBondContact O-N 3.01Å; C614-S616 VanDerWaalsContact O-N 3.09Å
617	S	85.8	Confident	82	Confident	13 Å²	13	63 Å²	63	9%	0.091	33%	0.334	C	S	.	.	S	Bend	trans	-79.8	141.2	-178.8	-173.5	0	0	0	0	110.7	C611 C614 L615 E619 V620	C611-S617 WeakPolarHBondContact O-CB 3.3Å; C611-S617 PolarHBondContact O-OG 3.14Å; C614-S617 WeakPolarHBondContact O-CB 3.08Å; C614-S617 PolarHBondContact O-N 3.41Å; L615-S617 VanDerWaalsContact C-N 3.28Å; S617-E619 PolarHBondContact O-N 3Å; S617-E619 PolarHBondContact OG-N 3.39Å; S617-V620 WeakPolarHBondContact O-CG1 3.3Å
618	P	83.7	Confident	84.6	Confident	123 Å²	123	57.5 Å²	57.5	80%	0.799	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-17.7	173.5	29.3	-34.8	0	0	0	113.2	V620	P618-V620 VanDerWaalsContact C-N 3.34Å
619	E	83.3	Confident	86.3	Confident	86 Å²	86	51.3 Å²	51.3	40%	0.402	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	2.1	-177.4	-61.8	-170.6	-178.6	0	0	113.8	P610 W612 S617	P610-E619 HydrophobicContact CB-CG 4.09Å; P610-E619 VanDerWaalsContact CB-OE1 3.3Å; P610-E619 WeakPolarHBondContact CB-OE1 3.06Å; P610-E619 WeakPolarHBondContact CB-OE2 3.47Å; P610-E619 VanDerWaalsContact CG-CD 3.41Å; P610-E619 WeakPolarHBondContact CG-OE1 3.28Å; P610-E619 VanDerWaalsContact CG-OE2 3.28Å; P610-E619 WeakPolarHBondContact CG-OE2 3.43Å; W612-E619 PolarHBondContact NE1-OE2 2.98Å; S617-E619 PolarHBondContact O-N 3Å; S617-E619 PolarHBondContact OG-N 3.39Å
620	V	85.9	Confident	87.5	Confident	13 Å²	13	55.8 Å²	55.8	8%	0.079	29%	0.294	C	S	.	.	S	Bend	trans	-74.9	131.3	178.8	71.3	0	0	0	0	111.1	W612 L615 S617 P618 K622	W612-V620 WeakPolarHBondContact O-CG2 3.47Å; L615-V620 HydrophobicContact CD2-CG2 4.19Å; S617-V620 WeakPolarHBondContact O-CG1 3.3Å; P618-V620 VanDerWaalsContact C-N 3.34Å; V620-K622 VanDerWaalsContact C-N 3.33Å; V620-K622 HydrophobicContact CG1-CD 4.46Å; V620-K622 HydrophobicContact CG1-CG 3.74Å; V620-K622 PolarHBondContact O-N 3.41Å
621	E	89.4	Confident	88.2	Confident	72 Å²	72	54.4 Å²	54.4	34%	0.336	28%	0.283	S	S	.	.			trans	-78	78.9	179.4	-61.7	-76.1	-155.9	0	0	110.3	H623 L624 K638	E621-H623 PolarHBondContact O-N 2.86Å; E621-H623 IonicContact OE2-CE1 3.31Å; E621-H623 PolarHBondContact OE2-CE1 2.95Å; E621-H623 VanDerWaalsContact OE2-CE1 3.24Å; E621-H623 IonicContact OE2-ND1 2.68Å; E621-L624 HydrophobicContact CB-CD1 3.85Å; E621-L624 HydrophobicContact CB-CG 4.3Å; E621-L624 PolarHBondContact O-N 2.56Å; E621-L624 VanDerWaalsContact O-N 3.16Å; E621-K638 IonicContact OE1-NZ 3.68Å; E621-K638 PolarHBondContact OE1-NZ 3.5Å
622	K	90.2	Very high	88.8	Confident	137 Å²	137	53.7 Å²	53.7	60%	0.596	28%	0.278	S	S	*	.	G	3₁₀ helix	trans	-60.9	-26.5	-171.5	-64.3	-178.7	-177.8	-179.5	0	114.3	V620 L624 I625	V620-K622 VanDerWaalsContact C-N 3.33Å; V620-K622 HydrophobicContact CG1-CD 4.46Å; V620-K622 HydrophobicContact CG1-CG 3.74Å; V620-K622 PolarHBondContact O-N 3.41Å; K622-L624 PolarHBondContact O-N 3.47Å; K622-I625 HydrophobicContact CB-CD1 4.42Å; K622-I625 PolarHBondContact O-N 2.9Å
623	H	90.9	Very high	89.3	Confident	38 Å²	38	46.4 Å²	46.4	18%	0.176	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-68.6	-19.9	179.9	63.5	-73.9	0	0	0	113.1	E621 E799 A803	E621-H623 PolarHBondContact O-N 2.86Å; E621-H623 IonicContact OE2-CE1 3.31Å; E621-H623 PolarHBondContact OE2-CE1 2.95Å; E621-H623 VanDerWaalsContact OE2-CE1 3.24Å; E621-H623 IonicContact OE2-ND1 2.68Å; H623-E799 IonicContact CD2-OE2 2.7Å; H623-E799 IonicContact CE1-OE2 2.68Å; H623-E799 IonicContact NE2-OE2 3.42Å; H623-E799 PolarHBondContact NE2-OE2 3.47Å; H623-A803 WeakPolarHBondContact O-CB 3.29Å
624	L	92.8	Very high	89.5	Confident	9 Å²	9	44.1 Å²	44.1	5%	0.047	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-81.6	-13.2	177.2	-66.7	174.5	0	0	0	113.6	E621 K622 S635 L636 K638 E799	E621-L624 HydrophobicContact CB-CD1 3.85Å; E621-L624 HydrophobicContact CB-CG 4.3Å; E621-L624 PolarHBondContact O-N 2.56Å; E621-L624 VanDerWaalsContact O-N 3.16Å; K622-L624 PolarHBondContact O-N 3.47Å; L624-S635 CarbonylContact O-C 3.56Å; L624-S635 VanDerWaalsContact O-CA 3.24Å; L624-S635 WeakPolarHBondContact O-CA 3.39Å; L624-S635 WeakPolarHBondContact O-CB 3.48Å; L624-L636 HydrophobicContact CB-CB 4.38Å; L624-L636 HydrophobicContact CD2-CB 3.93Å; L624-L636 PolarHBondContact O-N 3.44Å; L624-K638 HydrophobicContact CD1-CB 4.13Å; L624-E799 HydrophobicContact CD2-CB 3.74Å; L624-E799 HydrophobicContact CD2-CG 4.01Å
625	I	92.7	Very high	89.8	Confident	10 Å²	10	44.1 Å²	44.1	5%	0.051	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	133.5	-175.4	-59.6	170.9	0	0	0	109.7	L615 K622 I628 Y633 R807	L615-I625 HydrophobicContact CD2-CD1 3.49Å; L615-I625 VanDerWaalsContact CD2-CD1 3.49Å; K622-I625 HydrophobicContact CB-CD1 4.42Å; K622-I625 PolarHBondContact O-N 2.9Å; I625-I628 HydrophobicContact CG2-CD1 3.88Å; I625-I628 HydrophobicContact CG2-CG1 3.51Å; I625-Y633 HydrophobicContact CG1-CD2 4.25Å; I625-Y633 HydrophobicContact CG1-CE2 4.37Å; I625-Y633 HydrophobicContact CG2-CD2 4.38Å; I625-R807 VanDerWaalsContact O-CZ 3.25Å; I625-R807 PolarHBondContact O-NE 2.92Å; I625-R807 PolarHBondContact O-NH2 2.85Å
626	V	92.1	Very high	90.1	Very high	10 Å²	10	42.8 Å²	42.8	6%	0.061	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	-45.2	-179.3	178.2	0	0	0	0	111.2	L634 L636 F646 R807 F810	V626-L634 HydrophobicContact CB-CD2 4.5Å; V626-L634 HydrophobicContact CG1-CD2 4.46Å; V626-L634 PolarHBondContact N-O 3.41Å; V626-L636 HydrophobicContact CG2-CG 4.26Å; V626-F646 HydrophobicContact CG2-CE1 4.14Å; V626-R807 HydrophobicContact CB-CG 4.41Å; V626-R807 HydrophobicContact CG1-CG 3.94Å; V626-F810 HydrophobicContact CG1-CD1 4.4Å
627	S	91.5	Very high	90.6	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	146.6	179	177.5	0	0	0	0	109.8	Y633 L634 Y671 D814	S627-Y633 CarbonylContact O-C 3.28Å; S627-Y633 WeakPolarHBondContact O-CA 3.37Å; S627-Y633 WeakPolarHBondContact O-CB 3.49Å; S627-L634 PolarHBondContact N-O 2.84Å; S627-L634 PolarHBondContact O-N 3.07Å; S627-Y671 PolarHBondContact OG-OH 3.17Å; S627-D814 WeakPolarHBondContact CB-OD2 3.24Å; S627-D814 PolarHBondContact OG-OD1 2.81Å; S627-D814 PolarHBondContact OG-OD2 3.29Å
628	I	92.1	Very high	90.8	Very high	56 Å²	56	41.9 Å²	41.9	29%	0.287	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	128.8	177	-60.7	173.6	0	0	0	107.3	L615 I625 I651 L820	L615-I628 HydrophobicContact CD1-CD1 4.3Å; L615-I628 HydrophobicContact CD1-CG2 4.3Å; I625-I628 HydrophobicContact CG2-CD1 3.88Å; I625-I628 HydrophobicContact CG2-CG1 3.51Å; I628-I651 HydrophobicContact CG2-CD1 3.93Å; I628-L820 HydrophobicContact CB-CD1 4.29Å; I628-L820 HydrophobicContact CD1-CD1 3.6Å; I628-L820 HydrophobicContact CD1-CD2 4.03Å; I628-L820 HydrophobicContact CD1-CG 4.47Å; I628-L820 HydrophobicContact CG1-CD1 3.76Å
629	S	89.4	Confident	91.1	Very high	13 Å²	13	36.2 Å²	36.2	9%	0.091	18%	0.18	C	C	.	.			trans	-104.9	-163.9	171.2	-160.1	0	0	0	0	110.2	A632 I651 E667 Y671 F815 N816	S629-A632 WeakPolarHBondContact CA-O 3.47Å; S629-A632 WeakPolarHBondContact CB-O 3.47Å; S629-A632 PolarHBondContact N-O 3.49Å; S629-I651 WeakPolarHBondContact O-CD1 3.34Å; S629-E667 WeakPolarHBondContact CB-OE2 2.84Å; S629-E667 PolarHBondContact OG-OE2 3.41Å; S629-Y671 PolarHBondContact N-OH 3.37Å; S629-F815 WeakPolarHBondContact OG-CE2 3.48Å; S629-N816 WeakPolarHBondContact CB-ND2 3.44Å; S629-N816 WeakPolarHBondContact CB-OD1 3.43Å; S629-N816 PolarHBondContact OG-OD1 3.48Å
630	D	88.6	Confident	91.4	Very high	140 Å²	140	32.7 Å²	32.7	75%	0.749	17%	0.167	S	C	*	.	S	Bend	trans	-75.9	-35.4	-176.8	-71	-28.2	0	0	0	112.4	I651	D630-I651 WeakPolarHBondContact O-CD1 3.46Å
631	N	91.5	Very high	91.7	Very high	49 Å²	49	32.3 Å²	32.3	26%	0.262	17%	0.165	S	C	.	.	S	Bend	trans	-125	-17.4	-176.1	-61.3	-69.7	0	0	0	114.9	S650 I651 E663 I664 E667	N631-S650 WeakPolarHBondContact O-CA 3.45Å; N631-I651 PolarHBondContact O-N 3.46Å; N631-E663 PolarHBondContact ND2-OE2 3.33Å; N631-I664 HydrophobicContact CB-CG1 3.71Å; N631-E667 WeakPolarHBondContact CA-OE2 3.46Å; N631-E667 WeakPolarHBondContact CB-OE1 3.38Å; N631-E667 PolarHBondContact N-OE1 3.46Å; N631-E667 PolarHBondContact N-OE2 3.24Å; N631-E667 PolarHBondContact ND2-OE1 2.95Å
632	A	93.2	Very high	91.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	161	179.5	0	0	0	0	0	112	S629 S649 E667 Y671	S629-A632 WeakPolarHBondContact CA-O 3.47Å; S629-A632 WeakPolarHBondContact CB-O 3.47Å; S629-A632 PolarHBondContact N-O 3.49Å; A632-S649 CarbonylContact C-O 3.58Å; A632-S649 VanDerWaalsContact CA-O 3.3Å; A632-S649 WeakPolarHBondContact CA-O 3.36Å; A632-E667 HydrophobicContact CB-CB 4.14Å; A632-E667 WeakPolarHBondContact CB-OE2 3.46Å; A632-E667 PolarHBondContact N-OE2 3.34Å; A632-Y671 HydrophobicContact CB-CE2 4.2Å
633	Y	93.6	Very high	91.8	Very high	4 Å²	4	28.2 Å²	28.2	2%	0.016	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	154.3	175.6	72.3	-87.7	0	0	0	110.8	F613 L615 I625 S627 S649 S650 I651	F613-Y633 WeakPolarHBondContact O-CE1 3.37Å; F613-Y633 PolarHBondContact O-OH 3.35Å; L615-Y633 HydrophobicContact CD1-CD1 3.89Å; L615-Y633 HydrophobicContact CD1-CE1 4.48Å; L615-Y633 HydrophobicContact CD1-CG 4.19Å; L615-Y633 HydrophobicContact CD2-CD1 3.9Å; L615-Y633 HydrophobicContact CD2-CD2 4.3Å; L615-Y633 HydrophobicContact CD2-CE1 3.79Å; L615-Y633 HydrophobicContact CD2-CE2 4.21Å; L615-Y633 HydrophobicContact CD2-CG 4.16Å; L615-Y633 HydrophobicContact CG-CD1 3.78Å; L615-Y633 HydrophobicContact CG-CE1 3.86Å; L615-Y633 HydrophobicContact CG-CG 4.37Å; I625-Y633 HydrophobicContact CG1-CD2 4.25Å; I625-Y633 HydrophobicContact CG1-CE2 4.37Å; I625-Y633 HydrophobicContact CG2-CD2 4.38Å; S627-Y633 CarbonylContact O-C 3.28Å; S627-Y633 WeakPolarHBondContact O-CA 3.37Å; S627-Y633 WeakPolarHBondContact O-CB 3.49Å; Y633-S649 WeakPolarHBondContact CD1-O 3.48Å; Y633-S649 PolarHBondContact N-O 3.33Å; Y633-S649 PolarHBondContact O-N 2.85Å; Y633-S650 WeakPolarHBondContact CE1-O 3.26Å; Y633-I651 HydrophobicContact CD1-CG1 4.09Å
634	L	94.5	Very high	91.9	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	127.6	175.6	-177	70.7	0	0	0	109.2	V626 S627 F646 I648 Y671 L675 F810	V626-L634 HydrophobicContact CB-CD2 4.5Å; V626-L634 HydrophobicContact CG1-CD2 4.46Å; V626-L634 PolarHBondContact N-O 3.41Å; S627-L634 PolarHBondContact N-O 2.84Å; S627-L634 PolarHBondContact O-N 3.07Å; L634-F646 HydrophobicContact CD1-CB 3.83Å; L634-F646 HydrophobicContact CD1-CD1 4.31Å; L634-F646 HydrophobicContact CD1-CG 4.28Å; L634-F646 HydrophobicContact CD2-CD1 4.4Å; L634-F646 HydrophobicContact CG-CD1 4.24Å; L634-I648 HydrophobicContact CD1-CG1 3.78Å; L634-Y671 HydrophobicContact CB-CD1 4.07Å; L634-Y671 HydrophobicContact CB-CE1 3.84Å; L634-Y671 HydrophobicContact CD2-CD1 4.35Å; L634-L675 HydrophobicContact CD1-CD1 4Å; L634-L675 HydrophobicContact CD2-CD2 4.35Å; L634-F810 HydrophobicContact CD2-CD1 4.23Å; L634-F810 HydrophobicContact CD2-CE1 3.74Å; L634-F810 HydrophobicContact CD2-CZ 3.96Å
635	S	94.2	Very high	92	Very high	10 Å²	10	27.2 Å²	27.2	7%	0.07	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	162.8	173.9	68.9	0	0	0	0	112	L624 F646 L647	L624-S635 CarbonylContact O-C 3.56Å; L624-S635 VanDerWaalsContact O-CA 3.24Å; L624-S635 WeakPolarHBondContact O-CA 3.39Å; L624-S635 WeakPolarHBondContact O-CB 3.48Å; S635-F646 CarbonylContact O-C 3.52Å; S635-F646 WeakPolarHBondContact O-CA 3.49Å; S635-L647 PolarHBondContact N-O 3.46Å; S635-L647 PolarHBondContact O-N 2.9Å
636	L	94.1	Very high	92.1	Very high	9 Å²	9	26.7 Å²	26.7	5%	0.047	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	150.5	163.7	-71.7	175.2	0	0	0	110.7	L624 V626 F646 L802 A803 F806	L624-L636 HydrophobicContact CB-CB 4.38Å; L624-L636 HydrophobicContact CD2-CB 3.93Å; L624-L636 PolarHBondContact O-N 3.44Å; V626-L636 HydrophobicContact CG2-CG 4.26Å; L636-F646 HydrophobicContact CD2-CD1 3.75Å; L636-F646 HydrophobicContact CD2-CE1 3.48Å; L636-F646 VanDerWaalsContact CD2-CE1 3.48Å; L636-F646 HydrophobicContact CD2-CZ 4.12Å; L636-F646 HydrophobicContact CG-CD1 4.49Å; L636-F646 HydrophobicContact CG-CE1 4.29Å; L636-L802 HydrophobicContact CD1-CB 3.99Å; L636-A803 HydrophobicContact CD1-CB 3.93Å; L636-F806 HydrophobicContact CD1-CD2 3.95Å; L636-F806 HydrophobicContact CD1-CE2 4.32Å; L636-F806 HydrophobicContact CD2-CD2 3.77Å; L636-F806 HydrophobicContact CD2-CE2 3.98Å; L636-F806 HydrophobicContact CG-CD2 4.34Å
637	T	92.6	Very high	92.2	Very high	19 Å²	19	26.6 Å²	26.6	12%	0.117	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-86.8	123.2	176.6	-59.3	0	0	0	0	110.4	G639 G640 H645	T637-G639 PolarHBondContact O-N 3.02Å; T637-G640 PolarHBondContact O-N 3.08Å; T637-G640 VanDerWaalsContact O-N 3.11Å; T637-H645 WeakPolarHBondContact CB-O 3.08Å; T637-H645 PolarHBondContact N-O 3.3Å; T637-H645 PolarHBondContact OG1-CD2 3.31Å; T637-H645 PolarHBondContact OG1-O 3.4Å
638	K	90.6	Very high	92.5	Very high	79 Å²	79	26.5 Å²	26.5	34%	0.343	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	123.6	170.4	-168.5	169.8	-167.9	168.3	0	110.3	E621 L624 W789	E621-K638 IonicContact OE1-NZ 3.68Å; E621-K638 PolarHBondContact OE1-NZ 3.5Å; L624-K638 HydrophobicContact CD1-CB 4.13Å; K638-W789 HydrophobicContact CD-CZ3 4.07Å; K638-W789 HydrophobicContact CG-CE3 4.41Å; K638-W789 HydrophobicContact CG-CZ3 4.08Å
639	G	90.2	Very high	92.6	Very high	3 Å²	3	23.8 Å²	23.8	3%	0.031	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	48.3	-173.3	0	0	0	0	0	113	T637 R772 C792	T637-G639 PolarHBondContact O-N 3.02Å; G639-R772 PolarHBondContact O-NH1 3.4Å; G639-R772 PolarHBondContact O-NH2 2.92Å; G639-C792 PolarHBondContact O-SG 3.41Å; G639-C792 VanDerWaalsContact O-SG 3.38Å
640	G	89.8	Confident	92.8	Very high	13 Å²	13	23.2 Å²	23.2	13%	0.134	13%	0.127	C	C	.	.			trans	-61.4	150.7	176.4	0	0	0	0	0	113.7	T637 C642	T637-G640 PolarHBondContact O-N 3.08Å; T637-G640 VanDerWaalsContact O-N 3.11Å; G640-C642 VanDerWaalsContact C-N 3.27Å; G640-C642 PolarHBondContact O-N 3.47Å
641	L	91.6	Very high	93	Very high	4 Å²	4	18.7 Å²	18.7	2%	0.021	10%	0.102	C	C	.	.	S	Bend	trans	-63.4	-36.2	172.3	-67.9	175.2	0	0	0	112	H645 V703 R772 L775 T776 L781 K786	L641-H645 PolarHBondContact N-ND1 3.14Å; L641-V703 HydrophobicContact CD1-CG1 4.35Å; L641-V703 HydrophobicContact CD1-CG2 4.48Å; L641-R772 HydrophobicContact CD1-CB 4.43Å; L641-R772 HydrophobicContact CD1-CG 4.34Å; L641-R772 HydrophobicContact CD2-CB 4.27Å; L641-R772 HydrophobicContact CD2-CG 4.45Å; L641-L775 HydrophobicContact CD1-CB 3.82Å; L641-L775 HydrophobicContact CD1-CD1 4Å; L641-T776 HydrophobicContact CD2-CG2 3.53Å; L641-L781 HydrophobicContact CB-CD1 3.87Å; L641-L781 HydrophobicContact CD1-CD1 4.3Å; L641-K786 HydrophobicContact CD2-CB 3.97Å; L641-K786 WeakPolarHBondContact CD2-O 3.38Å; L641-K786 VanDerWaalsContact O-CD 3.25Å; L641-K786 WeakPolarHBondContact O-CD 3.45Å; L641-K786 PolarHBondContact O-NZ 2.94Å
642	C	91.6	Very high	92.8	Very high	29 Å²	29	18.2 Å²	18.2	20%	0.196	11%	0.109	C	C	.	.	S	Bend	trans	-136.6	163.3	173.4	60.2	0	0	0	0	108.7	G640 D644 H645	G640-C642 VanDerWaalsContact C-N 3.27Å; G640-C642 PolarHBondContact O-N 3.47Å; C642-D644 PolarHBondContact O-N 3.35Å; C642-H645 VanDerWaalsContact O-CB 3.29Å; C642-H645 WeakPolarHBondContact O-CB 3.46Å; C642-H645 PolarHBondContact O-N 3.25Å; C642-H645 VanDerWaalsContact O-N 3.14Å
643	D	91.1	Very high	92.6	Very high	94 Å²	94	21.7 Å²	21.7	50%	0.503	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-27.7	-176.6	-56.2	-4.5	0	0	0	112	H645 L802 F806	D643-H645 PolarHBondContact O-N 2.93Å; D643-L802 HydrophobicContact CB-CD1 4.49Å; D643-L802 HydrophobicContact CB-CD2 4.18Å; D643-F806 HydrophobicContact CB-CZ 4.48Å; D643-F806 VanDerWaalsContact O-CE2 3.25Å; D643-F806 WeakPolarHBondContact O-CE2 3.4Å
644	D	92.2	Very high	92.4	Very high	24 Å²	24	22.9 Å²	22.9	13%	0.128	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.6	22.2	-179.2	-50.5	-6.4	0	0	0	112.6	C642 F646 F679 K684 P704 F806	C642-D644 PolarHBondContact O-N 3.35Å; D644-F646 HydrophobicContact CB-CE2 4.42Å; D644-F646 WeakPolarHBondContact O-CD2 3.43Å; D644-F646 WeakPolarHBondContact O-CE2 3.17Å; D644-F646 PolarHBondContact O-N 3.39Å; D644-F679 HydrophobicContact CB-CE1 3.95Å; D644-F679 HydrophobicContact CB-CZ 4.17Å; D644-K684 IonicContact OD2-NZ 3.39Å; D644-K684 PolarHBondContact OD2-NZ 2.86Å; D644-P704 HydrophobicContact CB-CG 3.57Å; D644-P704 VanDerWaalsContact O-CD 3.23Å; D644-P704 WeakPolarHBondContact O-CD 3.47Å; D644-P704 WeakPolarHBondContact O-CG 3.22Å; D644-F806 HydrophobicContact CB-CE1 4.26Å; D644-F806 HydrophobicContact CB-CZ 4.24Å; D644-F806 WeakPolarHBondContact OD1-CE1 3.25Å; D644-F806 WeakPolarHBondContact OD1-CZ 3.41Å
645	H	94.4	Very high	92.1	Very high	2 Å²	2	26.7 Å²	26.7	1%	0.009	15%	0.151	C	C	.	.			trans	-82.5	107.3	179.6	-173.2	155.5	0	0	0	110.6	T637 L641 C642 D643 H701 V703	T637-H645 WeakPolarHBondContact CB-O 3.08Å; T637-H645 PolarHBondContact N-O 3.3Å; T637-H645 PolarHBondContact OG1-CD2 3.31Å; T637-H645 PolarHBondContact OG1-O 3.4Å; L641-H645 PolarHBondContact N-ND1 3.14Å; C642-H645 VanDerWaalsContact O-CB 3.29Å; C642-H645 WeakPolarHBondContact O-CB 3.46Å; C642-H645 PolarHBondContact O-N 3.25Å; C642-H645 VanDerWaalsContact O-N 3.14Å; D643-H645 PolarHBondContact O-N 2.93Å; H645-H701 AromaticContact CE1-ND1 3.83Å; H645-H701 AromaticContact NE2-CG 3.71Å; H645-H701 AromaticContact NE2-ND1 2.99Å; H645-H701 PolarHBondContact NE2-ND1 2.99Å; H645-V703 WeakPolarHBondContact CE1-CG2 3.1Å
646	F	95.9	Very high	92	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	158.4	-179.2	-62.8	-78.5	0	0	0	113.6	V626 L634 S635 L636 D644 L675 Y678 F679 A702 F806	V626-F646 HydrophobicContact CG2-CE1 4.14Å; L634-F646 HydrophobicContact CD1-CB 3.83Å; L634-F646 HydrophobicContact CD1-CD1 4.31Å; L634-F646 HydrophobicContact CD1-CG 4.28Å; L634-F646 HydrophobicContact CD2-CD1 4.4Å; L634-F646 HydrophobicContact CG-CD1 4.24Å; S635-F646 CarbonylContact O-C 3.52Å; S635-F646 WeakPolarHBondContact O-CA 3.49Å; L636-F646 HydrophobicContact CD2-CD1 3.75Å; L636-F646 HydrophobicContact CD2-CE1 3.48Å; L636-F646 VanDerWaalsContact CD2-CE1 3.48Å; L636-F646 HydrophobicContact CD2-CZ 4.12Å; L636-F646 HydrophobicContact CG-CD1 4.49Å; L636-F646 HydrophobicContact CG-CE1 4.29Å; D644-F646 HydrophobicContact CB-CE2 4.42Å; D644-F646 WeakPolarHBondContact O-CD2 3.43Å; D644-F646 WeakPolarHBondContact O-CE2 3.17Å; D644-F646 PolarHBondContact O-N 3.39Å; F646-L675 HydrophobicContact CD2-CD2 3.77Å; F646-L675 HydrophobicContact CE2-CD2 4.12Å; F646-L675 HydrophobicContact CG-CD2 4.23Å; F646-Y678 HydrophobicContact CE2-CE1 4.48Å; F646-F679 HydrophobicContact CD2-CE2 4.25Å; F646-F679 AromaticContact CD2-CZ 3.81Å; F646-F679 HydrophobicContact CD2-CZ 3.81Å; F646-F679 HydrophobicContact CE2-CE1 4.42Å; F646-F679 HydrophobicContact CE2-CE2 4.39Å; F646-F679 AromaticContact CE2-CZ 3.63Å; F646-F679 HydrophobicContact CE2-CZ 3.63Å; F646-A702 HydrophobicContact CB-CB 4.24Å; F646-A702 PolarHBondContact N-O 3.14Å; F646-A702 PolarHBondContact O-N 3.13Å; F646-F806 HydrophobicContact CE1-CB 4.3Å; F646-F806 HydrophobicContact CE1-CG 4.33Å; F646-F806 HydrophobicContact CZ-CB 4.15Å; F646-F806 AromaticContact CZ-CD1 3.96Å; F646-F806 HydrophobicContact CZ-CD1 3.96Å; F646-F806 HydrophobicContact CZ-CD2 4.39Å; F646-F806 AromaticContact CZ-CG 3.91Å; F646-F806 HydrophobicContact CZ-CG 3.91Å
647	L	94.8	Very high	91.9	Very high	8 Å²	8	26.3 Å²	26.3	4%	0.042	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	127.6	175.4	-178.6	69	0	0	0	108.8	F613 S635 Q699	F613-L647 HydrophobicContact CD1-CD2 3.83Å; F613-L647 HydrophobicContact CE1-CD2 3.52Å; S635-L647 PolarHBondContact N-O 3.46Å; S635-L647 PolarHBondContact O-N 2.9Å; L647-Q699 HydrophobicContact CD1-CB 3.75Å; L647-Q699 HydrophobicContact CD1-CG 4.03Å; L647-Q699 HydrophobicContact CD2-CG 4.37Å
648	I	96	Very high	91.7	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	124.4	170.2	-52	163.6	0	0	0	107.5	L634 V668 Y671 K672 L675 V700	L634-I648 HydrophobicContact CD1-CG1 3.78Å; I648-V668 HydrophobicContact CG2-CB 4.5Å; I648-V668 HydrophobicContact CG2-CG1 4.47Å; I648-V668 HydrophobicContact CG2-CG2 3.92Å; I648-Y671 HydrophobicContact CG2-CD2 4.07Å; I648-K672 HydrophobicContact CD1-CG 4.15Å; I648-L675 HydrophobicContact CD1-CD1 4.18Å; I648-V700 HydrophobicContact CB-CB 4.27Å; I648-V700 PolarHBondContact N-O 3.29Å; I648-V700 PolarHBondContact O-N 3.16Å
649	S	94.2	Very high	91.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	152.6	-177.5	-78	0	0	0	0	111.3	A632 Y633 M698	A632-S649 CarbonylContact C-O 3.58Å; A632-S649 VanDerWaalsContact CA-O 3.3Å; A632-S649 WeakPolarHBondContact CA-O 3.36Å; Y633-S649 WeakPolarHBondContact CD1-O 3.48Å; Y633-S649 PolarHBondContact N-O 3.33Å; Y633-S649 PolarHBondContact O-N 2.85Å; S649-M698 WeakPolarHBondContact CB-O 3.35Å; S649-M698 PolarHBondContact OG-O 3.26Å
650	S	94.3	Very high	91.5	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	147	173.8	55.7	0	0	0	0	110.8	N631 Y633 G652 H697	N631-S650 WeakPolarHBondContact O-CA 3.45Å; Y633-S650 WeakPolarHBondContact CE1-O 3.26Å; S650-G652 WeakPolarHBondContact CB-O 3.3Å; S650-G652 PolarHBondContact OG-O 2.62Å; S650-H697 PolarHBondContact O-CE1 3.42Å; S650-H697 PolarHBondContact O-NE2 3.35Å; S650-H697 PolarHBondContact OG-NE2 3.2Å
651	I	91.9	Very high	91.5	Very high	45 Å²	45	29.2 Å²	29.2	23%	0.231	17%	0.17	C	C	.	.	S	Bend	trans	-65.2	-44.6	177	-67.3	-179.9	0	0	0	110.7	L615 I628 S629 D630 N631 Y633	L615-I651 HydrophobicContact CB-CG2 4.21Å; L615-I651 HydrophobicContact CD1-CB 4.3Å; L615-I651 HydrophobicContact CD1-CD1 4.22Å; L615-I651 HydrophobicContact CD1-CG1 3.75Å; L615-I651 HydrophobicContact CD1-CG2 4.03Å; L615-I651 HydrophobicContact CG-CG1 4.44Å; L615-I651 HydrophobicContact CG-CG2 4.31Å; L615-I651 PolarHBondContact N-O 2.71Å; I628-I651 HydrophobicContact CG2-CD1 3.93Å; S629-I651 WeakPolarHBondContact O-CD1 3.34Å; D630-I651 WeakPolarHBondContact O-CD1 3.46Å; N631-I651 PolarHBondContact O-N 3.46Å; Y633-I651 HydrophobicContact CD1-CG1 4.09Å
652	G	88.6	Confident	91.3	Very high	39 Å²	39	31.1 Å²	31.1	40%	0.402	19%	0.191	S	C	.	.	S	Bend	trans	-87.6	166.9	173.6	0	0	0	0	0	113.3	S650 V654 H697	S650-G652 WeakPolarHBondContact CB-O 3.3Å; S650-G652 PolarHBondContact OG-O 2.62Å; G652-V654 PolarHBondContact O-N 3.44Å; G652-V654 VanDerWaalsContact O-N 3.07Å; G652-H697 PolarHBondContact O-CE1 3.39Å; G652-H697 PolarHBondContact O-NE2 2.93Å
653	H	88.7	Confident	91.3	Very high	74 Å²	74	35.8 Å²	35.8	34%	0.343	21%	0.209	S	C	.	.			trans	-74.8	97.9	-179.5	-162.5	82	0	0	0	111.1	Y608 C614 Q696 H697	Y608-H653 AromaticContact CD2-NE2 3.9Å; C614-H653 VanDerWaalsContact SG-CB 3.59Å; H653-Q696 PolarHBondContact CE1-O 2.83Å; H653-Q696 PolarHBondContact NE2-O 3.33Å; H653-Q696 VanDerWaalsContact NE2-O 3.08Å; H653-H697 AromaticContact ND1-ND1 3.57Å
654	V	89.7	Confident	91.4	Very high	29 Å²	29	32 Å²	32	18%	0.176	19%	0.189	C	C	.	.			trans	-123.7	133.8	173.8	-178.9	0	0	0	0	107.9	G652 A660 I664 H697 M698	G652-V654 PolarHBondContact O-N 3.44Å; G652-V654 VanDerWaalsContact O-N 3.07Å; V654-A660 HydrophobicContact CG1-CB 3.97Å; V654-I664 HydrophobicContact CG2-CD1 3.9Å; V654-H697 CarbonylContact O-C 3.58Å; V654-H697 WeakPolarHBondContact O-CA 3.37Å; V654-M698 WeakPolarHBondContact O-CB 3.28Å; V654-M698 PolarHBondContact O-N 3.21Å
655	Q	88.9	Confident	91.4	Very high	80 Å²	80	33.2 Å²	33.2	37%	0.374	19%	0.193	S	C	.	.			trans	-70.7	-42.3	-170.4	-173.9	178.6	23.5	0	0	113.7	H697 M698	Q655-H697 CarbonylContact O-C 3.45Å; Q655-M698 PolarHBondContact O-N 3.4Å
656	S	91.4	Very high	91.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.221	C	C	.	.			trans	-158.6	163.3	-171.9	62.4	0	0	0	0	111.2	S658 A659 A660 E690 N692 Y747	S656-S658 PolarHBondContact O-N 2.97Å; S656-S658 PolarHBondContact OG-OG 2.96Å; S656-A659 PolarHBondContact O-N 2.82Å; S656-A660 PolarHBondContact O-N 3.37Å; S656-E690 WeakPolarHBondContact CA-OE1 3.42Å; S656-E690 VanDerWaalsContact CB-OE1 3.3Å; S656-E690 WeakPolarHBondContact CB-OE1 3.25Å; S656-N692 PolarHBondContact OG-ND2 3.37Å; S656-Y747 WeakPolarHBondContact CB-OH 3.33Å
657	I	91.5	Very high	91.1	Very high	11 Å²	11	39.9 Å²	39.9	6%	0.056	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-62.2	-31	178.8	-153.8	174.3	0	0	0	111.8	A659 A660 K665 V668 E690 M698 I737	I657-A659 PolarHBondContact O-N 3.2Å; I657-A660 WeakPolarHBondContact O-CB 3.36Å; I657-A660 PolarHBondContact O-N 3.03Å; I657-K665 HydrophobicContact CG1-CG 4.28Å; I657-K665 WeakPolarHBondContact O-CE 2.97Å; I657-V668 HydrophobicContact CD1-CB 4.47Å; I657-V668 HydrophobicContact CD1-CG1 3.85Å; I657-E690 WeakPolarHBondContact CG2-OE2 3.39Å; I657-E690 PolarHBondContact N-OE1 2.77Å; I657-M698 HydrophobicContact CB-SD 4.03Å; I657-M698 HydrophobicContact CG1-SD 4.2Å; I657-I737 HydrophobicContact CG2-CD1 4.19Å; I657-I737 HydrophobicContact CG2-CG2 3.51Å
658	S	87.8	Confident	91.1	Very high	7 Å²	7	39.5 Å²	39.5	5%	0.049	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-66.7	-24.7	175.7	65.7	0	0	0	0	113.4	S656	S656-S658 PolarHBondContact O-N 2.97Å; S656-S658 PolarHBondContact OG-OG 2.96Å
659	A	87.4	Confident	91	Very high	40 Å²	40	43.3 Å²	43.3	33%	0.331	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-97.6	-2	177.6	0	0	0	0	0	113	S656 I657 P743	S656-A659 PolarHBondContact O-N 2.82Å; I657-A659 PolarHBondContact O-N 3.2Å; A659-P743 HydrophobicContact CB-CB 4.21Å
660	A	89.3	Confident	91	Very high	8 Å²	8	47.3 Å²	47.3	7%	0.066	26%	0.259	C	S	.	.	S	Bend	trans	-81.6	149.6	-179.4	0	0	0	0	0	111.9	V654 S656 I657 I664 K665 M698	V654-A660 HydrophobicContact CG1-CB 3.97Å; S656-A660 PolarHBondContact O-N 3.37Å; I657-A660 WeakPolarHBondContact O-CB 3.36Å; I657-A660 PolarHBondContact O-N 3.03Å; A660-I664 HydrophobicContact CB-CB 3.99Å; A660-I664 HydrophobicContact CB-CD1 4.28Å; A660-I664 HydrophobicContact CB-CG2 3.8Å; A660-K665 HydrophobicContact CB-CG 4.4Å; A660-K665 VanDerWaalsContact O-CE 3.26Å; A660-K665 WeakPolarHBondContact O-CE 3.39Å; A660-M698 HydrophobicContact CB-SD 4.43Å
661	D	89.6	Confident	91	Very high	120 Å²	120	47.3 Å²	47.3	64%	0.642	26%	0.259	S	S	*	.			trans	-71.4	167.6	173.1	-63.1	-37.1	0	0	0	111.4	E663 I664 K665	D661-E663 VanDerWaalsContact C-N 3.32Å; D661-E663 PolarHBondContact O-N 3.42Å; D661-I664 PolarHBondContact O-N 3.02Å; D661-K665 WeakPolarHBondContact O-CG 3.38Å; D661-K665 PolarHBondContact O-N 3.12Å
662	G	88.9	Confident	91.2	Very high	44 Å²	44	45.3 Å²	45.3	45%	0.454	25%	0.248	S	C	.	.	H	α-helix	trans	-56.4	-42.4	-177.9	0	0	0	0	0	113.4	I664 K665 E666	G662-I664 PolarHBondContact O-N 3.2Å; G662-K665 WeakPolarHBondContact O-CB 3.21Å; G662-K665 PolarHBondContact O-N 2.74Å; G662-K665 VanDerWaalsContact O-N 3.13Å; G662-E666 WeakPolarHBondContact O-CG 3.36Å; G662-E666 PolarHBondContact O-N 3.04Å
663	E	91.3	Very high	91.4	Very high	126 Å²	126	46.4 Å²	46.4	59%	0.589	25%	0.25	S	C	*	.	H	α-helix	trans	-60.6	-45.5	-178.5	-60.5	178.3	-172.6	0	0	112.2	N631 D661 K665 E666 E667	N631-E663 PolarHBondContact ND2-OE2 3.33Å; D661-E663 VanDerWaalsContact C-N 3.32Å; D661-E663 PolarHBondContact O-N 3.42Å; E663-K665 VanDerWaalsContact C-N 3.31Å; E663-K665 PolarHBondContact O-N 3.12Å; E663-E666 PolarHBondContact O-N 3.29Å; E663-E667 PolarHBondContact O-N 2.92Å; E663-E667 VanDerWaalsContact O-N 3.1Å
664	I	92.1	Very high	91.7	Very high	14 Å²	14	43.8 Å²	43.8	7%	0.072	24%	0.24	C	C	.	.	H	α-helix	trans	-62.5	-40.3	176.5	-65.7	166.2	0	0	0	110.6	N631 V654 A660 D661 G662 E667 V668 M698	N631-I664 HydrophobicContact CB-CG1 3.71Å; V654-I664 HydrophobicContact CG2-CD1 3.9Å; A660-I664 HydrophobicContact CB-CB 3.99Å; A660-I664 HydrophobicContact CB-CD1 4.28Å; A660-I664 HydrophobicContact CB-CG2 3.8Å; D661-I664 PolarHBondContact O-N 3.02Å; G662-I664 PolarHBondContact O-N 3.2Å; I664-E667 PolarHBondContact O-N 2.8Å; I664-V668 HydrophobicContact CG2-CG2 4.3Å; I664-V668 WeakPolarHBondContact O-CB 3.44Å; I664-V668 WeakPolarHBondContact O-CG2 3.28Å; I664-V668 PolarHBondContact O-N 2.96Å; I664-M698 HydrophobicContact CG2-CE 3.79Å; I664-M698 HydrophobicContact CG2-SD 4.25Å
665	K	91.8	Very high	91.9	Very high	50 Å²	50	42.4 Å²	42.4	22%	0.217	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-42.5	179.7	-68.7	178.2	-178.5	179.2	0	111.6	I657 A660 D661 G662 E663 V668 E669 S738	I657-K665 HydrophobicContact CG1-CG 4.28Å; I657-K665 WeakPolarHBondContact O-CE 2.97Å; A660-K665 HydrophobicContact CB-CG 4.4Å; A660-K665 VanDerWaalsContact O-CE 3.26Å; A660-K665 WeakPolarHBondContact O-CE 3.39Å; D661-K665 WeakPolarHBondContact O-CG 3.38Å; D661-K665 PolarHBondContact O-N 3.12Å; G662-K665 WeakPolarHBondContact O-CB 3.21Å; G662-K665 PolarHBondContact O-N 2.74Å; G662-K665 VanDerWaalsContact O-N 3.13Å; E663-K665 VanDerWaalsContact C-N 3.31Å; E663-K665 PolarHBondContact O-N 3.12Å; K665-V668 PolarHBondContact O-N 3.45Å; K665-E669 WeakPolarHBondContact O-CG 3.47Å; K665-E669 PolarHBondContact O-N 3.04Å; K665-S738 PolarHBondContact NZ-OG 3.22Å
666	E	92.6	Very high	92.2	Very high	128 Å²	128	43.1 Å²	43.1	60%	0.598	23%	0.233	S	C	*	.	H	α-helix	trans	-61	-47.2	177.2	-72	175.8	-164.7	0	0	111.3	G662 E663 V668 E669 Q670	G662-E666 WeakPolarHBondContact O-CG 3.36Å; G662-E666 PolarHBondContact O-N 3.04Å; E663-E666 PolarHBondContact O-N 3.29Å; E666-V668 PolarHBondContact O-N 3.01Å; E666-E669 PolarHBondContact O-N 2.89Å; E666-Q670 WeakPolarHBondContact O-CG 3.44Å; E666-Q670 PolarHBondContact O-N 2.77Å
667	E	93.4	Very high	92.3	Very high	14 Å²	14	45.7 Å²	45.7	7%	0.065	25%	0.251	C	S	.	.	H	α-helix	trans	-63.4	-38.8	176.8	-72.3	178.9	-155.4	0	0	112.5	S629 N631 A632 E663 I664 Q670 Y671	S629-E667 WeakPolarHBondContact CB-OE2 2.84Å; S629-E667 PolarHBondContact OG-OE2 3.41Å; N631-E667 WeakPolarHBondContact CA-OE2 3.46Å; N631-E667 WeakPolarHBondContact CB-OE1 3.38Å; N631-E667 PolarHBondContact N-OE1 3.46Å; N631-E667 PolarHBondContact N-OE2 3.24Å; N631-E667 PolarHBondContact ND2-OE1 2.95Å; A632-E667 HydrophobicContact CB-CB 4.14Å; A632-E667 WeakPolarHBondContact CB-OE2 3.46Å; A632-E667 PolarHBondContact N-OE2 3.34Å; E663-E667 PolarHBondContact O-N 2.92Å; E663-E667 VanDerWaalsContact O-N 3.1Å; I664-E667 PolarHBondContact O-N 2.8Å; E667-Q670 PolarHBondContact O-N 2.79Å; E667-Y671 VanDerWaalsContact O-CD2 3.25Å; E667-Y671 WeakPolarHBondContact O-CD2 3.39Å; E667-Y671 PolarHBondContact O-N 2.93Å
668	V	94.1	Very high	92.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.9	-43.5	175.4	169.8	0	0	0	0	111.1	I648 I657 I664 K665 E666 Y671 K672 M698 V700	I648-V668 HydrophobicContact CG2-CB 4.5Å; I648-V668 HydrophobicContact CG2-CG1 4.47Å; I648-V668 HydrophobicContact CG2-CG2 3.92Å; I657-V668 HydrophobicContact CD1-CB 4.47Å; I657-V668 HydrophobicContact CD1-CG1 3.85Å; I664-V668 HydrophobicContact CG2-CG2 4.3Å; I664-V668 WeakPolarHBondContact O-CB 3.44Å; I664-V668 WeakPolarHBondContact O-CG2 3.28Å; I664-V668 PolarHBondContact O-N 2.96Å; K665-V668 PolarHBondContact O-N 3.45Å; E666-V668 PolarHBondContact O-N 3.01Å; V668-Y671 PolarHBondContact O-N 2.88Å; V668-K672 WeakPolarHBondContact O-CG 3.38Å; V668-K672 PolarHBondContact O-N 3.36Å; V668-M698 HydrophobicContact CG2-CE 3.76Å; V668-V700 HydrophobicContact CG1-CG2 4.48Å
669	E	93.4	Very high	92.7	Very high	81 Å²	81	45.3 Å²	45.3	38%	0.379	25%	0.248	S	C	.	.	H	α-helix	trans	-68.4	-34.1	177.1	-70.9	-54.6	135.7	0	0	112.9	K665 E666 K672 S673	K665-E669 WeakPolarHBondContact O-CG 3.47Å; K665-E669 PolarHBondContact O-N 3.04Å; E666-E669 PolarHBondContact O-N 2.89Å; E669-K672 PolarHBondContact O-N 2.76Å; E669-K672 IonicContact OE1-NZ 3.12Å; E669-K672 PolarHBondContact OE1-NZ 2.99Å; E669-S673 WeakPolarHBondContact O-CB 2.91Å; E669-S673 PolarHBondContact O-N 3.25Å; E669-S673 PolarHBondContact O-OG 3.26Å
670	Q	93.9	Very high	93	Very high	83 Å²	83	50.3 Å²	50.3	39%	0.388	27%	0.265	S	S	.	.	H	α-helix	trans	-62.2	-49.7	171.4	-71.4	174.3	18.7	0	0	110.8	E666 E667 K672 S673 C674 F815	E666-Q670 WeakPolarHBondContact O-CG 3.44Å; E666-Q670 PolarHBondContact O-N 2.77Å; E667-Q670 PolarHBondContact O-N 2.79Å; Q670-K672 VanDerWaalsContact C-N 3.34Å; Q670-K672 PolarHBondContact O-N 2.84Å; Q670-S673 WeakPolarHBondContact O-CB 3.44Å; Q670-S673 PolarHBondContact O-N 3.48Å; Q670-S673 VanDerWaalsContact O-N 3.11Å; Q670-C674 PolarHBondContact O-N 2.88Å; Q670-C674 PolarHBondContact O-SG 2.94Å; Q670-F815 HydrophobicContact CB-CD1 4.03Å; Q670-F815 HydrophobicContact CB-CE1 3.72Å; Q670-F815 HydrophobicContact CB-CE2 4.45Å; Q670-F815 HydrophobicContact CB-CZ 3.95Å; Q670-F815 VanDerWaalsContact OE1-CD2 3.3Å
671	Y	95.3	Very high	93.1	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.4	-43.2	175.4	-82.1	-57.1	0	0	0	112.6	S627 S629 A632 L634 I648 E667 V668 S673 C674 L675 F815 N816	S627-Y671 PolarHBondContact OG-OH 3.17Å; S629-Y671 PolarHBondContact N-OH 3.37Å; A632-Y671 HydrophobicContact CB-CE2 4.2Å; L634-Y671 HydrophobicContact CB-CD1 4.07Å; L634-Y671 HydrophobicContact CB-CE1 3.84Å; L634-Y671 HydrophobicContact CD2-CD1 4.35Å; I648-Y671 HydrophobicContact CG2-CD2 4.07Å; E667-Y671 VanDerWaalsContact O-CD2 3.25Å; E667-Y671 WeakPolarHBondContact O-CD2 3.39Å; E667-Y671 PolarHBondContact O-N 2.93Å; V668-Y671 PolarHBondContact O-N 2.88Å; Y671-S673 VanDerWaalsContact C-N 3.31Å; Y671-S673 PolarHBondContact O-N 3.32Å; Y671-C674 PolarHBondContact O-N 2.86Å; Y671-L675 WeakPolarHBondContact O-CB 3.46Å; Y671-L675 WeakPolarHBondContact O-CG 3.35Å; Y671-L675 PolarHBondContact O-N 2.91Å; Y671-F815 HydrophobicContact CD1-CD1 4.43Å; Y671-F815 AromaticContact CD1-CE1 3.5Å; Y671-F815 HydrophobicContact CD1-CE1 3.5Å; Y671-F815 HydrophobicContact CD1-CZ 4.19Å; Y671-F815 HydrophobicContact CD2-CE1 4.05Å; Y671-F815 HydrophobicContact CD2-CZ 4.03Å; Y671-F815 HydrophobicContact CE1-CD1 4.46Å; Y671-F815 AromaticContact CE1-CE1 3.55Å; Y671-F815 HydrophobicContact CE1-CE1 3.55Å; Y671-F815 AromaticContact CE1-CZ 3.95Å; Y671-F815 HydrophobicContact CE1-CZ 3.95Å; Y671-F815 HydrophobicContact CE2-CE1 4.13Å; Y671-F815 AromaticContact CE2-CZ 3.82Å; Y671-F815 HydrophobicContact CE2-CZ 3.82Å; Y671-F815 AromaticContact CG-CE1 3.75Å; Y671-F815 HydrophobicContact CG-CE1 3.75Å; Y671-F815 HydrophobicContact CG-CZ 4.21Å; Y671-F815 AromaticContact CZ-CE1 3.89Å; Y671-F815 AromaticContact CZ-CZ 3.78Å; Y671-N816 PolarHBondContact OH-ND2 2.87Å; Y671-N816 VanDerWaalsContact OH-ND2 3.1Å
672	K	94.9	Very high	93.3	Very high	4 Å²	4	54 Å²	54	2%	0.017	28%	0.28	C	S	.	.	H	α-helix	trans	-58.6	-43.3	174.7	-73.6	179.3	-175.3	172.3	0	111.7	I648 V668 E669 Q670 L675 K676 F688 E751	I648-K672 HydrophobicContact CD1-CG 4.15Å; V668-K672 WeakPolarHBondContact O-CG 3.38Å; V668-K672 PolarHBondContact O-N 3.36Å; E669-K672 PolarHBondContact O-N 2.76Å; E669-K672 IonicContact OE1-NZ 3.12Å; E669-K672 PolarHBondContact OE1-NZ 2.99Å; Q670-K672 VanDerWaalsContact C-N 3.34Å; Q670-K672 PolarHBondContact O-N 2.84Å; K672-L675 PolarHBondContact O-N 2.8Å; K672-K676 WeakPolarHBondContact O-CB 3.37Å; K672-K676 VanDerWaalsContact O-CG 3.27Å; K672-K676 WeakPolarHBondContact O-CG 3.25Å; K672-K676 PolarHBondContact O-N 3.04Å; K672-F688 HydrophobicContact CB-CE1 4.12Å; K672-F688 HydrophobicContact CB-CE2 4.27Å; K672-F688 HydrophobicContact CB-CZ 3.91Å; K672-F688 HydrophobicContact CD-CD1 4.48Å; K672-F688 HydrophobicContact CD-CG 4.38Å; K672-F688 HydrophobicContact CG-CD1 3.86Å; K672-F688 HydrophobicContact CG-CD2 4.42Å; K672-F688 HydrophobicContact CG-CE1 3.74Å; K672-F688 HydrophobicContact CG-CE2 4.33Å; K672-F688 HydrophobicContact CG-CG 4.2Å; K672-F688 HydrophobicContact CG-CZ 3.98Å; K672-E751 VanDerWaalsContact NZ-CD 3.33Å; K672-E751 IonicContact NZ-OE1 3.24Å; K672-E751 PolarHBondContact NZ-OE1 3.15Å; K672-E751 IonicContact NZ-OE2 3.76Å; K672-E751 PolarHBondContact NZ-OE2 3.19Å
673	S	94	Very high	93.4	Very high	62 Å²	62	54.2 Å²	54.2	43%	0.434	28%	0.283	S	S	.	.	H	α-helix	trans	-66.3	-41.8	-179.6	-59.5	0	0	0	0	112.3	E669 Q670 Y671 K676 S677	E669-S673 WeakPolarHBondContact O-CB 2.91Å; E669-S673 PolarHBondContact O-N 3.25Å; E669-S673 PolarHBondContact O-OG 3.26Å; Q670-S673 WeakPolarHBondContact O-CB 3.44Å; Q670-S673 PolarHBondContact O-N 3.48Å; Q670-S673 VanDerWaalsContact O-N 3.11Å; Y671-S673 VanDerWaalsContact C-N 3.31Å; Y671-S673 PolarHBondContact O-N 3.32Å; S673-K676 PolarHBondContact O-N 2.9Å; S673-S677 PolarHBondContact O-N 2.96Å; S673-S677 VanDerWaalsContact O-N 3.12Å; S673-S677 PolarHBondContact O-OG 3.27Å
674	C	94.5	Very high	93.6	Very high	19 Å²	19	51.1 Å²	51.1	13%	0.128	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-43.7	174.4	-64.3	0	0	0	0	111.9	Q670 Y671 S677 Y678 F810 Y813	Q670-C674 PolarHBondContact O-N 2.88Å; Q670-C674 PolarHBondContact O-SG 2.94Å; Y671-C674 PolarHBondContact O-N 2.86Å; C674-S677 PolarHBondContact O-N 3.34Å; C674-Y678 WeakPolarHBondContact O-CB 3.4Å; C674-Y678 PolarHBondContact O-N 3.3Å; C674-F810 HydrophobicContact CB-CE2 4.14Å; C674-F810 HydrophobicContact CB-CZ 3.78Å; C674-Y813 WeakPolarHBondContact CB-O 3.29Å; C674-Y813 PolarHBondContact SG-O 3.28Å
675	L	94.8	Very high	93.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-40.2	176.7	-73.7	171	0	0	0	112.3	L634 F646 I648 Y671 K672 Y678 F679 F688 A702 F810	L634-L675 HydrophobicContact CD1-CD1 4Å; L634-L675 HydrophobicContact CD2-CD2 4.35Å; F646-L675 HydrophobicContact CD2-CD2 3.77Å; F646-L675 HydrophobicContact CE2-CD2 4.12Å; F646-L675 HydrophobicContact CG-CD2 4.23Å; I648-L675 HydrophobicContact CD1-CD1 4.18Å; Y671-L675 WeakPolarHBondContact O-CB 3.46Å; Y671-L675 WeakPolarHBondContact O-CG 3.35Å; Y671-L675 PolarHBondContact O-N 2.91Å; K672-L675 PolarHBondContact O-N 2.8Å; L675-Y678 PolarHBondContact O-N 2.9Å; L675-F679 HydrophobicContact CB-CD2 4.41Å; L675-F679 HydrophobicContact CB-CE2 4.35Å; L675-F679 HydrophobicContact CD2-CE2 4.07Å; L675-F679 WeakPolarHBondContact O-CD2 3.5Å; L675-F679 PolarHBondContact O-N 3.28Å; L675-F688 HydrophobicContact CB-CE1 4.41Å; L675-F688 HydrophobicContact CB-CZ 4.22Å; L675-F688 HydrophobicContact CD1-CE1 4Å; L675-A702 HydrophobicContact CD1-CB 3.86Å; L675-F810 HydrophobicContact CD2-CE2 3.91Å; L675-F810 HydrophobicContact CD2-CZ 4.41Å; L675-F810 HydrophobicContact CG-CE2 4.38Å
676	K	94.2	Very high	93.8	Very high	95 Å²	95	49.3 Å²	49.3	41%	0.413	26%	0.262	S	S	.	.	H	α-helix	trans	-56.7	-50.5	174	-76.7	171.4	-175.6	176.7	0	110.7	K672 S673 Y678 F679 E680 V686 F688	K672-K676 WeakPolarHBondContact O-CB 3.37Å; K672-K676 VanDerWaalsContact O-CG 3.27Å; K672-K676 WeakPolarHBondContact O-CG 3.25Å; K672-K676 PolarHBondContact O-N 3.04Å; S673-K676 PolarHBondContact O-N 2.9Å; K676-Y678 PolarHBondContact O-N 3.38Å; K676-F679 PolarHBondContact O-N 2.98Å; K676-E680 VanDerWaalsContact O-CB 3.3Å; K676-E680 WeakPolarHBondContact O-CB 3.36Å; K676-E680 PolarHBondContact O-N 3.35Å; K676-V686 HydrophobicContact CB-CG1 4.48Å; K676-V686 HydrophobicContact CG-CG1 3.71Å; K676-F688 HydrophobicContact CD-CE2 4.37Å; K676-F688 HydrophobicContact CG-CE2 3.96Å; K676-F688 HydrophobicContact CG-CZ 4.23Å
677	S	93.7	Very high	94	Very high	54 Å²	54	43.2 Å²	43.2	38%	0.378	23%	0.233	S	C	.	.	H	α-helix	trans	-62.6	-44.1	178.9	-52.1	0	0	0	0	112	S673 C674 F679 E680 D681	S673-S677 PolarHBondContact O-N 2.96Å; S673-S677 VanDerWaalsContact O-N 3.12Å; S673-S677 PolarHBondContact O-OG 3.27Å; C674-S677 PolarHBondContact O-N 3.34Å; S677-F679 VanDerWaalsContact C-N 3.35Å; S677-F679 PolarHBondContact O-N 3.12Å; S677-E680 PolarHBondContact O-N 2.89Å; S677-D681 PolarHBondContact O-N 3.02Å
678	Y	94.2	Very high	94.1	Very high	10 Å²	10	42.8 Å²	42.8	4%	0.039	23%	0.231	C	C	.	.	H	α-helix	trans	-60.4	-40.5	178.2	172.8	-107.4	0	0	0	113.2	F646 C674 L675 K676 Q682 S809 F810 Y813	F646-Y678 HydrophobicContact CE2-CE1 4.48Å; C674-Y678 WeakPolarHBondContact O-CB 3.4Å; C674-Y678 PolarHBondContact O-N 3.3Å; L675-Y678 PolarHBondContact O-N 2.9Å; K676-Y678 PolarHBondContact O-N 3.38Å; Y678-Q682 VanDerWaalsContact CE1-NE2 3.32Å; Y678-Q682 VanDerWaalsContact CE2-NE2 3.32Å; Y678-Q682 PolarHBondContact OH-NE2 3.48Å; Y678-Q682 VanDerWaalsContact OH-NE2 3.07Å; Y678-S809 PolarHBondContact OH-OG 3.47Å; Y678-F810 HydrophobicContact CD1-CD2 4.3Å; Y678-F810 HydrophobicContact CD2-CD2 4.08Å; Y678-F810 AromaticContact CG-CD2 3.9Å; Y678-F810 HydrophobicContact CG-CD2 3.9Å; Y678-F810 HydrophobicContact CG-CE2 4.45Å; Y678-Y813 AromaticContact CD2-CD2 3.6Å; Y678-Y813 HydrophobicContact CD2-CD2 3.6Å; Y678-Y813 AromaticContact CD2-CE2 3.62Å; Y678-Y813 HydrophobicContact CD2-CE2 3.62Å; Y678-Y813 HydrophobicContact CD2-CG 4.43Å; Y678-Y813 HydrophobicContact CG-CD2 4.27Å; Y678-Y813 HydrophobicContact CG-CE2 4.43Å
679	F	94.3	Very high	94.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-81.5	-30.9	179.7	-71.5	-53.3	0	0	0	113.3	D644 F646 L675 K676 S677 D681 Q682 G683 K684 V686 P704	D644-F679 HydrophobicContact CB-CE1 3.95Å; D644-F679 HydrophobicContact CB-CZ 4.17Å; F646-F679 HydrophobicContact CD2-CE2 4.25Å; F646-F679 AromaticContact CD2-CZ 3.81Å; F646-F679 HydrophobicContact CD2-CZ 3.81Å; F646-F679 HydrophobicContact CE2-CE1 4.42Å; F646-F679 HydrophobicContact CE2-CE2 4.39Å; F646-F679 AromaticContact CE2-CZ 3.63Å; F646-F679 HydrophobicContact CE2-CZ 3.63Å; L675-F679 HydrophobicContact CB-CD2 4.41Å; L675-F679 HydrophobicContact CB-CE2 4.35Å; L675-F679 HydrophobicContact CD2-CE2 4.07Å; L675-F679 WeakPolarHBondContact O-CD2 3.5Å; L675-F679 PolarHBondContact O-N 3.28Å; K676-F679 PolarHBondContact O-N 2.98Å; S677-F679 VanDerWaalsContact C-N 3.35Å; S677-F679 PolarHBondContact O-N 3.12Å; F679-D681 VanDerWaalsContact C-N 3.33Å; F679-D681 PolarHBondContact O-N 3.47Å; F679-Q682 CarbonylContact O-C 3.42Å; F679-Q682 WeakPolarHBondContact O-CA 3.34Å; F679-Q682 WeakPolarHBondContact O-CB 3.5Å; F679-Q682 PolarHBondContact O-N 3Å; F679-G683 PolarHBondContact O-N 3.19Å; F679-K684 CarbonylContact C-O 3.6Å; F679-K684 VanDerWaalsContact C-O 3.28Å; F679-K684 HydrophobicContact CB-CB 4.1Å; F679-K684 HydrophobicContact CD1-CB 4.42Å; F679-K684 HydrophobicContact CD1-CD 4.2Å; F679-K684 PolarHBondContact O-N 2.95Å; F679-V686 HydrophobicContact CD2-CB 3.82Å; F679-V686 HydrophobicContact CD2-CG1 4.37Å; F679-V686 HydrophobicContact CD2-CG2 4.09Å; F679-V686 HydrophobicContact CE2-CB 4.36Å; F679-V686 HydrophobicContact CE2-CG2 4.14Å; F679-P704 HydrophobicContact CD1-CB 3.67Å; F679-P704 HydrophobicContact CD1-CG 4.28Å; F679-P704 HydrophobicContact CD2-CB 4.13Å; F679-P704 HydrophobicContact CE1-CB 3.48Å; F679-P704 VanDerWaalsContact CE1-CB 3.48Å; F679-P704 HydrophobicContact CE1-CG 3.57Å; F679-P704 HydrophobicContact CE2-CB 3.95Å; F679-P704 HydrophobicContact CE2-CG 4.2Å; F679-P704 HydrophobicContact CG-CB 4Å; F679-P704 HydrophobicContact CZ-CB 3.61Å; F679-P704 HydrophobicContact CZ-CG 3.5Å
680	E	92.7	Very high	94.2	Very high	145 Å²	145	39.6 Å²	39.6	68%	0.678	22%	0.216	S	C	*	.	H	α-helix	trans	-59.6	-44.4	174.1	-174.6	168.6	-160.6	0	0	111	K676 S677 Q682 G683	K676-E680 VanDerWaalsContact O-CB 3.3Å; K676-E680 WeakPolarHBondContact O-CB 3.36Å; K676-E680 PolarHBondContact O-N 3.35Å; S677-E680 PolarHBondContact O-N 2.89Å; E680-Q682 PolarHBondContact O-N 3.09Å; E680-Q682 VanDerWaalsContact O-N 3.11Å; E680-G683 PolarHBondContact O-N 3.09Å
681	D	92.4	Very high	94.1	Very high	126 Å²	126	38.4 Å²	38.4	67%	0.674	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-19.6	173.9	-95	35.1	0	0	0	113.7	S677 F679 Y813	S677-D681 PolarHBondContact O-N 3.02Å; F679-D681 VanDerWaalsContact C-N 3.33Å; F679-D681 PolarHBondContact O-N 3.47Å; D681-Y813 VanDerWaalsContact CB-OH 3.26Å; D681-Y813 WeakPolarHBondContact CB-OH 3.11Å; D681-Y813 PolarHBondContact OD2-OH 3.47Å
682	Q	92.1	Very high	93.9	Very high	78 Å²	78	38.6 Å²	38.6	36%	0.364	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	3.4	175.4	-62.4	-177	22.1	0	0	113.6	Y678 F679 E680 K684	Y678-Q682 VanDerWaalsContact CE1-NE2 3.32Å; Y678-Q682 VanDerWaalsContact CE2-NE2 3.32Å; Y678-Q682 PolarHBondContact OH-NE2 3.48Å; Y678-Q682 VanDerWaalsContact OH-NE2 3.07Å; F679-Q682 CarbonylContact O-C 3.42Å; F679-Q682 WeakPolarHBondContact O-CA 3.34Å; F679-Q682 WeakPolarHBondContact O-CB 3.5Å; F679-Q682 PolarHBondContact O-N 3Å; E680-Q682 PolarHBondContact O-N 3.09Å; E680-Q682 VanDerWaalsContact O-N 3.11Å; Q682-K684 HydrophobicContact CB-CD 4.25Å; Q682-K684 HydrophobicContact CB-CG 4.34Å; Q682-K684 PolarHBondContact O-N 3.48Å
683	G	92.5	Very high	93.4	Very high	49 Å²	49	40.1 Å²	40.1	51%	0.505	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.6	26.7	-173.7	0	0	0	0	0	113.3	F679 E680 A707	F679-G683 PolarHBondContact O-N 3.19Å; E680-G683 PolarHBondContact O-N 3.09Å; G683-A707 VanDerWaalsContact O-CB 3.31Å; G683-A707 WeakPolarHBondContact O-CB 3.43Å; G683-A707 PolarHBondContact O-N 3.39Å
684	K	94.2	Very high	92.7	Very high	62 Å²	62	47.1 Å²	47.1	27%	0.27	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	155.3	177.2	-65.6	173.1	-174.6	161.1	0	109.7	D644 F679 Q682 P704 L705	D644-K684 IonicContact OD2-NZ 3.39Å; D644-K684 PolarHBondContact OD2-NZ 2.86Å; F679-K684 CarbonylContact C-O 3.6Å; F679-K684 VanDerWaalsContact C-O 3.28Å; F679-K684 HydrophobicContact CB-CB 4.1Å; F679-K684 HydrophobicContact CD1-CB 4.42Å; F679-K684 HydrophobicContact CD1-CD 4.2Å; F679-K684 PolarHBondContact O-N 2.95Å; Q682-K684 HydrophobicContact CB-CD 4.25Å; Q682-K684 HydrophobicContact CB-CG 4.34Å; Q682-K684 PolarHBondContact O-N 3.48Å; K684-P704 HydrophobicContact CD-CB 4.28Å; K684-L705 CarbonylContact C-O 3.56Å; K684-L705 VanDerWaalsContact CA-O 3.32Å; K684-L705 WeakPolarHBondContact CA-O 2.79Å; K684-L705 WeakPolarHBondContact CB-O 3.46Å
685	C	93.7	Very high	92.1	Very high	18 Å²	18	47 Å²	47	12%	0.122	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	158.4	168.6	67.8	0	0	0	0	109.3	P704 L705 A710 P753	C685-P704 CarbonylContact O-C 3.54Å; C685-P704 VanDerWaalsContact O-CA 3.27Å; C685-P704 WeakPolarHBondContact O-CA 3.24Å; C685-L705 PolarHBondContact N-O 3.47Å; C685-L705 PolarHBondContact O-N 2.97Å; C685-L705 VanDerWaalsContact O-O 3.14Å; C685-L705 PolarHBondContact SG-O 3.2Å; C685-L705 VanDerWaalsContact SG-O 3.4Å; C685-A710 HydrophobicContact CB-CB 4.45Å; C685-P753 HydrophobicContact CB-CB 3.9Å; C685-P753 HydrophobicContact CB-CG 3.75Å
686	V	95.3	Very high	91.5	Very high	8 Å²	8	51.5 Å²	51.5	5%	0.048	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.5	-177.1	58.3	0	0	0	0	111.1	K676 F679 F688 A702	K676-V686 HydrophobicContact CB-CG1 4.48Å; K676-V686 HydrophobicContact CG-CG1 3.71Å; F679-V686 HydrophobicContact CD2-CB 3.82Å; F679-V686 HydrophobicContact CD2-CG1 4.37Å; F679-V686 HydrophobicContact CD2-CG2 4.09Å; F679-V686 HydrophobicContact CE2-CB 4.36Å; F679-V686 HydrophobicContact CE2-CG2 4.14Å; V686-F688 HydrophobicContact CB-CE2 4.3Å; V686-F688 HydrophobicContact CB-CZ 4.27Å; V686-F688 HydrophobicContact CG1-CD2 4.4Å; V686-F688 HydrophobicContact CG1-CE2 3.44Å; V686-F688 VanDerWaalsContact CG1-CE2 3.44Å; V686-F688 HydrophobicContact CG1-CZ 3.57Å; V686-F688 HydrophobicContact CG2-CD1 4.41Å; V686-F688 HydrophobicContact CG2-CD2 4.48Å; V686-F688 HydrophobicContact CG2-CE1 3.91Å; V686-F688 HydrophobicContact CG2-CE2 3.97Å; V686-F688 HydrophobicContact CG2-CZ 3.67Å; V686-A702 HydrophobicContact CG2-CB 4.01Å
687	V	96	Very high	91.3	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	126.4	171.3	176.4	0	0	0	0	108.2	V703 L705 I713 F717 L752 P753 L775	V687-V703 PolarHBondContact N-O 3.48Å; V687-V703 PolarHBondContact O-N 3.47Å; V687-L705 HydrophobicContact CG2-CD1 3.73Å; V687-I713 HydrophobicContact CG2-CD1 3.7Å; V687-I713 HydrophobicContact CG2-CG2 3.86Å; V687-F717 HydrophobicContact CG1-CE2 4.28Å; V687-F717 HydrophobicContact CG1-CZ 4.39Å; V687-L752 HydrophobicContact CG1-CD2 4.2Å; V687-P753 HydrophobicContact CG2-CG 4.42Å; V687-L775 HydrophobicContact CG2-CD2 4.42Å
688	F	96.6	Very high	91.3	Very high	4 Å²	4	44.5 Å²	44.5	2%	0.018	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	136.2	172.5	-58	-83	0	0	0	109.7	K672 L675 K676 V686 V700 H701 A702 A750 E751	K672-F688 HydrophobicContact CB-CE1 4.12Å; K672-F688 HydrophobicContact CB-CE2 4.27Å; K672-F688 HydrophobicContact CB-CZ 3.91Å; K672-F688 HydrophobicContact CD-CD1 4.48Å; K672-F688 HydrophobicContact CD-CG 4.38Å; K672-F688 HydrophobicContact CG-CD1 3.86Å; K672-F688 HydrophobicContact CG-CD2 4.42Å; K672-F688 HydrophobicContact CG-CE1 3.74Å; K672-F688 HydrophobicContact CG-CE2 4.33Å; K672-F688 HydrophobicContact CG-CG 4.2Å; K672-F688 HydrophobicContact CG-CZ 3.98Å; L675-F688 HydrophobicContact CB-CE1 4.41Å; L675-F688 HydrophobicContact CB-CZ 4.22Å; L675-F688 HydrophobicContact CD1-CE1 4Å; K676-F688 HydrophobicContact CD-CE2 4.37Å; K676-F688 HydrophobicContact CG-CE2 3.96Å; K676-F688 HydrophobicContact CG-CZ 4.23Å; V686-F688 HydrophobicContact CB-CE2 4.3Å; V686-F688 HydrophobicContact CB-CZ 4.27Å; V686-F688 HydrophobicContact CG1-CD2 4.4Å; V686-F688 HydrophobicContact CG1-CE2 3.44Å; V686-F688 VanDerWaalsContact CG1-CE2 3.44Å; V686-F688 HydrophobicContact CG1-CZ 3.57Å; V686-F688 HydrophobicContact CG2-CD1 4.41Å; V686-F688 HydrophobicContact CG2-CD2 4.48Å; V686-F688 HydrophobicContact CG2-CE1 3.91Å; V686-F688 HydrophobicContact CG2-CE2 3.97Å; V686-F688 HydrophobicContact CG2-CZ 3.67Å; F688-V700 HydrophobicContact CB-CG1 4.44Å; F688-H701 CarbonylContact C-O 3.54Å; F688-H701 VanDerWaalsContact CA-O 3.22Å; F688-H701 WeakPolarHBondContact CA-O 3.39Å; F688-A702 HydrophobicContact CD1-CB 3.64Å; F688-A702 HydrophobicContact CE1-CB 3.51Å; F688-A750 CarbonylContact O-C 3.56Å; F688-A750 VanDerWaalsContact O-CA 3.27Å; F688-A750 WeakPolarHBondContact O-CA 3.28Å; F688-E751 HydrophobicContact CB-CB 4.25Å; F688-E751 PolarHBondContact N-O 3.44Å; F688-E751 VanDerWaalsContact N-O 3.12Å; F688-E751 PolarHBondContact O-N 3.4Å
689	F	95.2	Very high	91.2	Very high	10 Å²	10	45.4 Å²	45.4	4%	0.044	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	149.1	172.2	67.4	-93.7	0	0	0	112.8	H701 V703 F748 F749 A750 A771 L775	F689-H701 HydrophobicContact CD1-CB 3.99Å; F689-H701 HydrophobicContact CD2-CB 4.02Å; F689-H701 HydrophobicContact CE1-CB 3.56Å; F689-H701 HydrophobicContact CE2-CB 3.57Å; F689-H701 AromaticContact CE2-CD2 3.54Å; F689-H701 AromaticContact CE2-CG 3.6Å; F689-H701 HydrophobicContact CG-CB 4.21Å; F689-H701 HydrophobicContact CZ-CB 3.33Å; F689-H701 AromaticContact CZ-CG 3.58Å; F689-H701 PolarHBondContact N-O 3.38Å; F689-H701 PolarHBondContact O-N 2.86Å; F689-V703 HydrophobicContact CE1-CG2 3.73Å; F689-V703 HydrophobicContact CZ-CG2 4.49Å; F689-F748 HydrophobicContact CB-CE2 4.13Å; F689-F748 HydrophobicContact CB-CZ 4.1Å; F689-F748 HydrophobicContact CD2-CE2 4.08Å; F689-F748 HydrophobicContact CG-CE2 4.4Å; F689-F749 CarbonylContact C-O 3.51Å; F689-F749 WeakPolarHBondContact CA-O 3.31Å; F689-F749 WeakPolarHBondContact CB-O 3.1Å; F689-A750 HydrophobicContact CB-CB 3.9Å; F689-A771 HydrophobicContact CD1-CB 4.02Å; F689-A771 HydrophobicContact CD2-CB 3.53Å; F689-A771 HydrophobicContact CE1-CB 3.97Å; F689-A771 HydrophobicContact CE2-CB 3.5Å; F689-A771 VanDerWaalsContact CE2-CB 3.5Å; F689-A771 HydrophobicContact CG-CB 3.8Å; F689-A771 HydrophobicContact CZ-CB 3.73Å; F689-L775 HydrophobicContact CD1-CD1 4.23Å; F689-L775 HydrophobicContact CE1-CD1 3.71Å
690	E	94.4	Very high	91.3	Very high	5 Å²	5	45.7 Å²	45.7	2%	0.023	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	136	175.9	-173.7	-170.3	-171.9	0	0	109.4	S656 I657 V700 Y747 F749	S656-E690 WeakPolarHBondContact CA-OE1 3.42Å; S656-E690 VanDerWaalsContact CB-OE1 3.3Å; S656-E690 WeakPolarHBondContact CB-OE1 3.25Å; I657-E690 WeakPolarHBondContact CG2-OE2 3.39Å; I657-E690 PolarHBondContact N-OE1 2.77Å; E690-V700 HydrophobicContact CB-CG2 4.45Å; E690-Y747 HydrophobicContact CG-CE2 4.43Å; E690-Y747 PolarHBondContact OE1-OH 3.41Å; E690-Y747 VanDerWaalsContact OE1-OH 3.08Å; E690-Y747 VanDerWaalsContact OE2-CE2 3.31Å; E690-Y747 WeakPolarHBondContact OE2-CE2 3.5Å; E690-Y747 PolarHBondContact OE2-OH 3.34Å; E690-F749 PolarHBondContact N-O 3.22Å; E690-F749 PolarHBondContact O-N 3.47Å
691	R	92.2	Very high	91.5	Very high	58 Å²	58	39.9 Å²	39.9	22%	0.219	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	94.2	173.6	-174	-162.6	70.3	-122.6	-11.3	110	Y693 F748 M763 F766 V768	R691-Y693 VanDerWaalsContact C-N 3.3Å; R691-Y693 PolarHBondContact O-N 3.13Å; R691-Y693 VanDerWaalsContact O-N 3.12Å; R691-F748 HydrophobicContact CB-CD2 4.17Å; R691-F748 HydrophobicContact CG-CD2 4.44Å; R691-M763 HydrophobicContact CG-CE 4.4Å; R691-F766 HydrophobicContact CG-CE1 4.18Å; R691-V768 WeakPolarHBondContact CD-O 3.42Å; R691-V768 VanDerWaalsContact CZ-CG1 3.5Å; R691-V768 PolarHBondContact NH1-O 3.45Å
692	N	90.3	Very high	91.7	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.016	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	71.3	168.7	-172.2	22.5	0	0	0	110.9	S656 T695 C745 P746 Y747	S656-N692 PolarHBondContact OG-ND2 3.37Å; N692-T695 HydrophobicContact CB-CG2 4.46Å; N692-T695 WeakPolarHBondContact OD1-CG2 3.38Å; N692-C745 PolarHBondContact ND2-O 3.05Å; N692-C745 VanDerWaalsContact ND2-O 3.13Å; N692-P746 CarbonylContact O-C 3.52Å; N692-P746 WeakPolarHBondContact O-CA 3.32Å; N692-P746 WeakPolarHBondContact O-CB 3.23Å; N692-Y747 CarbonylContact C-O 3.51Å; N692-Y747 HydrophobicContact CB-CD1 3.69Å; N692-Y747 HydrophobicContact CB-CD2 4.49Å; N692-Y747 HydrophobicContact CB-CE1 3.5Å; N692-Y747 VanDerWaalsContact CB-CE1 3.5Å; N692-Y747 HydrophobicContact CB-CE2 4.28Å; N692-Y747 HydrophobicContact CB-CG 4.23Å; N692-Y747 PolarHBondContact N-O 3.42Å; N692-Y747 WeakPolarHBondContact ND2-CE1 3.37Å; N692-Y747 PolarHBondContact O-N 2.9Å
693	Y	85	Confident	91.9	Very high	36 Å²	36	30.2 Å²	30.2	14%	0.141	14%	0.144	C	C	.	.	S	Bend	trans	-145.2	116.3	172.8	178.3	-109.4	0	0	0	108.9	R691 T695 P746 M763 F766	R691-Y693 VanDerWaalsContact C-N 3.3Å; R691-Y693 PolarHBondContact O-N 3.13Å; R691-Y693 VanDerWaalsContact O-N 3.12Å; Y693-T695 PolarHBondContact O-N 3.45Å; Y693-P746 HydrophobicContact CD2-CB 3.98Å; Y693-M763 HydrophobicContact CD2-CB 3.7Å; Y693-M763 HydrophobicContact CE2-CB 4.08Å; Y693-M763 VanDerWaalsContact CE2-O 3.25Å; Y693-M763 WeakPolarHBondContact CE2-O 3.26Å; Y693-M763 HydrophobicContact CG-CB 4.22Å; Y693-M763 HydrophobicContact CG-CE 4.18Å; Y693-F766 HydrophobicContact CD1-CB 4.23Å; Y693-F766 HydrophobicContact CE1-CB 4.2Å
694	R	79	Confident	92	Very high	210 Å²	210	28.1 Å²	28.1	79%	0.792	12%	0.122	S	C	*	.	S	Bend	trans	53.9	29.1	-171.9	-57.4	-179.1	175.3	179.1	-3	113.7
695	T	81	Confident	92	Very high	16 Å²	16	25.2 Å²	25.2	10%	0.098	11%	0.109	C	C	.	.			trans	-101	151.9	171.8	-169.1	0	0	0	0	110.5	N692 Y693 H697 Q699	N692-T695 HydrophobicContact CB-CG2 4.46Å; N692-T695 WeakPolarHBondContact OD1-CG2 3.38Å; Y693-T695 PolarHBondContact O-N 3.45Å; T695-H697 PolarHBondContact OG1-O 3.44Å; T695-H697 VanDerWaalsContact OG1-O 3.05Å; T695-Q699 PolarHBondContact OG1-NE2 3.02Å
696	Q	82.7	Confident	91.9	Very high	94 Å²	94	26.7 Å²	26.7	44%	0.439	12%	0.118	S	C	.	.	S	Bend	trans	-108.1	-22.9	176.7	-60.8	178.6	7.1	0	0	112.1	H653	H653-Q696 PolarHBondContact CE1-O 2.83Å; H653-Q696 PolarHBondContact NE2-O 3.33Å; H653-Q696 VanDerWaalsContact NE2-O 3.08Å
697	H	90.7	Very high	91.8	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	13%	0.134	C	C	.	.	S	Bend	trans	-134.5	141.9	-174.7	-157.1	112.7	0	0	0	110.6	C611 F613 C614 S650 G652 H653 V654 Q655 T695 Q699	C611-H697 PolarHBondContact SG-ND1 3.08Å; C611-H697 VanDerWaalsContact SG-ND1 3.36Å; F613-H697 HydrophobicContact CB-CB 3.95Å; F613-H697 VanDerWaalsContact CB-CD2 3.49Å; F613-H697 WeakPolarHBondContact CB-CD2 3.21Å; F613-H697 HydrophobicContact CD2-CB 3.89Å; F613-H697 HydrophobicContact CG-CB 4.25Å; C614-H697 PolarHBondContact SG-CE1 2.61Å; C614-H697 PolarHBondContact SG-ND1 2.85Å; S650-H697 PolarHBondContact O-CE1 3.42Å; S650-H697 PolarHBondContact O-NE2 3.35Å; S650-H697 PolarHBondContact OG-NE2 3.2Å; G652-H697 PolarHBondContact O-CE1 3.39Å; G652-H697 PolarHBondContact O-NE2 2.93Å; H653-H697 AromaticContact ND1-ND1 3.57Å; V654-H697 CarbonylContact O-C 3.58Å; V654-H697 WeakPolarHBondContact O-CA 3.37Å; Q655-H697 CarbonylContact O-C 3.45Å; T695-H697 PolarHBondContact OG1-O 3.44Å; T695-H697 VanDerWaalsContact OG1-O 3.05Å; H697-Q699 WeakPolarHBondContact O-CG 3.49Å; H697-Q699 PolarHBondContact O-N 3.13Å; H697-Q699 PolarHBondContact O-NE2 3.23Å
698	M	92.6	Very high	91.5	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	17%	0.165	C	C	.	.			trans	-61.7	125	-177.8	-174.8	-174.6	78.5	0	0	110.7	S649 V654 Q655 I657 A660 I664 V668	S649-M698 WeakPolarHBondContact CB-O 3.35Å; S649-M698 PolarHBondContact OG-O 3.26Å; V654-M698 WeakPolarHBondContact O-CB 3.28Å; V654-M698 PolarHBondContact O-N 3.21Å; Q655-M698 PolarHBondContact O-N 3.4Å; I657-M698 HydrophobicContact CB-SD 4.03Å; I657-M698 HydrophobicContact CG1-SD 4.2Å; A660-M698 HydrophobicContact CB-SD 4.43Å; I664-M698 HydrophobicContact CG2-CE 3.79Å; I664-M698 HydrophobicContact CG2-SD 4.25Å; V668-M698 HydrophobicContact CG2-CE 3.76Å
699	Q	92.8	Very high	91.3	Very high	30 Å²	30	36.8 Å²	36.8	14%	0.14	18%	0.176	C	C	.	.			trans	-139.1	98.1	-174.6	-76.5	164.5	57.3	0	0	108.6	F613 L647 T695 H697	F613-Q699 HydrophobicContact CD1-CG 4.25Å; F613-Q699 HydrophobicContact CD2-CG 4.49Å; F613-Q699 HydrophobicContact CE1-CG 4Å; F613-Q699 VanDerWaalsContact CE2-CD 3.5Å; F613-Q699 HydrophobicContact CE2-CG 4.27Å; F613-Q699 HydrophobicContact CG-CG 4.49Å; F613-Q699 HydrophobicContact CZ-CG 4.01Å; L647-Q699 HydrophobicContact CD1-CB 3.75Å; L647-Q699 HydrophobicContact CD1-CG 4.03Å; L647-Q699 HydrophobicContact CD2-CG 4.37Å; T695-Q699 PolarHBondContact OG1-NE2 3.02Å; H697-Q699 WeakPolarHBondContact O-CG 3.49Å; H697-Q699 PolarHBondContact O-N 3.13Å; H697-Q699 PolarHBondContact O-NE2 3.23Å
700	V	95.7	Very high	91	Very high	5 Å²	5	36.7 Å²	36.7	3%	0.03	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	108.5	172	-177.6	0	0	0	0	107.7	I648 V668 F688 E690	I648-V700 HydrophobicContact CB-CB 4.27Å; I648-V700 PolarHBondContact N-O 3.29Å; I648-V700 PolarHBondContact O-N 3.16Å; V668-V700 HydrophobicContact CG1-CG2 4.48Å; F688-V700 HydrophobicContact CB-CG1 4.44Å; E690-V700 HydrophobicContact CB-CG2 4.45Å
701	H	96.5	Very high	90.8	Very high	24 Å²	24	40 Å²	40	11%	0.111	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	140.4	178.1	-71.9	-92.4	0	0	0	110.4	H645 F688 F689	H645-H701 AromaticContact CE1-ND1 3.83Å; H645-H701 AromaticContact NE2-CG 3.71Å; H645-H701 AromaticContact NE2-ND1 2.99Å; H645-H701 PolarHBondContact NE2-ND1 2.99Å; F688-H701 CarbonylContact C-O 3.54Å; F688-H701 VanDerWaalsContact CA-O 3.22Å; F688-H701 WeakPolarHBondContact CA-O 3.39Å; F689-H701 HydrophobicContact CD1-CB 3.99Å; F689-H701 HydrophobicContact CD2-CB 4.02Å; F689-H701 HydrophobicContact CE1-CB 3.56Å; F689-H701 HydrophobicContact CE2-CB 3.57Å; F689-H701 AromaticContact CE2-CD2 3.54Å; F689-H701 AromaticContact CE2-CG 3.6Å; F689-H701 HydrophobicContact CG-CB 4.21Å; F689-H701 HydrophobicContact CZ-CB 3.33Å; F689-H701 AromaticContact CZ-CG 3.58Å; F689-H701 PolarHBondContact N-O 3.38Å; F689-H701 PolarHBondContact O-N 2.86Å
702	A	96.7	Very high	90.8	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	112.4	173	0	0	0	0	0	109.2	F646 L675 V686 F688	F646-A702 HydrophobicContact CB-CB 4.24Å; F646-A702 PolarHBondContact N-O 3.14Å; F646-A702 PolarHBondContact O-N 3.13Å; L675-A702 HydrophobicContact CD1-CB 3.86Å; V686-A702 HydrophobicContact CG2-CB 4.01Å; F688-A702 HydrophobicContact CD1-CB 3.64Å; F688-A702 HydrophobicContact CE1-CB 3.51Å
703	V	96	Very high	90.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	113	-177.9	-175.5	0	0	0	0	110	L641 H645 V687 F689 L775 L781	L641-V703 HydrophobicContact CD1-CG1 4.35Å; L641-V703 HydrophobicContact CD1-CG2 4.48Å; H645-V703 WeakPolarHBondContact CE1-CG2 3.1Å; V687-V703 PolarHBondContact N-O 3.48Å; V687-V703 PolarHBondContact O-N 3.47Å; F689-V703 HydrophobicContact CE1-CG2 3.73Å; F689-V703 HydrophobicContact CZ-CG2 4.49Å; V703-L775 HydrophobicContact CB-CD1 3.98Å; V703-L775 HydrophobicContact CG1-CD1 4.11Å; V703-L775 HydrophobicContact CG2-CD1 3.89Å; V703-L781 HydrophobicContact CG1-CD1 4.24Å
704	P	95.1	Very high	91.2	Very high	6 Å²	6	42 Å²	42	4%	0.039	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	145.2	174.8	31.1	-34	0	0	0	111.9	D644 F679 K684 C685	D644-P704 HydrophobicContact CB-CG 3.57Å; D644-P704 VanDerWaalsContact O-CD 3.23Å; D644-P704 WeakPolarHBondContact O-CD 3.47Å; D644-P704 WeakPolarHBondContact O-CG 3.22Å; F679-P704 HydrophobicContact CD1-CB 3.67Å; F679-P704 HydrophobicContact CD1-CG 4.28Å; F679-P704 HydrophobicContact CD2-CB 4.13Å; F679-P704 HydrophobicContact CE1-CB 3.48Å; F679-P704 VanDerWaalsContact CE1-CB 3.48Å; F679-P704 HydrophobicContact CE1-CG 3.57Å; F679-P704 HydrophobicContact CE2-CB 3.95Å; F679-P704 HydrophobicContact CE2-CG 4.2Å; F679-P704 HydrophobicContact CG-CB 4Å; F679-P704 HydrophobicContact CZ-CB 3.61Å; F679-P704 HydrophobicContact CZ-CG 3.5Å; K684-P704 HydrophobicContact CD-CB 4.28Å; C685-P704 CarbonylContact O-C 3.54Å; C685-P704 VanDerWaalsContact O-CA 3.27Å; C685-P704 WeakPolarHBondContact O-CA 3.24Å
705	L	93.8	Very high	91.9	Very high	1 Å²	1	34 Å²	34	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	146.3	178.3	-70.5	155	0	0	0	108.7	K684 C685 V687 A707 I713 L775 L780 L781	K684-L705 CarbonylContact C-O 3.56Å; K684-L705 VanDerWaalsContact CA-O 3.32Å; K684-L705 WeakPolarHBondContact CA-O 2.79Å; K684-L705 WeakPolarHBondContact CB-O 3.46Å; C685-L705 PolarHBondContact N-O 3.47Å; C685-L705 PolarHBondContact O-N 2.97Å; C685-L705 VanDerWaalsContact O-O 3.14Å; C685-L705 PolarHBondContact SG-O 3.2Å; C685-L705 VanDerWaalsContact SG-O 3.4Å; V687-L705 HydrophobicContact CG2-CD1 3.73Å; L705-A707 PolarHBondContact O-N 2.87Å; L705-I713 HydrophobicContact CD1-CD1 3.41Å; L705-I713 VanDerWaalsContact CD1-CD1 3.41Å; L705-I713 HydrophobicContact CD1-CG1 3.82Å; L705-L775 HydrophobicContact CD1-CD2 3.9Å; L705-L780 HydrophobicContact CD2-CB 4.19Å; L705-L781 HydrophobicContact CD2-CD1 4.25Å; L705-L781 HydrophobicContact CD2-CD2 3.71Å; L705-L781 HydrophobicContact CD2-CG 3.59Å
706	P	93.2	Very high	92.5	Very high	48 Å²	48	33.3 Å²	33.3	31%	0.312	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-50.7	134.9	168.3	-29	38.3	0	0	0	112	D708 K709	P706-D708 WeakPolarHBondContact CB-OD1 3.34Å; P706-D708 PolarHBondContact O-N 3.18Å; P706-K709 HydrophobicContact CB-CD 4.39Å; P706-K709 HydrophobicContact CB-CG 4.32Å; P706-K709 HydrophobicContact CG-CD 4.35Å; P706-K709 WeakPolarHBondContact O-CB 3.2Å; P706-K709 PolarHBondContact O-N 2.81Å
707	A	91.8	Very high	93	Very high	46 Å²	46	28.9 Å²	28.9	38%	0.38	16%	0.162	S	C	.	.	G	3₁₀ helix	trans	-61.5	-29.2	-172.6	0	0	0	0	0	113.6	G683 L705 K709 A710	G683-A707 VanDerWaalsContact O-CB 3.31Å; G683-A707 WeakPolarHBondContact O-CB 3.43Å; G683-A707 PolarHBondContact O-N 3.39Å; L705-A707 PolarHBondContact O-N 2.87Å; A707-K709 PolarHBondContact O-N 3.27Å; A707-A710 WeakPolarHBondContact O-CB 3.44Å; A707-A710 PolarHBondContact O-N 3.23Å; A707-A710 VanDerWaalsContact O-N 3.16Å
708	D	91	Very high	93.1	Very high	120 Å²	120	31.7 Å²	31.7	64%	0.642	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-60.2	-28.5	173.4	62.6	-46.1	0	0	0	112.8	P706	P706-D708 WeakPolarHBondContact CB-OD1 3.34Å; P706-D708 PolarHBondContact O-N 3.18Å
709	K	90.8	Very high	93	Very high	59 Å²	59	36 Å²	36	26%	0.257	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-85.8	-9.3	-179.9	-59	-172.7	-179.1	179.8	0	113.4	P706 A707 V711 N712 L780	P706-K709 HydrophobicContact CB-CD 4.39Å; P706-K709 HydrophobicContact CB-CG 4.32Å; P706-K709 HydrophobicContact CG-CD 4.35Å; P706-K709 WeakPolarHBondContact O-CB 3.2Å; P706-K709 PolarHBondContact O-N 2.81Å; A707-K709 PolarHBondContact O-N 3.27Å; K709-V711 PolarHBondContact O-N 2.52Å; K709-V711 VanDerWaalsContact O-N 3.11Å; K709-N712 PolarHBondContact O-N 3.02Å; K709-L780 HydrophobicContact CB-CD2 4.12Å; K709-L780 VanDerWaalsContact CD-O 3.25Å; K709-L780 WeakPolarHBondContact CD-O 3.11Å; K709-L780 WeakPolarHBondContact CE-O 3.4Å; K709-L780 PolarHBondContact NZ-O 3.19Å
710	A	89.5	Confident	93	Very high	7 Å²	7	34.8 Å²	34.8	6%	0.058	19%	0.192	C	C	.	.	H	α-helix	trans	-54.5	-35.4	-176.2	0	0	0	0	0	113.4	C685 A707 N712 I713 Y754	C685-A710 HydrophobicContact CB-CB 4.45Å; A707-A710 WeakPolarHBondContact O-CB 3.44Å; A707-A710 PolarHBondContact O-N 3.23Å; A707-A710 VanDerWaalsContact O-N 3.16Å; A710-N712 VanDerWaalsContact C-N 3.26Å; A710-N712 PolarHBondContact O-N 3.3Å; A710-I713 HydrophobicContact CB-CD1 4.38Å; A710-I713 PolarHBondContact O-N 3.07Å; A710-Y754 HydrophobicContact CB-CE2 3.72Å
711	V	89.8	Confident	92.8	Very high	74 Å²	74	34.6 Å²	34.6	45%	0.448	19%	0.191	S	C	.	.	H	α-helix	trans	-64.2	-29.8	-178.1	-176.1	0	0	0	0	112.6	K709	K709-V711 PolarHBondContact O-N 2.52Å; K709-V711 VanDerWaalsContact O-N 3.11Å
712	N	92	Very high	92.4	Very high	59 Å²	59	36.8 Å²	36.8	32%	0.316	21%	0.213	S	C	.	.	H	α-helix	trans	-89.2	-17.1	-175.3	-65.9	-27	0	0	0	113	K709 A710 R714 A715 C716 D779 L780	K709-N712 PolarHBondContact O-N 3.02Å; A710-N712 VanDerWaalsContact C-N 3.26Å; A710-N712 PolarHBondContact O-N 3.3Å; N712-R714 PolarHBondContact O-N 3.19Å; N712-A715 WeakPolarHBondContact O-CB 3.34Å; N712-A715 PolarHBondContact O-N 2.9Å; N712-C716 PolarHBondContact O-N 3.04Å; N712-C716 PolarHBondContact O-SG 3Å; N712-C716 VanDerWaalsContact O-SG 3.41Å; N712-D779 HydrophobicContact CB-CB 4.42Å; N712-L780 HydrophobicContact CB-CD2 4.16Å
713	I	92.9	Very high	92.1	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-55.4	-52.6	-172.7	-59.9	172.8	0	0	0	111.3	V687 L705 A710 A715 C716 F717 L752 P753 L780	V687-I713 HydrophobicContact CG2-CD1 3.7Å; V687-I713 HydrophobicContact CG2-CG2 3.86Å; L705-I713 HydrophobicContact CD1-CD1 3.41Å; L705-I713 VanDerWaalsContact CD1-CD1 3.41Å; L705-I713 HydrophobicContact CD1-CG1 3.82Å; A710-I713 HydrophobicContact CB-CD1 4.38Å; A710-I713 PolarHBondContact O-N 3.07Å; I713-A715 VanDerWaalsContact C-N 3.29Å; I713-A715 PolarHBondContact O-N 3.16Å; I713-C716 PolarHBondContact O-N 3.13Å; I713-F717 HydrophobicContact CG2-CD2 3.78Å; I713-F717 HydrophobicContact CG2-CE2 3.77Å; I713-F717 WeakPolarHBondContact O-CD2 3.46Å; I713-F717 PolarHBondContact O-N 2.86Å; I713-L752 HydrophobicContact CG2-CD2 3.65Å; I713-P753 HydrophobicContact CD1-CG 3.93Å; I713-L780 HydrophobicContact CG1-CD1 4.45Å; I713-L780 HydrophobicContact CG1-CD2 3.75Å
714	R	92.8	Very high	91.7	Very high	81 Å²	81	46 Å²	46	31%	0.306	26%	0.26	S	S	.	.	H	α-helix	trans	-56.3	-43.5	178.8	-178.3	177.3	171.3	-98.6	3.9	111.9	N712 F717 L718 E730 L752	N712-R714 PolarHBondContact O-N 3.19Å; R714-F717 PolarHBondContact O-N 3.39Å; R714-L718 HydrophobicContact CG-CD1 4.11Å; R714-L718 WeakPolarHBondContact O-CG 3.49Å; R714-L718 PolarHBondContact O-N 3.34Å; R714-L718 VanDerWaalsContact O-N 3.09Å; R714-E730 IonicContact CZ-OE1 2.81Å; R714-E730 IonicContact NE-OE1 3.8Å; R714-E730 PolarHBondContact NE-OE1 2.94Å; R714-E730 IonicContact NH2-OE1 2.7Å; R714-E730 PolarHBondContact NH2-OE1 3.37Å; R714-E730 IonicContact NH2-OE2 3.75Å; R714-L752 HydrophobicContact CB-CD1 3.67Å; R714-L752 HydrophobicContact CG-CD1 4.17Å
715	A	92	Very high	91	Very high	41 Å²	41	49.1 Å²	49.1	34%	0.339	29%	0.293	S	S	.	.	H	α-helix	trans	-65.2	-42.4	-179.2	0	0	0	0	0	111.5	N712 I713 L718 Q719	N712-A715 WeakPolarHBondContact O-CB 3.34Å; N712-A715 PolarHBondContact O-N 2.9Å; I713-A715 VanDerWaalsContact C-N 3.29Å; I713-A715 PolarHBondContact O-N 3.16Å; A715-L718 PolarHBondContact O-N 3.08Å; A715-Q719 VanDerWaalsContact O-CB 3.31Å; A715-Q719 WeakPolarHBondContact O-CB 3.41Å; A715-Q719 PolarHBondContact O-N 3.39Å
716	C	93.3	Very high	90.6	Very high	2 Å²	2	50.8 Å²	50.8	1%	0.014	30%	0.3	C	S	.	.	H	α-helix	trans	-62.2	-44.3	176.3	-65.8	0	0	0	0	112	N712 I713 L718 Q719 T720 H777 L780	N712-C716 PolarHBondContact O-N 3.04Å; N712-C716 PolarHBondContact O-SG 3Å; N712-C716 VanDerWaalsContact O-SG 3.41Å; I713-C716 PolarHBondContact O-N 3.13Å; C716-L718 PolarHBondContact O-N 3.37Å; C716-Q719 PolarHBondContact O-N 3.31Å; C716-T720 WeakPolarHBondContact O-CB 3.11Å; C716-T720 PolarHBondContact O-N 3.17Å; C716-T720 PolarHBondContact O-OG1 3.23Å; C716-H777 HydrophobicContact CB-CB 4.24Å; C716-H777 PolarHBondContact SG-ND1 2.99Å; C716-L780 HydrophobicContact CB-CD1 3.79Å; C716-L780 HydrophobicContact CB-CG 4.4Å
717	F	94	Very high	90	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60	-47.1	175.4	-89.1	-82	0	0	0	112.5	V687 I713 R714 Q719 T720 A721 L728 F748 A750 L752 L758 F770 A771 A774 L775	V687-F717 HydrophobicContact CG1-CE2 4.28Å; V687-F717 HydrophobicContact CG1-CZ 4.39Å; I713-F717 HydrophobicContact CG2-CD2 3.78Å; I713-F717 HydrophobicContact CG2-CE2 3.77Å; I713-F717 WeakPolarHBondContact O-CD2 3.46Å; I713-F717 PolarHBondContact O-N 2.86Å; R714-F717 PolarHBondContact O-N 3.39Å; F717-Q719 VanDerWaalsContact C-N 3.34Å; F717-Q719 PolarHBondContact O-N 2.77Å; F717-T720 PolarHBondContact O-N 3.48Å; F717-A721 WeakPolarHBondContact O-CB 3.04Å; F717-A721 PolarHBondContact O-N 3.34Å; F717-L728 HydrophobicContact CB-CD1 4.02Å; F717-L728 VanDerWaalsContact O-CD1 3.29Å; F717-L728 WeakPolarHBondContact O-CD1 3.05Å; F717-F748 HydrophobicContact CD1-CE1 4.48Å; F717-F748 HydrophobicContact CE1-CE1 4.18Å; F717-F748 AromaticContact CE1-CZ 3.88Å; F717-F748 HydrophobicContact CE1-CZ 3.88Å; F717-A750 HydrophobicContact CE1-CB 4.45Å; F717-L752 HydrophobicContact CD2-CD2 4.26Å; F717-L752 HydrophobicContact CE2-CD2 4.22Å; F717-L758 HydrophobicContact CB-CD1 3.76Å; F717-L758 HydrophobicContact CG-CD1 4.08Å; F717-F770 AromaticContact CD1-CE1 3.85Å; F717-F770 HydrophobicContact CD1-CE1 3.85Å; F717-F770 HydrophobicContact CD1-CZ 4.2Å; F717-F770 HydrophobicContact CE1-CE1 4.19Å; F717-A771 HydrophobicContact CE1-CB 4.34Å; F717-A774 HydrophobicContact CD1-CB 3.84Å; F717-A774 HydrophobicContact CD2-CB 4.4Å; F717-A774 HydrophobicContact CE1-CB 3.89Å; F717-A774 HydrophobicContact CE2-CB 4.46Å; F717-A774 HydrophobicContact CG-CB 4.1Å; F717-A774 HydrophobicContact CZ-CB 4.21Å; F717-L775 HydrophobicContact CE2-CD2 4.1Å; F717-L775 HydrophobicContact CE2-CG 4.44Å; F717-L775 HydrophobicContact CZ-CD2 4.39Å; F717-L775 HydrophobicContact CZ-CG 4.3Å
718	L	92.3	Very high	89.8	Confident	60 Å²	60	54.9 Å²	54.9	31%	0.314	31%	0.307	S	S	.	.	H	α-helix	trans	-63	-40.1	178	-68.1	175.2	0	0	0	112.2	R714 A715 C716 A721 A722 L728	R714-L718 HydrophobicContact CG-CD1 4.11Å; R714-L718 WeakPolarHBondContact O-CG 3.49Å; R714-L718 PolarHBondContact O-N 3.34Å; R714-L718 VanDerWaalsContact O-N 3.09Å; A715-L718 PolarHBondContact O-N 3.08Å; C716-L718 PolarHBondContact O-N 3.37Å; L718-A721 PolarHBondContact O-N 2.93Å; L718-A722 WeakPolarHBondContact O-CB 3.35Å; L718-A722 PolarHBondContact O-N 3.44Å; L718-L728 HydrophobicContact CD2-CB 3.99Å; L718-L728 HydrophobicContact CD2-CD1 4.04Å
719	Q	91.7	Very high	89.6	Confident	93 Å²	93	52.9 Å²	52.9	44%	0.435	30%	0.295	S	S	.	.	H	α-helix	trans	-66.6	-46.4	177.5	-175.3	178	-1.9	0	0	111.7	A715 C716 F717 A721 A722 N723	A715-Q719 VanDerWaalsContact O-CB 3.31Å; A715-Q719 WeakPolarHBondContact O-CB 3.41Å; A715-Q719 PolarHBondContact O-N 3.39Å; C716-Q719 PolarHBondContact O-N 3.31Å; F717-Q719 VanDerWaalsContact C-N 3.34Å; F717-Q719 PolarHBondContact O-N 2.77Å; Q719-A721 VanDerWaalsContact C-N 3.3Å; Q719-A721 PolarHBondContact O-N 3.35Å; Q719-A722 PolarHBondContact O-N 3.25Å; Q719-N723 VanDerWaalsContact O-CG 3.25Å; Q719-N723 PolarHBondContact O-N 2.74Å; Q719-N723 PolarHBondContact O-OD1 3.33Å
720	T	91.8	Very high	89.4	Confident	3 Å²	3	55 Å²	55	2%	0.018	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-36.1	177.3	-55.3	0	0	0	0	111.4	C716 F717 N723 H724 F770 E773 A774	C716-T720 WeakPolarHBondContact O-CB 3.11Å; C716-T720 PolarHBondContact O-N 3.17Å; C716-T720 PolarHBondContact O-OG1 3.23Å; F717-T720 PolarHBondContact O-N 3.48Å; T720-N723 PolarHBondContact O-N 3.16Å; T720-H724 PolarHBondContact O-N 2.98Å; T720-H724 PolarHBondContact O-ND1 3.36Å; T720-F770 HydrophobicContact CG2-CD2 3.87Å; T720-F770 HydrophobicContact CG2-CE2 3.63Å; T720-E773 HydrophobicContact CG2-CB 4.27Å; T720-E773 HydrophobicContact CG2-CG 4.03Å; T720-A774 HydrophobicContact CG2-CB 4.33Å
721	A	91.4	Very high	89.2	Confident	2 Å²	2	56 Å²	56	2%	0.017	31%	0.311	C	S	.	.	H	α-helix	trans	-66	-43.1	174.2	0	0	0	0	0	112	F717 L718 Q719 N723 H724 G725 F726 L728 F770	F717-A721 WeakPolarHBondContact O-CB 3.04Å; F717-A721 PolarHBondContact O-N 3.34Å; L718-A721 PolarHBondContact O-N 2.93Å; Q719-A721 VanDerWaalsContact C-N 3.3Å; Q719-A721 PolarHBondContact O-N 3.35Å; A721-N723 VanDerWaalsContact C-N 3.32Å; A721-N723 PolarHBondContact O-N 3.44Å; A721-H724 CarbonylContact O-C 3.51Å; A721-H724 PolarHBondContact O-N 3.39Å; A721-H724 VanDerWaalsContact O-N 3.15Å; A721-G725 PolarHBondContact O-N 3.02Å; A721-F726 CarbonylContact C-O 3.52Å; A721-F726 HydrophobicContact CB-CD2 3.91Å; A721-F726 HydrophobicContact CB-CE2 3.69Å; A721-F726 HydrophobicContact CB-CZ 4.42Å; A721-F726 WeakPolarHBondContact CB-O 3.47Å; A721-F726 PolarHBondContact O-N 2.91Å; A721-L728 HydrophobicContact CB-CD1 3.51Å; A721-L728 HydrophobicContact CB-CG 3.78Å; A721-F770 HydrophobicContact CB-CE2 4.2Å; A721-F770 HydrophobicContact CB-CZ 3.98Å
722	A	89.5	Confident	88.9	Confident	70 Å²	70	55 Å²	55	58%	0.579	31%	0.311	S	S	*	.	H	α-helix	trans	-61.2	-39.2	175	0	0	0	0	0	112.2	L718 Q719 H724 G725	L718-A722 WeakPolarHBondContact O-CB 3.35Å; L718-A722 PolarHBondContact O-N 3.44Å; Q719-A722 PolarHBondContact O-N 3.25Å; A722-H724 VanDerWaalsContact C-N 3.26Å; A722-H724 PolarHBondContact O-N 3.11Å; A722-G725 PolarHBondContact O-N 3.37Å
723	N	88.8	Confident	88.3	Confident	116 Å²	116	58.8 Å²	58.8	62%	0.62	33%	0.327	S	S	*	.	H	α-helix	trans	-62.1	-33.2	175.9	-69.1	-14.8	0	0	0	112.7	Q719 T720 A721	Q719-N723 VanDerWaalsContact O-CG 3.25Å; Q719-N723 PolarHBondContact O-N 2.74Å; Q719-N723 PolarHBondContact O-OD1 3.33Å; T720-N723 PolarHBondContact O-N 3.16Å; A721-N723 VanDerWaalsContact C-N 3.32Å; A721-N723 PolarHBondContact O-N 3.44Å
724	H	87.8	Confident	87.7	Confident	78 Å²	78	65.2 Å²	65.2	36%	0.361	36%	0.361	S	S	.	.	H	α-helix	trans	-90.8	-6.1	177.6	-72.1	91.1	0	0	0	114.2	T720 A721 A722 F726 E773	T720-H724 PolarHBondContact O-N 2.98Å; T720-H724 PolarHBondContact O-ND1 3.36Å; A721-H724 CarbonylContact O-C 3.51Å; A721-H724 PolarHBondContact O-N 3.39Å; A721-H724 VanDerWaalsContact O-N 3.15Å; A722-H724 VanDerWaalsContact C-N 3.26Å; A722-H724 PolarHBondContact O-N 3.11Å; H724-F726 HydrophobicContact CB-CD1 3.61Å; H724-F726 HydrophobicContact CB-CE1 3.3Å; H724-F726 HydrophobicContact CB-CZ 4.21Å; H724-E773 IonicContact CE1-OE1 2.61Å; H724-E773 PolarHBondContact CE1-OE1 2.71Å; H724-E773 IonicContact CE1-OE2 2.94Å; H724-E773 PolarHBondContact CE1-OE2 3.19Å; H724-E773 IonicContact NE2-OE2 2.85Å
725	G	81.9	Confident	87.1	Confident	70 Å²	70	63 Å²	63	72%	0.722	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	25.5	176.3	0	0	0	0	0	115.1	A721 A722	A721-G725 PolarHBondContact O-N 3.02Å; A722-G725 PolarHBondContact O-N 3.37Å
726	F	84	Confident	86.4	Confident	37 Å²	37	66.4 Å²	66.4	16%	0.162	37%	0.365	C	S	.	.			trans	-121.5	155.9	170.6	59.6	-100.4	0	0	0	112.4	A721 H724 V760 F766 P767 F770	A721-F726 CarbonylContact C-O 3.52Å; A721-F726 HydrophobicContact CB-CD2 3.91Å; A721-F726 HydrophobicContact CB-CE2 3.69Å; A721-F726 HydrophobicContact CB-CZ 4.42Å; A721-F726 WeakPolarHBondContact CB-O 3.47Å; A721-F726 PolarHBondContact O-N 2.91Å; H724-F726 HydrophobicContact CB-CD1 3.61Å; H724-F726 HydrophobicContact CB-CE1 3.3Å; H724-F726 HydrophobicContact CB-CZ 4.21Å; F726-V760 HydrophobicContact CD2-CG1 4.23Å; F726-V760 HydrophobicContact CD2-CG2 4.1Å; F726-V760 HydrophobicContact CE2-CG2 4.09Å; F726-F766 HydrophobicContact CD1-CD2 4.47Å; F726-F766 AromaticContact CE1-CD2 3.91Å; F726-F766 HydrophobicContact CE1-CD2 3.91Å; F726-F766 HydrophobicContact CE1-CE2 4.04Å; F726-F766 HydrophobicContact CE2-CD2 4.24Å; F726-F766 AromaticContact CE2-CE2 3.71Å; F726-F766 HydrophobicContact CE2-CE2 3.71Å; F726-F766 AromaticContact CZ-CD2 3.77Å; F726-F766 HydrophobicContact CZ-CD2 3.77Å; F726-F766 AromaticContact CZ-CE2 3.4Å; F726-F766 HydrophobicContact CZ-CE2 3.4Å; F726-F766 VanDerWaalsContact CZ-CE2 3.4Å; F726-F766 HydrophobicContact CZ-CZ 4.29Å; F726-P767 HydrophobicContact CE1-CG 4.2Å; F726-F770 HydrophobicContact CE1-CD2 4.36Å; F726-F770 HydrophobicContact CE1-CE2 4.42Å; F726-F770 HydrophobicContact CE2-CD2 4.24Å; F726-F770 HydrophobicContact CE2-CE1 4.2Å; F726-F770 AromaticContact CE2-CE2 3.76Å; F726-F770 HydrophobicContact CE2-CE2 3.76Å; F726-F770 AromaticContact CE2-CZ 3.74Å; F726-F770 HydrophobicContact CE2-CZ 3.74Å; F726-F770 HydrophobicContact CZ-CD1 4.38Å; F726-F770 AromaticContact CZ-CD2 3.45Å; F726-F770 HydrophobicContact CZ-CD2 3.45Å; F726-F770 VanDerWaalsContact CZ-CD2 3.45Å; F726-F770 HydrophobicContact CZ-CE1 4.3Å; F726-F770 AromaticContact CZ-CE2 3.35Å; F726-F770 HydrophobicContact CZ-CE2 3.35Å; F726-F770 AromaticContact CZ-CG 3.97Å; F726-F770 HydrophobicContact CZ-CG 3.97Å; F726-F770 AromaticContact CZ-CZ 3.81Å; F726-F770 HydrophobicContact CZ-CZ 3.81Å
727	E	80.4	Confident	85.9	Confident	166 Å²	166	67.2 Å²	67.2	78%	0.776	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-98.7	133.7	-177.1	-171	176.1	-173.1	0	0	110.6
728	L	87.5	Confident	85.1	Confident	13 Å²	13	69 Å²	69	7%	0.068	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-90.7	123.1	169.9	-76.6	161.4	0	0	0	108.6	F717 L718 A721 F748 L758 V760 F770	F717-L728 HydrophobicContact CB-CD1 4.02Å; F717-L728 VanDerWaalsContact O-CD1 3.29Å; F717-L728 WeakPolarHBondContact O-CD1 3.05Å; L718-L728 HydrophobicContact CD2-CB 3.99Å; L718-L728 HydrophobicContact CD2-CD1 4.04Å; A721-L728 HydrophobicContact CB-CD1 3.51Å; A721-L728 HydrophobicContact CB-CG 3.78Å; L728-F748 HydrophobicContact CD2-CD1 4.4Å; L728-L758 HydrophobicContact CD1-CD1 4.35Å; L728-L758 HydrophobicContact CD2-CB 4.13Å; L728-V760 HydrophobicContact CD2-CG2 3.3Å; L728-V760 HydrophobicContact CG-CG2 4.11Å; L728-F770 HydrophobicContact CD1-CZ 4.26Å; L728-F770 HydrophobicContact CD2-CE1 4.42Å
729	M	87.4	Confident	84.5	Confident	78 Å²	78	72.9 Å²	72.9	38%	0.384	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	137.8	174	-59.8	-177.9	-68.5	0	0	109.8	L758 L759 L761	M729-L758 CarbonylContact O-C 3.53Å; M729-L758 WeakPolarHBondContact O-CA 3.49Å; M729-L759 WeakPolarHBondContact CB-O 3.12Å; M729-L759 HydrophobicContact CE-CD2 4.19Å; M729-L759 HydrophobicContact CE-CG 4.28Å; M729-L759 PolarHBondContact N-O 3.1Å; M729-L759 PolarHBondContact O-N 3.32Å; M729-L761 HydrophobicContact CE-CB 4.06Å; M729-L761 HydrophobicContact CE-CD1 3.53Å; M729-L761 HydrophobicContact CE-CG 3.55Å
730	E	87.5	Confident	84	Confident	105 Å²	105	71.2 Å²	71.2	49%	0.491	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	128.4	172.4	-59	-168.6	156.5	0	0	109.7	R714 K757 L758	R714-E730 IonicContact CZ-OE1 2.81Å; R714-E730 IonicContact NE-OE1 3.8Å; R714-E730 PolarHBondContact NE-OE1 2.94Å; R714-E730 IonicContact NH2-OE1 2.7Å; R714-E730 PolarHBondContact NH2-OE1 3.37Å; R714-E730 IonicContact NH2-OE2 3.75Å; E730-K757 WeakPolarHBondContact CA-O 3.43Å; E730-L758 HydrophobicContact CG-CD2 3.96Å
731	V	85.6	Confident	83.5	Confident	26 Å²	26	71.2 Å²	71.2	16%	0.158	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	140.8	176.6	-178.7	0	0	0	0	107.8	V735 V740 K757 L759	V731-V735 HydrophobicContact CG1-CB 3.72Å; V731-V735 HydrophobicContact CG1-CG1 3.86Å; V731-V740 HydrophobicContact CG1-CG2 4.34Å; V731-K757 HydrophobicContact CB-CB 3.92Å; V731-K757 PolarHBondContact N-O 3.29Å; V731-L759 HydrophobicContact CG2-CB 3.73Å; V731-L759 HydrophobicContact CG2-CD2 3.89Å; V731-L759 HydrophobicContact CG2-CG 4.47Å
732	A	81.9	Confident	82.8	Confident	55 Å²	55	74.9 Å²	74.9	46%	0.455	41%	0.414	S	S	.	.			trans	-63.8	150.2	176.9	0	0	0	0	0	110.8	D734 V735	A732-D734 WeakPolarHBondContact CB-OD1 3.29Å; A732-D734 PolarHBondContact O-N 3.35Å; A732-V735 HydrophobicContact CB-CG2 4.1Å; A732-V735 PolarHBondContact O-N 3.16Å
733	E	79.5	Confident	82.3	Confident	137 Å²	137	75.8 Å²	75.8	64%	0.64	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-31.8	-172.4	-173.6	172.4	-169.9	0	0	112.7	K757	E733-K757 WeakPolarHBondContact O-CE 3.44Å; E733-K757 PolarHBondContact O-NZ 2.96Å
734	D	80.2	Confident	81.6	Confident	137 Å²	137	72.4 Å²	72.4	73%	0.733	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.2	-179.3	60.2	-36.1	0	0	0	114.3	A732	A732-D734 WeakPolarHBondContact CB-OD1 3.29Å; A732-D734 PolarHBondContact O-N 3.35Å
735	V	80.7	Confident	81.2	Confident	34 Å²	34	71 Å²	71	21%	0.206	41%	0.405	C	S	.	.			trans	-85.9	125.9	-175.9	178.1	0	0	0	0	110.5	V731 A732 E739 V740 K757	V731-V735 HydrophobicContact CG1-CB 3.72Å; V731-V735 HydrophobicContact CG1-CG1 3.86Å; A732-V735 HydrophobicContact CB-CG2 4.1Å; A732-V735 PolarHBondContact O-N 3.16Å; V735-E739 HydrophobicContact CG1-CB 4.37Å; V735-V740 HydrophobicContact CG1-CG2 3.37Å; V735-K757 PolarHBondContact O-NZ 2.9Å
736	E	78.4	Confident	81.4	Confident	112 Å²	112	70.7 Å²	70.7	52%	0.523	39%	0.39	S	S	.	.			trans	-77.6	148.2	172.5	-71.4	-170.5	-176.5	0	0	111.9	S738 E739	E736-S738 PolarHBondContact O-N 2.88Å; E736-S738 PolarHBondContact OE2-OG 2.75Å; E736-E739 HydrophobicContact CB-CG 4.24Å; E736-E739 WeakPolarHBondContact O-CB 3.32Å; E736-E739 PolarHBondContact O-N 3.31Å
737	I	81.6	Confident	81.8	Confident	19 Å²	19	68.9 Å²	68.9	10%	0.097	38%	0.382	C	S	.	.	H	α-helix	trans	-62.9	-30.2	179.1	-162.8	172.6	0	0	0	112.8	I657 E739 V740 V741 Y747 F749	I657-I737 HydrophobicContact CG2-CD1 4.19Å; I657-I737 HydrophobicContact CG2-CG2 3.51Å; I737-E739 PolarHBondContact O-N 3.45Å; I737-V740 PolarHBondContact O-N 3.05Å; I737-V741 HydrophobicContact CG1-CB 4.45Å; I737-V741 HydrophobicContact CG1-CG2 3.93Å; I737-V741 PolarHBondContact O-N 2.94Å; I737-Y747 HydrophobicContact CD1-CD2 3.91Å; I737-Y747 HydrophobicContact CD1-CE2 3.3Å; I737-Y747 HydrophobicContact CG1-CE2 4.43Å; I737-F749 HydrophobicContact CD1-CB 3.62Å; I737-F749 HydrophobicContact CD1-CD1 3.65Å; I737-F749 HydrophobicContact CD1-CD2 3.91Å; I737-F749 HydrophobicContact CD1-CE1 4.2Å; I737-F749 HydrophobicContact CD1-CE2 4.45Å; I737-F749 HydrophobicContact CD1-CG 3.46Å; I737-F749 VanDerWaalsContact CD1-CG 3.46Å; I737-F749 HydrophobicContact CG1-CD2 4.38Å; I737-F749 HydrophobicContact CG1-CG 4.39Å
738	S	77.5	Confident	82.4	Confident	39 Å²	39	61.1 Å²	61.1	27%	0.273	35%	0.346	S	S	.	.	H	α-helix	trans	-62.6	-25.4	175.5	6.4	0	0	0	0	113.5	K665 E736	K665-S738 PolarHBondContact NZ-OG 3.22Å; E736-S738 PolarHBondContact O-N 2.88Å; E736-S738 PolarHBondContact OE2-OG 2.75Å
739	E	80.1	Confident	82.7	Confident	141 Å²	141	61.1 Å²	61.1	66%	0.659	35%	0.346	S	S	*	.	H	α-helix	trans	-80.7	-28.2	179.6	-60.6	-175.8	166.9	0	0	111.9	V735 E736 I737	V735-E739 HydrophobicContact CG1-CB 4.37Å; E736-E739 HydrophobicContact CB-CG 4.24Å; E736-E739 WeakPolarHBondContact O-CB 3.32Å; E736-E739 PolarHBondContact O-N 3.31Å; I737-E739 PolarHBondContact O-N 3.45Å
740	V	80.7	Confident	83	Confident	58 Å²	58	57.4 Å²	57.4	35%	0.352	33%	0.327	S	S	.	.	H	α-helix	trans	-96	-32.7	-177	-167.2	0	0	0	0	111.9	V731 V735 I737 L759	V731-V740 HydrophobicContact CG1-CG2 4.34Å; V735-V740 HydrophobicContact CG1-CG2 3.37Å; I737-V740 PolarHBondContact O-N 3.05Å; V740-L759 HydrophobicContact CB-CD2 4.24Å; V740-L759 HydrophobicContact CG1-CD2 3.44Å; V740-L759 VanDerWaalsContact CG1-CD2 3.44Å
741	V	82.1	Confident	83.3	Confident	3 Å²	3	53.7 Å²	53.7	2%	0.018	31%	0.31	C	S	.	.	S	Bend	trans	-122.6	120.6	-172.4	-165	0	0	0	0	111.7	I737 C745 Y747 L759 L761	I737-V741 HydrophobicContact CG1-CB 4.45Å; I737-V741 HydrophobicContact CG1-CG2 3.93Å; I737-V741 PolarHBondContact O-N 2.94Å; V741-C745 HydrophobicContact CG1-CB 4.03Å; V741-Y747 HydrophobicContact CB-CD1 4.38Å; V741-Y747 HydrophobicContact CG1-CD1 3.49Å; V741-Y747 VanDerWaalsContact CG1-CD1 3.49Å; V741-Y747 HydrophobicContact CG1-CE1 3.98Å; V741-Y747 HydrophobicContact CG1-CG 4.06Å; V741-Y747 HydrophobicContact CG2-CG 4.43Å; V741-L759 HydrophobicContact CG2-CD1 4.04Å; V741-L759 HydrophobicContact CG2-CD2 4.35Å; V741-L761 HydrophobicContact CG1-CD2 4.35Å; V741-L761 HydrophobicContact CG2-CD2 3.76Å
742	N	76.9	Confident	83.7	Confident	78 Å²	78	53 Å²	53	42%	0.417	31%	0.305	S	S	.	.			trans	-71.9	147.9	174.3	-61.4	-49.3	0	0	0	111.1	G744 C745	N742-G744 PolarHBondContact O-N 3.45Å; N742-C745 WeakPolarHBondContact O-CB 3.35Å; N742-C745 PolarHBondContact O-N 2.8Å
743	P	78.8	Confident	84	Confident	89 Å²	89	52.6 Å²	52.6	58%	0.578	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	134.5	171.5	-23.7	30.4	0	0	0	111.9	A659 C745	A659-P743 HydrophobicContact CB-CB 4.21Å; P743-C745 VanDerWaalsContact C-N 3.35Å; P743-C745 PolarHBondContact O-N 3.16Å
744	G	73.6	Confident	84.2	Confident	45 Å²	45	52.5 Å²	52.5	46%	0.464	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	-10.1	179	0	0	0	0	0	116.2	N742	N742-G744 PolarHBondContact O-N 3.45Å
745	C	79.1	Confident	84.4	Confident	49 Å²	49	46.9 Å²	46.9	33%	0.331	27%	0.267	S	S	.	.			trans	-74.9	134.5	172	-70.2	0	0	0	0	110.6	N692 V741 N742 P743 Y747	N692-C745 PolarHBondContact ND2-O 3.05Å; N692-C745 VanDerWaalsContact ND2-O 3.13Å; V741-C745 HydrophobicContact CG1-CB 4.03Å; N742-C745 WeakPolarHBondContact O-CB 3.35Å; N742-C745 PolarHBondContact O-N 2.8Å; P743-C745 VanDerWaalsContact C-N 3.35Å; P743-C745 PolarHBondContact O-N 3.16Å; C745-Y747 VanDerWaalsContact O-CD1 3.29Å; C745-Y747 WeakPolarHBondContact O-CD1 3.45Å
746	P	86.9	Confident	84.7	Confident	63 Å²	63	48.3 Å²	48.3	41%	0.409	27%	0.271	S	S	.	.			trans	-70.2	136.8	173.6	-18.8	31	0	0	0	112.5	N692 Y693 M763	N692-P746 CarbonylContact O-C 3.52Å; N692-P746 WeakPolarHBondContact O-CA 3.32Å; N692-P746 WeakPolarHBondContact O-CB 3.23Å; Y693-P746 HydrophobicContact CD2-CB 3.98Å; P746-M763 HydrophobicContact CB-CB 4.24Å; P746-M763 HydrophobicContact CB-CG 4.23Å
747	Y	91.8	Very high	85.4	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	162.8	177.4	65.4	-88.2	0	0	0	112.3	S656 E690 N692 I737 V741 C745 F749 L759 V760	S656-Y747 WeakPolarHBondContact CB-OH 3.33Å; E690-Y747 HydrophobicContact CG-CE2 4.43Å; E690-Y747 PolarHBondContact OE1-OH 3.41Å; E690-Y747 VanDerWaalsContact OE1-OH 3.08Å; E690-Y747 VanDerWaalsContact OE2-CE2 3.31Å; E690-Y747 WeakPolarHBondContact OE2-CE2 3.5Å; E690-Y747 PolarHBondContact OE2-OH 3.34Å; N692-Y747 CarbonylContact C-O 3.51Å; N692-Y747 HydrophobicContact CB-CD1 3.69Å; N692-Y747 HydrophobicContact CB-CD2 4.49Å; N692-Y747 HydrophobicContact CB-CE1 3.5Å; N692-Y747 VanDerWaalsContact CB-CE1 3.5Å; N692-Y747 HydrophobicContact CB-CE2 4.28Å; N692-Y747 HydrophobicContact CB-CG 4.23Å; N692-Y747 PolarHBondContact N-O 3.42Å; N692-Y747 WeakPolarHBondContact ND2-CE1 3.37Å; N692-Y747 PolarHBondContact O-N 2.9Å; I737-Y747 HydrophobicContact CD1-CD2 3.91Å; I737-Y747 HydrophobicContact CD1-CE2 3.3Å; I737-Y747 HydrophobicContact CG1-CE2 4.43Å; V741-Y747 HydrophobicContact CB-CD1 4.38Å; V741-Y747 HydrophobicContact CG1-CD1 3.49Å; V741-Y747 VanDerWaalsContact CG1-CD1 3.49Å; V741-Y747 HydrophobicContact CG1-CE1 3.98Å; V741-Y747 HydrophobicContact CG1-CG 4.06Å; V741-Y747 HydrophobicContact CG2-CG 4.43Å; C745-Y747 VanDerWaalsContact O-CD1 3.29Å; C745-Y747 WeakPolarHBondContact O-CD1 3.45Å; Y747-F749 HydrophobicContact CD2-CB 3.87Å; Y747-F749 HydrophobicContact CE2-CB 3.96Å; Y747-L759 HydrophobicContact CD2-CD1 4.45Å; Y747-V760 VanDerWaalsContact CA-O 3.27Å; Y747-V760 WeakPolarHBondContact CA-O 3.26Å
748	F	92.9	Very high	85.9	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.009	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	132.6	162.1	172.2	-95.9	0	0	0	108.8	F689 R691 F717 L728 A750 L759 V760 M763 F766 F770 A771	F689-F748 HydrophobicContact CB-CE2 4.13Å; F689-F748 HydrophobicContact CB-CZ 4.1Å; F689-F748 HydrophobicContact CD2-CE2 4.08Å; F689-F748 HydrophobicContact CG-CE2 4.4Å; R691-F748 HydrophobicContact CB-CD2 4.17Å; R691-F748 HydrophobicContact CG-CD2 4.44Å; F717-F748 HydrophobicContact CD1-CE1 4.48Å; F717-F748 HydrophobicContact CE1-CE1 4.18Å; F717-F748 AromaticContact CE1-CZ 3.88Å; F717-F748 HydrophobicContact CE1-CZ 3.88Å; L728-F748 HydrophobicContact CD2-CD1 4.4Å; F748-A750 HydrophobicContact CE1-CB 3.92Å; F748-A750 HydrophobicContact CZ-CB 3.94Å; F748-L759 CarbonylContact O-C 3.54Å; F748-L759 WeakPolarHBondContact O-CA 3.16Å; F748-V760 HydrophobicContact CB-CB 4.19Å; F748-V760 HydrophobicContact CB-CG2 4.48Å; F748-V760 HydrophobicContact CD1-CG2 4.2Å; F748-V760 PolarHBondContact N-O 3.35Å; F748-V760 PolarHBondContact O-N 2.93Å; F748-M763 HydrophobicContact CB-CE 3.67Å; F748-M763 HydrophobicContact CB-SD 3.85Å; F748-F766 HydrophobicContact CB-CE1 4.33Å; F748-F766 HydrophobicContact CB-CE2 4.05Å; F748-F766 HydrophobicContact CB-CZ 3.66Å; F748-F766 HydrophobicContact CD1-CZ 4.28Å; F748-F766 HydrophobicContact CD2-CE1 4.32Å; F748-F766 AromaticContact CD2-CZ 3.89Å; F748-F766 HydrophobicContact CD2-CZ 3.89Å; F748-F766 HydrophobicContact CG-CE1 4.44Å; F748-F766 HydrophobicContact CG-CE2 4.33Å; F748-F766 AromaticContact CG-CZ 3.66Å; F748-F766 HydrophobicContact CG-CZ 3.66Å; F748-F770 HydrophobicContact CD1-CD1 4.07Å; F748-F770 HydrophobicContact CD1-CE1 4.03Å; F748-F770 HydrophobicContact CD2-CD1 4.41Å; F748-F770 AromaticContact CE1-CD1 3.78Å; F748-F770 HydrophobicContact CE1-CD1 3.78Å; F748-F770 AromaticContact CE1-CE1 3.62Å; F748-F770 HydrophobicContact CE1-CE1 3.62Å; F748-F770 HydrophobicContact CE2-CD1 4.15Å; F748-F770 HydrophobicContact CG-CD1 4.38Å; F748-F770 AromaticContact CZ-CD1 3.82Å; F748-F770 HydrophobicContact CZ-CD1 3.82Å; F748-F770 HydrophobicContact CZ-CE1 4.04Å; F748-A771 HydrophobicContact CE2-CB 3.74Å; F748-A771 HydrophobicContact CZ-CB 3.85Å
749	F	93.5	Very high	86.5	Confident	14 Å²	14	42 Å²	42	6%	0.061	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	135	-178.6	179.3	-108.9	0	0	0	110.1	F689 E690 I737 Y747 E751 K757 L758 L759	F689-F749 CarbonylContact C-O 3.51Å; F689-F749 WeakPolarHBondContact CA-O 3.31Å; F689-F749 WeakPolarHBondContact CB-O 3.1Å; E690-F749 PolarHBondContact N-O 3.22Å; E690-F749 PolarHBondContact O-N 3.47Å; I737-F749 HydrophobicContact CD1-CB 3.62Å; I737-F749 HydrophobicContact CD1-CD1 3.65Å; I737-F749 HydrophobicContact CD1-CD2 3.91Å; I737-F749 HydrophobicContact CD1-CE1 4.2Å; I737-F749 HydrophobicContact CD1-CE2 4.45Å; I737-F749 HydrophobicContact CD1-CG 3.46Å; I737-F749 VanDerWaalsContact CD1-CG 3.46Å; I737-F749 HydrophobicContact CG1-CD2 4.38Å; I737-F749 HydrophobicContact CG1-CG 4.39Å; Y747-F749 HydrophobicContact CD2-CB 3.87Å; Y747-F749 HydrophobicContact CE2-CB 3.96Å; F749-E751 HydrophobicContact CD1-CG 4.37Å; F749-E751 HydrophobicContact CE1-CG 3.5Å; F749-E751 VanDerWaalsContact CE1-CG 3.5Å; F749-E751 VanDerWaalsContact CE1-OE1 3.28Å; F749-E751 WeakPolarHBondContact CE1-OE1 3.49Å; F749-E751 HydrophobicContact CZ-CG 3.79Å; F749-K757 HydrophobicContact CE2-CB 3.86Å; F749-K757 HydrophobicContact CE2-CD 4.26Å; F749-K757 HydrophobicContact CE2-CG 4.14Å; F749-K757 HydrophobicContact CZ-CB 4.15Å; F749-K757 HydrophobicContact CZ-CD 3.92Å; F749-K757 HydrophobicContact CZ-CG 3.9Å; F749-L758 CarbonylContact C-O 3.59Å; F749-L758 WeakPolarHBondContact CA-O 3.13Å; F749-L759 HydrophobicContact CB-CD1 4.27Å; F749-L759 HydrophobicContact CD2-CB 4.45Å; F749-L759 HydrophobicContact CD2-CD1 4.08Å
750	A	94.3	Very high	87	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	133.8	176.4	0	0	0	0	0	111.2	F688 F689 F717 F748 K757 L758	F688-A750 CarbonylContact O-C 3.56Å; F688-A750 VanDerWaalsContact O-CA 3.27Å; F688-A750 WeakPolarHBondContact O-CA 3.28Å; F689-A750 HydrophobicContact CB-CB 3.9Å; F717-A750 HydrophobicContact CE1-CB 4.45Å; F748-A750 HydrophobicContact CE1-CB 3.92Å; F748-A750 HydrophobicContact CZ-CB 3.94Å; A750-K757 CarbonylContact O-C 3.45Å; A750-K757 WeakPolarHBondContact O-CA 3.11Å; A750-L758 HydrophobicContact CB-CB 4.47Å; A750-L758 PolarHBondContact N-O 3.04Å; A750-L758 PolarHBondContact O-N 3.07Å
751	E	94.1	Very high	87.2	Confident	27 Å²	27	36 Å²	36	13%	0.126	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	123.3	173.2	-58.9	174.8	-170	0	0	108.9	K672 F688 F749 K757	K672-E751 VanDerWaalsContact NZ-CD 3.33Å; K672-E751 IonicContact NZ-OE1 3.24Å; K672-E751 PolarHBondContact NZ-OE1 3.15Å; K672-E751 IonicContact NZ-OE2 3.76Å; K672-E751 PolarHBondContact NZ-OE2 3.19Å; F688-E751 HydrophobicContact CB-CB 4.25Å; F688-E751 PolarHBondContact N-O 3.44Å; F688-E751 VanDerWaalsContact N-O 3.12Å; F688-E751 PolarHBondContact O-N 3.4Å; F749-E751 HydrophobicContact CD1-CG 4.37Å; F749-E751 HydrophobicContact CE1-CG 3.5Å; F749-E751 VanDerWaalsContact CE1-CG 3.5Å; F749-E751 VanDerWaalsContact CE1-OE1 3.28Å; F749-E751 WeakPolarHBondContact CE1-OE1 3.49Å; F749-E751 HydrophobicContact CZ-CG 3.79Å; E751-K757 HydrophobicContact CG-CG 4.32Å
752	L	92.9	Very high	87	Confident	10 Å²	10	46.3 Å²	46.3	5%	0.052	25%	0.245	C	C	.	.			trans	-94.7	157.9	179.4	-56.1	-169.3	0	0	0	111.2	V687 I713 R714 F717 Y754 G755 Q756 L758	V687-L752 HydrophobicContact CG1-CD2 4.2Å; I713-L752 HydrophobicContact CG2-CD2 3.65Å; R714-L752 HydrophobicContact CB-CD1 3.67Å; R714-L752 HydrophobicContact CG-CD1 4.17Å; F717-L752 HydrophobicContact CD2-CD2 4.26Å; F717-L752 HydrophobicContact CE2-CD2 4.22Å; L752-Y754 PolarHBondContact O-N 3.43Å; L752-Y754 VanDerWaalsContact O-N 3.1Å; L752-G755 PolarHBondContact O-N 2.91Å; L752-G755 VanDerWaalsContact O-N 3.14Å; L752-Q756 HydrophobicContact CB-CB 4.27Å; L752-Q756 WeakPolarHBondContact CB-O 3.45Å; L752-Q756 HydrophobicContact CD1-CB 4.22Å; L752-Q756 HydrophobicContact CG-CB 4.43Å; L752-Q756 PolarHBondContact N-O 3.03Å; L752-L758 HydrophobicContact CD1-CD1 3.98Å; L752-L758 HydrophobicContact CD1-CG 4.32Å; L752-L758 HydrophobicContact CD2-CD1 4.48Å; L752-L758 HydrophobicContact CG-CD1 4.38Å
753	P	88.5	Confident	87.1	Confident	47 Å²	47	43 Å²	43	31%	0.305	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-27.7	-175.9	-27.3	33.7	0	0	0	115.8	C685 V687 I713 G755	C685-P753 HydrophobicContact CB-CB 3.9Å; C685-P753 HydrophobicContact CB-CG 3.75Å; V687-P753 HydrophobicContact CG2-CG 4.42Å; I713-P753 HydrophobicContact CD1-CG 3.93Å; P753-G755 VanDerWaalsContact C-N 3.34Å
754	Y	84.6	Confident	86.7	Confident	136 Å²	136	45.1 Å²	45.1	53%	0.533	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	29.1	-179	-56	-68.1	0	0	0	112.9	A710 L752 Q756	A710-Y754 HydrophobicContact CB-CE2 3.72Å; L752-Y754 PolarHBondContact O-N 3.43Å; L752-Y754 VanDerWaalsContact O-N 3.1Å; Y754-Q756 VanDerWaalsContact C-N 3.26Å; Y754-Q756 PolarHBondContact O-N 3.5Å
755	G	83.6	Confident	86.7	Confident	19 Å²	19	51.5 Å²	51.5	20%	0.196	24%	0.242	C	C	.	.	S	Bend	trans	79.5	-5.5	175.7	0	0	0	0	0	115.4	L752 P753 K757	L752-G755 PolarHBondContact O-N 2.91Å; L752-G755 VanDerWaalsContact O-N 3.14Å; P753-G755 VanDerWaalsContact C-N 3.34Å; G755-K757 PolarHBondContact O-N 3.3Å
756	Q	86.9	Confident	87	Confident	63 Å²	63	49.6 Å²	49.6	29%	0.294	23%	0.228	S	C	.	.			trans	-71.2	131.7	178.5	-53	97.4	-1.9	0	0	111.2	L752 Y754	L752-Q756 HydrophobicContact CB-CB 4.27Å; L752-Q756 WeakPolarHBondContact CB-O 3.45Å; L752-Q756 HydrophobicContact CD1-CB 4.22Å; L752-Q756 HydrophobicContact CG-CB 4.43Å; L752-Q756 PolarHBondContact N-O 3.03Å; Y754-Q756 VanDerWaalsContact C-N 3.26Å; Y754-Q756 PolarHBondContact O-N 3.5Å
757	K	92.2	Very high	87	Confident	34 Å²	34	48 Å²	48	15%	0.148	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	124.1	175.2	-70.1	172.4	172.2	173.6	0	109.7	E730 V731 E733 V735 F749 A750 E751 G755	E730-K757 WeakPolarHBondContact CA-O 3.43Å; V731-K757 HydrophobicContact CB-CB 3.92Å; V731-K757 PolarHBondContact N-O 3.29Å; E733-K757 WeakPolarHBondContact O-CE 3.44Å; E733-K757 PolarHBondContact O-NZ 2.96Å; V735-K757 PolarHBondContact O-NZ 2.9Å; F749-K757 HydrophobicContact CE2-CB 3.86Å; F749-K757 HydrophobicContact CE2-CD 4.26Å; F749-K757 HydrophobicContact CE2-CG 4.14Å; F749-K757 HydrophobicContact CZ-CB 4.15Å; F749-K757 HydrophobicContact CZ-CD 3.92Å; F749-K757 HydrophobicContact CZ-CG 3.9Å; A750-K757 CarbonylContact O-C 3.45Å; A750-K757 WeakPolarHBondContact O-CA 3.11Å; E751-K757 HydrophobicContact CG-CG 4.32Å; G755-K757 PolarHBondContact O-N 3.3Å
758	L	92.4	Very high	86.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	130	177.8	-58.6	179.5	0	0	0	110	F717 L728 M729 E730 F749 A750 L752	F717-L758 HydrophobicContact CB-CD1 3.76Å; F717-L758 HydrophobicContact CG-CD1 4.08Å; L728-L758 HydrophobicContact CD1-CD1 4.35Å; L728-L758 HydrophobicContact CD2-CB 4.13Å; M729-L758 CarbonylContact O-C 3.53Å; M729-L758 WeakPolarHBondContact O-CA 3.49Å; E730-L758 HydrophobicContact CG-CD2 3.96Å; F749-L758 CarbonylContact C-O 3.59Å; F749-L758 WeakPolarHBondContact CA-O 3.13Å; A750-L758 HydrophobicContact CB-CB 4.47Å; A750-L758 PolarHBondContact N-O 3.04Å; A750-L758 PolarHBondContact O-N 3.07Å; L752-L758 HydrophobicContact CD1-CD1 3.98Å; L752-L758 HydrophobicContact CD1-CG 4.32Å; L752-L758 HydrophobicContact CD2-CD1 4.48Å; L752-L758 HydrophobicContact CG-CD1 4.38Å
759	L	91.3	Very high	86.6	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.016	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	134.8	-175.4	-178.8	69.5	0	0	0	111.8	M729 V731 V740 V741 Y747 F748 F749 L761	M729-L759 WeakPolarHBondContact CB-O 3.12Å; M729-L759 HydrophobicContact CE-CD2 4.19Å; M729-L759 HydrophobicContact CE-CG 4.28Å; M729-L759 PolarHBondContact N-O 3.1Å; M729-L759 PolarHBondContact O-N 3.32Å; V731-L759 HydrophobicContact CG2-CB 3.73Å; V731-L759 HydrophobicContact CG2-CD2 3.89Å; V731-L759 HydrophobicContact CG2-CG 4.47Å; V740-L759 HydrophobicContact CB-CD2 4.24Å; V740-L759 HydrophobicContact CG1-CD2 3.44Å; V740-L759 VanDerWaalsContact CG1-CD2 3.44Å; V741-L759 HydrophobicContact CG2-CD1 4.04Å; V741-L759 HydrophobicContact CG2-CD2 4.35Å; Y747-L759 HydrophobicContact CD2-CD1 4.45Å; F748-L759 CarbonylContact O-C 3.54Å; F748-L759 WeakPolarHBondContact O-CA 3.16Å; F749-L759 HydrophobicContact CB-CD1 4.27Å; F749-L759 HydrophobicContact CD2-CB 4.45Å; F749-L759 HydrophobicContact CD2-CD1 4.08Å; L759-L761 HydrophobicContact CD1-CD2 4.17Å; L759-L761 HydrophobicContact CD2-CD1 4.32Å; L759-L761 HydrophobicContact CD2-CD2 4.04Å; L759-L761 HydrophobicContact CD2-CG 4.05Å; L759-L761 HydrophobicContact CG-CD2 4.17Å; L759-L761 HydrophobicContact CG-CG 4.18Å
760	V	89.8	Confident	86.6	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	120.2	167.9	-172.9	0	0	0	0	108.8	F726 L728 Y747 F748 M763	F726-V760 HydrophobicContact CD2-CG1 4.23Å; F726-V760 HydrophobicContact CD2-CG2 4.1Å; F726-V760 HydrophobicContact CE2-CG2 4.09Å; L728-V760 HydrophobicContact CD2-CG2 3.3Å; L728-V760 HydrophobicContact CG-CG2 4.11Å; Y747-V760 VanDerWaalsContact CA-O 3.27Å; Y747-V760 WeakPolarHBondContact CA-O 3.26Å; F748-V760 HydrophobicContact CB-CB 4.19Å; F748-V760 HydrophobicContact CB-CG2 4.48Å; F748-V760 HydrophobicContact CD1-CG2 4.2Å; F748-V760 PolarHBondContact N-O 3.35Å; F748-V760 PolarHBondContact O-N 2.93Å; V760-M763 HydrophobicContact CB-SD 3.97Å; V760-M763 HydrophobicContact CG1-SD 3.78Å
761	L	84	Confident	86.5	Confident	71 Å²	71	53 Å²	53	37%	0.372	25%	0.246	S	C	.	.			trans	-98.9	-23.6	175.2	-64	175.2	0	0	0	112.8	M729 V741 L759 M763	M729-L761 HydrophobicContact CE-CB 4.06Å; M729-L761 HydrophobicContact CE-CD1 3.53Å; M729-L761 HydrophobicContact CE-CG 3.55Å; V741-L761 HydrophobicContact CG1-CD2 4.35Å; V741-L761 HydrophobicContact CG2-CD2 3.76Å; L759-L761 HydrophobicContact CD1-CD2 4.17Å; L759-L761 HydrophobicContact CD2-CD1 4.32Å; L759-L761 HydrophobicContact CD2-CD2 4.04Å; L759-L761 HydrophobicContact CD2-CG 4.05Å; L759-L761 HydrophobicContact CG-CD2 4.17Å; L759-L761 HydrophobicContact CG-CG 4.18Å; L761-M763 PolarHBondContact O-N 3.41Å
762	R	78.3	Confident	86.5	Confident	220 Å²	220	52.7 Å²	52.7	83%	0.83	24%	0.243	S	C	*	.			trans	-94.5	82.8	-179.6	-67.2	-170.4	-165.6	170.7	7	110.6	R764	R762-R764 VanDerWaalsContact C-N 3.28Å; R762-R764 PolarHBondContact O-N 3.04Å
763	M	79.3	Confident	86.5	Confident	9 Å²	9	55.2 Å²	55.2	4%	0.044	26%	0.255	C	S	.	.			trans	-87.5	26.2	-175.2	-58.7	-66	-79.3	0	0	114.4	R691 Y693 P746 F748 V760 L761 Q765 F766	R691-M763 HydrophobicContact CG-CE 4.4Å; Y693-M763 HydrophobicContact CD2-CB 3.7Å; Y693-M763 HydrophobicContact CE2-CB 4.08Å; Y693-M763 VanDerWaalsContact CE2-O 3.25Å; Y693-M763 WeakPolarHBondContact CE2-O 3.26Å; Y693-M763 HydrophobicContact CG-CB 4.22Å; Y693-M763 HydrophobicContact CG-CE 4.18Å; P746-M763 HydrophobicContact CB-CB 4.24Å; P746-M763 HydrophobicContact CB-CG 4.23Å; F748-M763 HydrophobicContact CB-CE 3.67Å; F748-M763 HydrophobicContact CB-SD 3.85Å; V760-M763 HydrophobicContact CB-SD 3.97Å; V760-M763 HydrophobicContact CG1-SD 3.78Å; L761-M763 PolarHBondContact O-N 3.41Å; M763-Q765 PolarHBondContact O-N 3.1Å; M763-F766 HydrophobicContact CB-CB 4.11Å; M763-F766 HydrophobicContact CE-CB 3.79Å; M763-F766 HydrophobicContact CE-CD1 3.26Å; M763-F766 HydrophobicContact CE-CD2 3.56Å; M763-F766 HydrophobicContact CE-CE1 3.55Å; M763-F766 HydrophobicContact CE-CE2 3.82Å; M763-F766 HydrophobicContact CE-CG 3.24Å; M763-F766 HydrophobicContact CE-CZ 3.8Å; M763-F766 PolarHBondContact O-N 3.23Å; M763-F766 HydrophobicContact SD-CB 4.13Å; M763-F766 HydrophobicContact SD-CD1 4.31Å; M763-F766 HydrophobicContact SD-CD2 3.45Å; M763-F766 WeakPolarHBondContact SD-CD2 3.48Å; M763-F766 HydrophobicContact SD-CE2 3.79Å; M763-F766 HydrophobicContact SD-CG 3.71Å; M763-F766 HydrophobicContact SD-CZ 4.33Å
764	R	70.2	Confident	86.7	Confident	133 Å²	133	53 Å²	53	50%	0.502	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	121.4	177.9	-80.5	-172	170.9	178.9	-3.9	109.5	N368 R762 F766	N368-R764 PolarHBondContact OD1-NH1 3.41Å; N368-R764 VanDerWaalsContact OD1-NH1 3.08Å; R762-R764 VanDerWaalsContact C-N 3.28Å; R762-R764 PolarHBondContact O-N 3.04Å; R764-F766 PolarHBondContact O-N 2.99Å
765	Q	74.2	Confident	87.2	Confident	180 Å²	180	46.5 Å²	46.5	84%	0.841	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	29.4	-177.2	-59.3	-179.7	-7.9	0	0	114	M763	M763-Q765 PolarHBondContact O-N 3.1Å
766	F	85	Confident	87.6	Confident	8 Å²	8	46 Å²	46	4%	0.035	21%	0.208	C	C	.	.			trans	-63.7	130.2	-178.3	-173.9	-90.5	0	0	0	111.7	R691 Y693 F726 F748 M763 R764 V768 F770	R691-F766 HydrophobicContact CG-CE1 4.18Å; Y693-F766 HydrophobicContact CD1-CB 4.23Å; Y693-F766 HydrophobicContact CE1-CB 4.2Å; F726-F766 HydrophobicContact CD1-CD2 4.47Å; F726-F766 AromaticContact CE1-CD2 3.91Å; F726-F766 HydrophobicContact CE1-CD2 3.91Å; F726-F766 HydrophobicContact CE1-CE2 4.04Å; F726-F766 HydrophobicContact CE2-CD2 4.24Å; F726-F766 AromaticContact CE2-CE2 3.71Å; F726-F766 HydrophobicContact CE2-CE2 3.71Å; F726-F766 AromaticContact CZ-CD2 3.77Å; F726-F766 HydrophobicContact CZ-CD2 3.77Å; F726-F766 AromaticContact CZ-CE2 3.4Å; F726-F766 HydrophobicContact CZ-CE2 3.4Å; F726-F766 VanDerWaalsContact CZ-CE2 3.4Å; F726-F766 HydrophobicContact CZ-CZ 4.29Å; F748-F766 HydrophobicContact CB-CE1 4.33Å; F748-F766 HydrophobicContact CB-CE2 4.05Å; F748-F766 HydrophobicContact CB-CZ 3.66Å; F748-F766 HydrophobicContact CD1-CZ 4.28Å; F748-F766 HydrophobicContact CD2-CE1 4.32Å; F748-F766 AromaticContact CD2-CZ 3.89Å; F748-F766 HydrophobicContact CD2-CZ 3.89Å; F748-F766 HydrophobicContact CG-CE1 4.44Å; F748-F766 HydrophobicContact CG-CE2 4.33Å; F748-F766 AromaticContact CG-CZ 3.66Å; F748-F766 HydrophobicContact CG-CZ 3.66Å; M763-F766 HydrophobicContact CB-CB 4.11Å; M763-F766 HydrophobicContact CE-CB 3.79Å; M763-F766 HydrophobicContact CE-CD1 3.26Å; M763-F766 HydrophobicContact CE-CD2 3.56Å; M763-F766 HydrophobicContact CE-CE1 3.55Å; M763-F766 HydrophobicContact CE-CE2 3.82Å; M763-F766 HydrophobicContact CE-CG 3.24Å; M763-F766 HydrophobicContact CE-CZ 3.8Å; M763-F766 PolarHBondContact O-N 3.23Å; M763-F766 HydrophobicContact SD-CB 4.13Å; M763-F766 HydrophobicContact SD-CD1 4.31Å; M763-F766 HydrophobicContact SD-CD2 3.45Å; M763-F766 WeakPolarHBondContact SD-CD2 3.48Å; M763-F766 HydrophobicContact SD-CE2 3.79Å; M763-F766 HydrophobicContact SD-CG 3.71Å; M763-F766 HydrophobicContact SD-CZ 4.33Å; R764-F766 PolarHBondContact O-N 2.99Å; F766-V768 PolarHBondContact O-N 3.08Å; F766-F770 HydrophobicContact CD1-CB 4.48Å; F766-F770 HydrophobicContact CE1-CB 3.52Å; F766-F770 HydrophobicContact CE1-CD1 4.39Å; F766-F770 HydrophobicContact CE1-CG 4.19Å; F766-F770 HydrophobicContact CE2-CB 4.25Å; F766-F770 HydrophobicContact CE2-CD1 4.06Å; F766-F770 HydrophobicContact CE2-CG 4.08Å; F766-F770 HydrophobicContact CZ-CB 3.39Å; F766-F770 AromaticContact CZ-CD1 3.46Å; F766-F770 HydrophobicContact CZ-CD1 3.46Å; F766-F770 VanDerWaalsContact CZ-CD1 3.46Å; F766-F770 HydrophobicContact CZ-CE1 4.38Å; F766-F770 AromaticContact CZ-CG 3.53Å; F766-F770 HydrophobicContact CZ-CG 3.53Å
767	P	87.3	Confident	87.9	Confident	29 Å²	29	45.2 Å²	45.2	19%	0.188	20%	0.204	C	C	.	.			trans	-67.9	122.7	179.7	25	-30	0	0	0	110.5	F726 H769 F770	F726-P767 HydrophobicContact CE1-CG 4.2Å; P767-H769 PolarHBondContact O-N 3.08Å; P767-H769 VanDerWaalsContact O-N 3.15Å; P767-F770 HydrophobicContact CG-CB 4.02Å; P767-F770 HydrophobicContact CG-CD2 4.3Å; P767-F770 WeakPolarHBondContact O-CB 3.44Å; P767-F770 PolarHBondContact O-N 3.24Å
768	V	86.5	Confident	87.8	Confident	58 Å²	58	53 Å²	53	35%	0.352	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-36.1	-176	179.4	0	0	0	0	111.3	R691 F766	R691-V768 WeakPolarHBondContact CD-O 3.42Å; R691-V768 VanDerWaalsContact CZ-CG1 3.5Å; R691-V768 PolarHBondContact NH1-O 3.45Å; F766-V768 PolarHBondContact O-N 3.08Å
769	H	89.9	Confident	87.6	Confident	60 Å²	60	56 Å²	56	28%	0.278	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	16	-179.1	-54.8	-71.5	0	0	0	114.4	P767 A771 R772 E773 V787	P767-H769 PolarHBondContact O-N 3.08Å; P767-H769 VanDerWaalsContact O-N 3.15Å; H769-A771 PolarHBondContact O-N 3.2Å; H769-R772 HydrophobicContact CB-CB 4.44Å; H769-R772 WeakPolarHBondContact O-CA 3.35Å; H769-R772 WeakPolarHBondContact O-CB 3.34Å; H769-R772 PolarHBondContact O-N 3.07Å; H769-E773 PolarHBondContact O-N 2.92Å; H769-V787 HydrophobicContact CB-CG1 3.97Å
770	F	93	Very high	87.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-44.6	-54.7	-175.7	176.7	-114.8	0	0	0	114.5	F717 T720 A721 F726 L728 F748 F766 P767 R772 E773 A774	F717-F770 AromaticContact CD1-CE1 3.85Å; F717-F770 HydrophobicContact CD1-CE1 3.85Å; F717-F770 HydrophobicContact CD1-CZ 4.2Å; F717-F770 HydrophobicContact CE1-CE1 4.19Å; T720-F770 HydrophobicContact CG2-CD2 3.87Å; T720-F770 HydrophobicContact CG2-CE2 3.63Å; A721-F770 HydrophobicContact CB-CE2 4.2Å; A721-F770 HydrophobicContact CB-CZ 3.98Å; F726-F770 HydrophobicContact CE1-CD2 4.36Å; F726-F770 HydrophobicContact CE1-CE2 4.42Å; F726-F770 HydrophobicContact CE2-CD2 4.24Å; F726-F770 HydrophobicContact CE2-CE1 4.2Å; F726-F770 AromaticContact CE2-CE2 3.76Å; F726-F770 HydrophobicContact CE2-CE2 3.76Å; F726-F770 AromaticContact CE2-CZ 3.74Å; F726-F770 HydrophobicContact CE2-CZ 3.74Å; F726-F770 HydrophobicContact CZ-CD1 4.38Å; F726-F770 AromaticContact CZ-CD2 3.45Å; F726-F770 HydrophobicContact CZ-CD2 3.45Å; F726-F770 VanDerWaalsContact CZ-CD2 3.45Å; F726-F770 HydrophobicContact CZ-CE1 4.3Å; F726-F770 AromaticContact CZ-CE2 3.35Å; F726-F770 HydrophobicContact CZ-CE2 3.35Å; F726-F770 AromaticContact CZ-CG 3.97Å; F726-F770 HydrophobicContact CZ-CG 3.97Å; F726-F770 AromaticContact CZ-CZ 3.81Å; F726-F770 HydrophobicContact CZ-CZ 3.81Å; L728-F770 HydrophobicContact CD1-CZ 4.26Å; L728-F770 HydrophobicContact CD2-CE1 4.42Å; F748-F770 HydrophobicContact CD1-CD1 4.07Å; F748-F770 HydrophobicContact CD1-CE1 4.03Å; F748-F770 HydrophobicContact CD2-CD1 4.41Å; F748-F770 AromaticContact CE1-CD1 3.78Å; F748-F770 HydrophobicContact CE1-CD1 3.78Å; F748-F770 AromaticContact CE1-CE1 3.62Å; F748-F770 HydrophobicContact CE1-CE1 3.62Å; F748-F770 HydrophobicContact CE2-CD1 4.15Å; F748-F770 HydrophobicContact CG-CD1 4.38Å; F748-F770 AromaticContact CZ-CD1 3.82Å; F748-F770 HydrophobicContact CZ-CD1 3.82Å; F748-F770 HydrophobicContact CZ-CE1 4.04Å; F766-F770 HydrophobicContact CD1-CB 4.48Å; F766-F770 HydrophobicContact CE1-CB 3.52Å; F766-F770 HydrophobicContact CE1-CD1 4.39Å; F766-F770 HydrophobicContact CE1-CG 4.19Å; F766-F770 HydrophobicContact CE2-CB 4.25Å; F766-F770 HydrophobicContact CE2-CD1 4.06Å; F766-F770 HydrophobicContact CE2-CG 4.08Å; F766-F770 HydrophobicContact CZ-CB 3.39Å; F766-F770 AromaticContact CZ-CD1 3.46Å; F766-F770 HydrophobicContact CZ-CD1 3.46Å; F766-F770 VanDerWaalsContact CZ-CD1 3.46Å; F766-F770 HydrophobicContact CZ-CE1 4.38Å; F766-F770 AromaticContact CZ-CG 3.53Å; F766-F770 HydrophobicContact CZ-CG 3.53Å; P767-F770 HydrophobicContact CG-CB 4.02Å; P767-F770 HydrophobicContact CG-CD2 4.3Å; P767-F770 WeakPolarHBondContact O-CB 3.44Å; P767-F770 PolarHBondContact O-N 3.24Å; F770-R772 VanDerWaalsContact C-N 3.31Å; F770-R772 PolarHBondContact O-N 3.06Å; F770-E773 WeakPolarHBondContact O-CB 3.31Å; F770-E773 PolarHBondContact O-N 2.92Å; F770-A774 PolarHBondContact O-N 3.31Å
771	A	92.8	Very high	87.7	Confident	4 Å²	4	57.7 Å²	57.7	3%	0.033	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-37	-177.8	0	0	0	0	0	111.9	F689 F717 F748 H769 A774 L775	F689-A771 HydrophobicContact CD1-CB 4.02Å; F689-A771 HydrophobicContact CD2-CB 3.53Å; F689-A771 HydrophobicContact CE1-CB 3.97Å; F689-A771 HydrophobicContact CE2-CB 3.5Å; F689-A771 VanDerWaalsContact CE2-CB 3.5Å; F689-A771 HydrophobicContact CG-CB 3.8Å; F689-A771 HydrophobicContact CZ-CB 3.73Å; F717-A771 HydrophobicContact CE1-CB 4.34Å; F748-A771 HydrophobicContact CE2-CB 3.74Å; F748-A771 HydrophobicContact CZ-CB 3.85Å; H769-A771 PolarHBondContact O-N 3.2Å; A771-A774 PolarHBondContact O-N 3.01Å; A771-L775 WeakPolarHBondContact O-CB 3.38Å; A771-L775 WeakPolarHBondContact O-CD1 3.47Å; A771-L775 WeakPolarHBondContact O-CG 3.26Å; A771-L775 PolarHBondContact O-N 3.35Å
772	R	93.6	Very high	88.1	Confident	21 Å²	21	59 Å²	59	8%	0.079	27%	0.265	C	S	.	.	H	α-helix	trans	-64	-46.6	175.7	-64.9	178.2	69.8	109.5	1.8	110.1	G639 L641 H769 F770 A774 L775 T776 K786 V787	G639-R772 PolarHBondContact O-NH1 3.4Å; G639-R772 PolarHBondContact O-NH2 2.92Å; L641-R772 HydrophobicContact CD1-CB 4.43Å; L641-R772 HydrophobicContact CD1-CG 4.34Å; L641-R772 HydrophobicContact CD2-CB 4.27Å; L641-R772 HydrophobicContact CD2-CG 4.45Å; H769-R772 HydrophobicContact CB-CB 4.44Å; H769-R772 WeakPolarHBondContact O-CA 3.35Å; H769-R772 WeakPolarHBondContact O-CB 3.34Å; H769-R772 PolarHBondContact O-N 3.07Å; F770-R772 VanDerWaalsContact C-N 3.31Å; F770-R772 PolarHBondContact O-N 3.06Å; R772-A774 PolarHBondContact O-N 3.42Å; R772-L775 PolarHBondContact O-N 2.88Å; R772-T776 WeakPolarHBondContact O-CB 2.94Å; R772-T776 WeakPolarHBondContact O-CG2 2.98Å; R772-T776 PolarHBondContact O-N 3.14Å; R772-T776 PolarHBondContact O-OG1 2.65Å; R772-T776 VanDerWaalsContact O-OG1 3.12Å; R772-K786 PolarHBondContact NE-O 3.35Å; R772-K786 PolarHBondContact NH2-O 3.44Å; R772-V787 WeakPolarHBondContact CD-O 3.29Å; R772-V787 PolarHBondContact NE-O 3.17Å
773	E	93.1	Very high	88.7	Confident	63 Å²	63	49.1 Å²	49.1	29%	0.294	23%	0.229	S	C	.	.	H	α-helix	trans	-57.8	-47.8	176	-170.8	-176.6	159.2	0	0	112.1	T720 H724 H769 F770 L775 T776 H777 V787	T720-E773 HydrophobicContact CG2-CB 4.27Å; T720-E773 HydrophobicContact CG2-CG 4.03Å; H724-E773 IonicContact CE1-OE1 2.61Å; H724-E773 PolarHBondContact CE1-OE1 2.71Å; H724-E773 IonicContact CE1-OE2 2.94Å; H724-E773 PolarHBondContact CE1-OE2 3.19Å; H724-E773 IonicContact NE2-OE2 2.85Å; H769-E773 PolarHBondContact O-N 2.92Å; F770-E773 WeakPolarHBondContact O-CB 3.31Å; F770-E773 PolarHBondContact O-N 2.92Å; E773-L775 VanDerWaalsContact C-N 3.33Å; E773-L775 PolarHBondContact O-N 3.49Å; E773-T776 WeakPolarHBondContact CA-OG1 3.18Å; E773-T776 PolarHBondContact O-N 2.69Å; E773-T776 PolarHBondContact O-OG1 2.81Å; E773-H777 PolarHBondContact O-N 3.35Å; E773-V787 HydrophobicContact CB-CG1 4.34Å
774	A	93.7	Very high	89.1	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.9	-41.4	176.6	0	0	0	0	0	112.7	F717 T720 F770 A771 R772 H777 L780	F717-A774 HydrophobicContact CD1-CB 3.84Å; F717-A774 HydrophobicContact CD2-CB 4.4Å; F717-A774 HydrophobicContact CE1-CB 3.89Å; F717-A774 HydrophobicContact CE2-CB 4.46Å; F717-A774 HydrophobicContact CG-CB 4.1Å; F717-A774 HydrophobicContact CZ-CB 4.21Å; T720-A774 HydrophobicContact CG2-CB 4.33Å; F770-A774 PolarHBondContact O-N 3.31Å; A771-A774 PolarHBondContact O-N 3.01Å; R772-A774 PolarHBondContact O-N 3.42Å; A774-H777 VanDerWaalsContact O-CB 3.31Å; A774-H777 WeakPolarHBondContact O-CB 3.15Å; A774-L780 WeakPolarHBondContact O-CD1 3.21Å
775	L	94	Very high	90	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-77.4	-27.2	-178.7	-68.4	169.7	0	0	0	113.8	L641 V687 F689 V703 L705 F717 A771 R772 E773 H777 L780 L781	L641-L775 HydrophobicContact CD1-CB 3.82Å; L641-L775 HydrophobicContact CD1-CD1 4Å; V687-L775 HydrophobicContact CG2-CD2 4.42Å; F689-L775 HydrophobicContact CD1-CD1 4.23Å; F689-L775 HydrophobicContact CE1-CD1 3.71Å; V703-L775 HydrophobicContact CB-CD1 3.98Å; V703-L775 HydrophobicContact CG1-CD1 4.11Å; V703-L775 HydrophobicContact CG2-CD1 3.89Å; L705-L775 HydrophobicContact CD1-CD2 3.9Å; F717-L775 HydrophobicContact CE2-CD2 4.1Å; F717-L775 HydrophobicContact CE2-CG 4.44Å; F717-L775 HydrophobicContact CZ-CD2 4.39Å; F717-L775 HydrophobicContact CZ-CG 4.3Å; A771-L775 WeakPolarHBondContact O-CB 3.38Å; A771-L775 WeakPolarHBondContact O-CD1 3.47Å; A771-L775 WeakPolarHBondContact O-CG 3.26Å; A771-L775 PolarHBondContact O-N 3.35Å; R772-L775 PolarHBondContact O-N 2.88Å; E773-L775 VanDerWaalsContact C-N 3.33Å; E773-L775 PolarHBondContact O-N 3.49Å; L775-H777 PolarHBondContact O-N 2.73Å; L775-L780 HydrophobicContact CD2-CD1 4.34Å; L775-L780 VanDerWaalsContact O-CB 3.29Å; L775-L780 WeakPolarHBondContact O-CB 3.43Å; L775-L781 PolarHBondContact O-N 2.87Å
776	T	93	Very high	90.8	Very high	8 Å²	8	45.7 Å²	45.7	5%	0.049	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-3.1	175.1	58.6	0	0	0	0	113.8	L641 R772 E773 N782 C783 V787	L641-T776 HydrophobicContact CD2-CG2 3.53Å; R772-T776 WeakPolarHBondContact O-CB 2.94Å; R772-T776 WeakPolarHBondContact O-CG2 2.98Å; R772-T776 PolarHBondContact O-N 3.14Å; R772-T776 PolarHBondContact O-OG1 2.65Å; R772-T776 VanDerWaalsContact O-OG1 3.12Å; E773-T776 WeakPolarHBondContact CA-OG1 3.18Å; E773-T776 PolarHBondContact O-N 2.69Å; E773-T776 PolarHBondContact O-OG1 2.81Å; T776-N782 WeakPolarHBondContact O-CA 3.38Å; T776-N782 PolarHBondContact O-N 3.11Å; T776-C783 WeakPolarHBondContact CG2-O 3.34Å; T776-C783 PolarHBondContact O-N 3Å; T776-V787 HydrophobicContact CG2-CG2 3.96Å; T776-V787 VanDerWaalsContact OG1-CG2 3.24Å; T776-V787 WeakPolarHBondContact OG1-CG2 3.41Å
777	H	92.2	Very high	90.9	Very high	46 Å²	46	47 Å²	47	21%	0.213	23%	0.234	C	C	.	.	S	Bend	trans	-52.4	149.8	178.8	-166.1	-96	0	0	0	111.7	C716 E773 A774 L775 D779 L780 N782	C716-H777 HydrophobicContact CB-CB 4.24Å; C716-H777 PolarHBondContact SG-ND1 2.99Å; E773-H777 PolarHBondContact O-N 3.35Å; A774-H777 VanDerWaalsContact O-CB 3.31Å; A774-H777 WeakPolarHBondContact O-CB 3.15Å; L775-H777 PolarHBondContact O-N 2.73Å; H777-D779 IonicContact CE1-OD2 3.62Å; H777-D779 PolarHBondContact CE1-OD2 3.11Å; H777-D779 PolarHBondContact ND1-N 2.87Å; H777-D779 IonicContact ND1-OD2 3.69Å; H777-D779 PolarHBondContact ND1-OD2 2.75Å; H777-D779 PolarHBondContact O-N 3.28Å; H777-D779 VanDerWaalsContact O-N 3.08Å; H777-L780 PolarHBondContact O-N 3.49Å; H777-N782 PolarHBondContact O-N 3.03Å
778	R	90.2	Very high	90.8	Very high	198 Å²	198	48.2 Å²	48.2	75%	0.747	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-33.5	-175	-177.3	-178.5	172	-169.1	-2.3	113.5	L780	R778-L780 VanDerWaalsContact C-N 3.33Å
779	D	89.3	Confident	90.8	Very high	64 Å²	64	48.6 Å²	48.6	34%	0.342	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-6.8	-178.5	-57.7	-51.3	0	0	0	113.9	N712 H777	N712-D779 HydrophobicContact CB-CB 4.42Å; H777-D779 IonicContact CE1-OD2 3.62Å; H777-D779 PolarHBondContact CE1-OD2 3.11Å; H777-D779 PolarHBondContact ND1-N 2.87Å; H777-D779 IonicContact ND1-OD2 3.69Å; H777-D779 PolarHBondContact ND1-OD2 2.75Å; H777-D779 PolarHBondContact O-N 3.28Å; H777-D779 VanDerWaalsContact O-N 3.08Å
780	L	91.9	Very high	90.6	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113	-109	179.9	-62.4	-177.7	0	0	0	110.1	L705 K709 N712 I713 C716 A774 L775 H777 R778	L705-L780 HydrophobicContact CD2-CB 4.19Å; K709-L780 HydrophobicContact CB-CD2 4.12Å; K709-L780 VanDerWaalsContact CD-O 3.25Å; K709-L780 WeakPolarHBondContact CD-O 3.11Å; K709-L780 WeakPolarHBondContact CE-O 3.4Å; K709-L780 PolarHBondContact NZ-O 3.19Å; N712-L780 HydrophobicContact CB-CD2 4.16Å; I713-L780 HydrophobicContact CG1-CD1 4.45Å; I713-L780 HydrophobicContact CG1-CD2 3.75Å; C716-L780 HydrophobicContact CB-CD1 3.79Å; C716-L780 HydrophobicContact CB-CG 4.4Å; A774-L780 WeakPolarHBondContact O-CD1 3.21Å; L775-L780 HydrophobicContact CD2-CD1 4.34Å; L775-L780 VanDerWaalsContact O-CB 3.29Å; L775-L780 WeakPolarHBondContact O-CB 3.43Å; H777-L780 PolarHBondContact O-N 3.49Å; R778-L780 VanDerWaalsContact C-N 3.33Å
781	L	91.1	Very high	90.3	Very high	40 Å²	40	57.1 Å²	57.1	21%	0.209	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-19.2	-177.8	-66.5	172.9	0	0	0	113.9	L641 V703 L705 L775 C783	L641-L781 HydrophobicContact CB-CD1 3.87Å; L641-L781 HydrophobicContact CD1-CD1 4.3Å; V703-L781 HydrophobicContact CG1-CD1 4.24Å; L705-L781 HydrophobicContact CD2-CD1 4.25Å; L705-L781 HydrophobicContact CD2-CD2 3.71Å; L705-L781 HydrophobicContact CD2-CG 3.59Å; L775-L781 PolarHBondContact O-N 2.87Å; L781-C783 VanDerWaalsContact CB-SG 3.51Å; L781-C783 PolarHBondContact O-N 2.98Å
782	N	91.2	Very high	89.9	Confident	99 Å²	99	57.9 Å²	57.9	53%	0.529	28%	0.283	S	S	.	.			trans	50.1	49.3	-179.9	-168.4	43	0	0	0	114.1	T776 H777	T776-N782 WeakPolarHBondContact O-CA 3.38Å; T776-N782 PolarHBondContact O-N 3.11Å; H777-N782 PolarHBondContact O-N 3.03Å
783	C	90.6	Very high	89.6	Confident	12 Å²	12	59.2 Å²	59.2	8%	0.081	30%	0.298	C	S	.	.			trans	-133.7	65.5	179.4	50.6	0	0	0	0	111.4	T776 L781 E785 K786	T776-C783 WeakPolarHBondContact CG2-O 3.34Å; T776-C783 PolarHBondContact O-N 3Å; L781-C783 VanDerWaalsContact CB-SG 3.51Å; L781-C783 PolarHBondContact O-N 2.98Å; C783-E785 WeakPolarHBondContact CA-OE1 3.36Å; C783-E785 VanDerWaalsContact CB-OE1 3.26Å; C783-E785 WeakPolarHBondContact CB-OE1 3.24Å; C783-E785 PolarHBondContact O-N 3.27Å; C783-E785 VanDerWaalsContact O-N 3.17Å; C783-K786 HydrophobicContact CB-CB 4.43Å; C783-K786 HydrophobicContact CB-CD 4.22Å; C783-K786 HydrophobicContact CB-CG 4.13Å; C783-K786 PolarHBondContact O-N 3.18Å
784	P	88.2	Confident	89.4	Confident	83 Å²	83	60 Å²	60	54%	0.539	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-60.6	-24.1	-176.3	26.8	-36.2	0	0	0	113.9	K786 V787	P784-K786 PolarHBondContact O-N 3.32Å; P784-V787 VanDerWaalsContact O-CG2 3.23Å; P784-V787 WeakPolarHBondContact O-CG2 3.48Å; P784-V787 PolarHBondContact O-N 3.14Å
785	E	88.6	Confident	89.3	Confident	114 Å²	114	63.2 Å²	63.2	53%	0.533	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-64.3	-24.3	174.6	67.4	-72	166.6	0	0	113.2	C783	C783-E785 WeakPolarHBondContact CA-OE1 3.36Å; C783-E785 VanDerWaalsContact CB-OE1 3.26Å; C783-E785 WeakPolarHBondContact CB-OE1 3.24Å; C783-E785 PolarHBondContact O-N 3.27Å; C783-E785 VanDerWaalsContact O-N 3.17Å
786	K	90.8	Very high	89.2	Confident	53 Å²	53	66.8 Å²	66.8	23%	0.23	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-89.2	6	180	-59.5	-164.9	177.5	-170.8	0	114	L641 R772 C783 P784 D788 C792	L641-K786 HydrophobicContact CD2-CB 3.97Å; L641-K786 WeakPolarHBondContact CD2-O 3.38Å; L641-K786 VanDerWaalsContact O-CD 3.25Å; L641-K786 WeakPolarHBondContact O-CD 3.45Å; L641-K786 PolarHBondContact O-NZ 2.94Å; R772-K786 PolarHBondContact NE-O 3.35Å; R772-K786 PolarHBondContact NH2-O 3.44Å; C783-K786 HydrophobicContact CB-CB 4.43Å; C783-K786 HydrophobicContact CB-CD 4.22Å; C783-K786 HydrophobicContact CB-CG 4.13Å; C783-K786 PolarHBondContact O-N 3.18Å; P784-K786 PolarHBondContact O-N 3.32Å; K786-D788 VanDerWaalsContact C-N 3.33Å; K786-D788 PolarHBondContact O-N 2.95Å; K786-C792 HydrophobicContact CB-CB 4.34Å; K786-C792 HydrophobicContact CD-CB 4.15Å; K786-C792 HydrophobicContact CG-CB 3.87Å
787	V	87.2	Confident	89.1	Confident	35 Å²	35	72.3 Å²	72.3	21%	0.212	37%	0.37	C	S	.	.	S	Bend	trans	-58.9	-47.6	177.3	172.7	0	0	0	0	110.6	H769 R772 E773 T776 P784	H769-V787 HydrophobicContact CB-CG1 3.97Å; R772-V787 WeakPolarHBondContact CD-O 3.29Å; R772-V787 PolarHBondContact NE-O 3.17Å; E773-V787 HydrophobicContact CB-CG1 4.34Å; T776-V787 HydrophobicContact CG2-CG2 3.96Å; T776-V787 VanDerWaalsContact OG1-CG2 3.24Å; T776-V787 WeakPolarHBondContact OG1-CG2 3.41Å; P784-V787 VanDerWaalsContact O-CG2 3.23Å; P784-V787 WeakPolarHBondContact O-CG2 3.48Å; P784-V787 PolarHBondContact O-N 3.14Å
788	D	87	Confident	89.1	Confident	55 Å²	55	74.3 Å²	74.3	29%	0.294	38%	0.38	S	S	.	.	S	Bend	trans	-84.1	124.1	168.5	-168.4	-11.7	0	0	0	109.7	K786 H790 N791	K786-D788 VanDerWaalsContact C-N 3.33Å; K786-D788 PolarHBondContact O-N 2.95Å; D788-H790 PolarHBondContact O-N 2.81Å; D788-H790 IonicContact OD1-CD2 3.48Å; D788-H790 PolarHBondContact OD1-CD2 3.3Å; D788-H790 VanDerWaalsContact OD1-CD2 3.26Å; D788-H790 IonicContact OD1-CG 2.63Å; D788-H790 PolarHBondContact OD1-N 3.02Å; D788-H790 VanDerWaalsContact OD1-N 3.1Å; D788-N791 PolarHBondContact O-N 3.01Å
789	W	85.9	Confident	89.2	Confident	66 Å²	66	65.3 Å²	65.3	25%	0.25	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-68.2	-26.8	-177.6	70.8	-84.1	0	0	0	112.2	K638 N791 C792 A793	K638-W789 HydrophobicContact CD-CZ3 4.07Å; K638-W789 HydrophobicContact CG-CE3 4.41Å; K638-W789 HydrophobicContact CG-CZ3 4.08Å; W789-N791 PolarHBondContact O-N 3.08Å; W789-C792 PolarHBondContact O-N 2.64Å; W789-C792 VanDerWaalsContact O-N 3.15Å; W789-C792 PolarHBondContact O-SG 3.44Å; W789-A793 PolarHBondContact O-N 3.16Å
790	H	85.6	Confident	89.3	Confident	117 Å²	117	64.5 Å²	64.5	54%	0.542	34%	0.344	S	S	.	.	G	3₁₀ helix	trans	-60.5	-29.3	176.9	-70.4	-68.3	0	0	0	112.4	D788 C792	D788-H790 PolarHBondContact O-N 2.81Å; D788-H790 IonicContact OD1-CD2 3.48Å; D788-H790 PolarHBondContact OD1-CD2 3.3Å; D788-H790 VanDerWaalsContact OD1-CD2 3.26Å; D788-H790 IonicContact OD1-CG 2.63Å; D788-H790 PolarHBondContact OD1-N 3.02Å; D788-H790 VanDerWaalsContact OD1-N 3.1Å; H790-C792 VanDerWaalsContact C-N 3.3Å; H790-C792 PolarHBondContact O-N 3.07Å
791	N	85.5	Confident	89.4	Confident	121 Å²	121	71 Å²	71	65%	0.647	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-80.8	-9.1	-178.3	-64.7	-22.7	0	0	0	113.7	D788 W789	D788-N791 PolarHBondContact O-N 3.01Å; W789-N791 PolarHBondContact O-N 3.08Å
792	C	86.3	Confident	89.5	Confident	21 Å²	21	70.6 Å²	70.6	14%	0.142	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-131.5	20.2	-176.2	57.3	0	0	0	0	113.5	G639 K786 W789 H790	G639-C792 PolarHBondContact O-SG 3.41Å; G639-C792 VanDerWaalsContact O-SG 3.38Å; K786-C792 HydrophobicContact CB-CB 4.34Å; K786-C792 HydrophobicContact CD-CB 4.15Å; K786-C792 HydrophobicContact CG-CB 3.87Å; W789-C792 PolarHBondContact O-N 2.64Å; W789-C792 VanDerWaalsContact O-N 3.15Å; W789-C792 PolarHBondContact O-SG 3.44Å; H790-C792 VanDerWaalsContact C-N 3.3Å; H790-C792 PolarHBondContact O-N 3.07Å
793	A	86	Confident	89.5	Confident	49 Å²	49	65.9 Å²	65.9	41%	0.405	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-67.9	131	171.8	0	0	0	0	0	110.6	W789	W789-A793 PolarHBondContact O-N 3.16Å
794	L	89.3	Confident	89.5	Confident	79 Å²	79	69.6 Å²	69.6	41%	0.414	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-89.9	169.7	176.1	-64.2	176.8	0	0	0	110.2	E798 E799 L802	L794-E798 HydrophobicContact CB-CB 4.13Å; L794-E799 HydrophobicContact CB-CG 3.91Å; L794-L802 HydrophobicContact CD1-CD1 3.56Å
795	T	92	Very high	89.7	Confident	67 Å²	67	72 Å²	72	41%	0.411	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-74.1	158.4	172.1	81.1	0	0	0	0	110.8	E797 E798 E799	T795-E797 VanDerWaalsContact CB-OE2 3.26Å; T795-E797 WeakPolarHBondContact CB-OE2 3.26Å; T795-E797 PolarHBondContact O-N 3.4Å; T795-E797 PolarHBondContact OG1-OE2 2.96Å; T795-E798 PolarHBondContact N-OE2 3.35Å; T795-E798 PolarHBondContact O-N 3.08Å; T795-E798 VanDerWaalsContact O-N 3.15Å; T795-E798 PolarHBondContact OG1-N 3.01Å; T795-E799 WeakPolarHBondContact O-CG 3.32Å; T795-E799 PolarHBondContact O-N 3.21Å
796	V	90.7	Very high	89.8	Confident	75 Å²	75	66.8 Å²	66.8	46%	0.455	34%	0.343	S	S	.	.	H	α-helix	trans	-58.8	-35.2	-179.6	177.1	0	0	0	0	111.2	T800	V796-T800 WeakPolarHBondContact O-CB 3.43Å; V796-T800 PolarHBondContact O-N 3.39Å; V796-T800 PolarHBondContact O-OG1 3.27Å
797	E	91.9	Very high	89.8	Confident	124 Å²	124	67.4 Å²	67.4	58%	0.579	34%	0.344	S	S	*	.	H	α-helix	trans	-65.8	-44.9	177.3	-58.3	76.9	-165.5	0	0	112	T795 T800 Q801	T795-E797 VanDerWaalsContact CB-OE2 3.26Å; T795-E797 WeakPolarHBondContact CB-OE2 3.26Å; T795-E797 PolarHBondContact O-N 3.4Å; T795-E797 PolarHBondContact OG1-OE2 2.96Å; E797-T800 PolarHBondContact O-N 3.17Å; E797-Q801 WeakPolarHBondContact O-CG 3.41Å; E797-Q801 PolarHBondContact O-N 3.39Å
798	E	92.3	Very high	89.8	Confident	89 Å²	89	71.5 Å²	71.5	42%	0.416	37%	0.365	S	S	.	.	H	α-helix	trans	-65.2	-44.7	177.4	-69.1	174.3	157.6	0	0	111.1	L794 T795 T800 Q801 L802	L794-E798 HydrophobicContact CB-CB 4.13Å; T795-E798 PolarHBondContact N-OE2 3.35Å; T795-E798 PolarHBondContact O-N 3.08Å; T795-E798 VanDerWaalsContact O-N 3.15Å; T795-E798 PolarHBondContact OG1-N 3.01Å; E798-T800 VanDerWaalsContact C-N 3.31Å; E798-T800 PolarHBondContact O-N 3.38Å; E798-Q801 PolarHBondContact O-N 2.83Å; E798-L802 WeakPolarHBondContact O-CG 3.21Å; E798-L802 PolarHBondContact O-N 3.25Å
799	E	92.3	Very high	90	Very high	9 Å²	9	71.1 Å²	71.1	4%	0.042	37%	0.366	C	S	.	.	H	α-helix	trans	-59	-42.5	175.1	-73.6	-176.5	160.3	0	0	111.8	H623 L624 L794 T795 L802 A803	H623-E799 IonicContact CD2-OE2 2.7Å; H623-E799 IonicContact CE1-OE2 2.68Å; H623-E799 IonicContact NE2-OE2 3.42Å; H623-E799 PolarHBondContact NE2-OE2 3.47Å; L624-E799 HydrophobicContact CD2-CB 3.74Å; L624-E799 HydrophobicContact CD2-CG 4.01Å; L794-E799 HydrophobicContact CB-CG 3.91Å; T795-E799 WeakPolarHBondContact O-CG 3.32Å; T795-E799 PolarHBondContact O-N 3.21Å; E799-L802 PolarHBondContact O-N 3.38Å; E799-A803 WeakPolarHBondContact O-CB 3.39Å; E799-A803 PolarHBondContact O-N 3.07Å
800	T	92.1	Very high	90.2	Very high	47 Å²	47	68 Å²	68	29%	0.288	35%	0.354	S	S	.	.	H	α-helix	trans	-65.4	-43.1	178.5	-57.9	0	0	0	0	111.3	V796 E797 E798 L802 A803 L804	V796-T800 WeakPolarHBondContact O-CB 3.43Å; V796-T800 PolarHBondContact O-N 3.39Å; V796-T800 PolarHBondContact O-OG1 3.27Å; E797-T800 PolarHBondContact O-N 3.17Å; E798-T800 VanDerWaalsContact C-N 3.31Å; E798-T800 PolarHBondContact O-N 3.38Å; T800-L802 VanDerWaalsContact C-N 3.35Å; T800-L802 PolarHBondContact O-N 2.81Å; T800-A803 PolarHBondContact O-N 3.32Å; T800-L804 HydrophobicContact CG2-CD1 4.26Å; T800-L804 WeakPolarHBondContact O-CG 3.37Å; T800-L804 PolarHBondContact O-N 3.18Å
801	Q	93.1	Very high	90.3	Very high	136 Å²	136	65.1 Å²	65.1	64%	0.636	35%	0.347	S	S	*	.	H	α-helix	trans	-63.9	-40.5	177.1	-72.7	176.2	8.7	0	0	112	E797 E798 K805	E797-Q801 WeakPolarHBondContact O-CG 3.41Å; E797-Q801 PolarHBondContact O-N 3.39Å; E798-Q801 PolarHBondContact O-N 2.83Å; Q801-K805 WeakPolarHBondContact O-CB 3.28Å; Q801-K805 PolarHBondContact O-N 2.68Å
802	L	92.3	Very high	90.4	Very high	31 Å²	31	68 Å²	68	16%	0.162	35%	0.354	C	S	.	.	H	α-helix	trans	-62.5	-48.5	173.8	-74.7	172.6	0	0	0	111.1	L636 D643 L794 E798 E799 T800 L804 K805 F806	L636-L802 HydrophobicContact CD1-CB 3.99Å; D643-L802 HydrophobicContact CB-CD1 4.49Å; D643-L802 HydrophobicContact CB-CD2 4.18Å; L794-L802 HydrophobicContact CD1-CD1 3.56Å; E798-L802 WeakPolarHBondContact O-CG 3.21Å; E798-L802 PolarHBondContact O-N 3.25Å; E799-L802 PolarHBondContact O-N 3.38Å; T800-L802 VanDerWaalsContact C-N 3.35Å; T800-L802 PolarHBondContact O-N 2.81Å; L802-L804 VanDerWaalsContact C-N 3.33Å; L802-L804 PolarHBondContact O-N 3.11Å; L802-K805 WeakPolarHBondContact O-CB 3.44Å; L802-K805 PolarHBondContact O-N 2.89Å; L802-F806 HydrophobicContact CB-CD2 4.48Å; L802-F806 HydrophobicContact CB-CE2 4.17Å; L802-F806 HydrophobicContact CD2-CE2 4.22Å; L802-F806 WeakPolarHBondContact O-CD2 3.49Å; L802-F806 PolarHBondContact O-N 3.43Å
803	A	91.5	Very high	90.6	Very high	1 Å²	1	69.5 Å²	69.5	1%	0.008	36%	0.357	C	S	.	.	H	α-helix	trans	-57.3	-44.9	178.7	0	0	0	0	0	112	H623 L636 E799 T800 F806 R807	H623-A803 WeakPolarHBondContact O-CB 3.29Å; L636-A803 HydrophobicContact CD1-CB 3.93Å; E799-A803 WeakPolarHBondContact O-CB 3.39Å; E799-A803 PolarHBondContact O-N 3.07Å; T800-A803 PolarHBondContact O-N 3.32Å; A803-F806 PolarHBondContact O-N 3.46Å; A803-R807 WeakPolarHBondContact O-CG 3.5Å; A803-R807 PolarHBondContact O-N 3.27Å
804	L	91.4	Very high	90.7	Very high	89 Å²	89	68.2 Å²	68.2	47%	0.466	34%	0.343	S	S	.	.	H	α-helix	trans	-61.9	-45.9	176.5	-70.4	172.5	0	0	0	112.1	T800 L802 F806 R807 D808	T800-L804 HydrophobicContact CG2-CD1 4.26Å; T800-L804 WeakPolarHBondContact O-CG 3.37Å; T800-L804 PolarHBondContact O-N 3.18Å; L802-L804 VanDerWaalsContact C-N 3.33Å; L802-L804 PolarHBondContact O-N 3.11Å; L804-F806 VanDerWaalsContact C-N 3.28Å; L804-F806 PolarHBondContact O-N 3.14Å; L804-R807 PolarHBondContact O-N 2.91Å; L804-D808 PolarHBondContact O-N 3.4Å; L804-D808 VanDerWaalsContact O-N 3.16Å
805	K	91.9	Very high	90.6	Very high	134 Å²	134	67.4 Å²	67.4	58%	0.583	34%	0.336	S	S	*	.	H	α-helix	trans	-57.8	-40.8	176.6	-177.8	-173.3	175.4	-170	0	111.9	Q801 L802 S809	Q801-K805 WeakPolarHBondContact O-CB 3.28Å; Q801-K805 PolarHBondContact O-N 2.68Å; L802-K805 WeakPolarHBondContact O-CB 3.44Å; L802-K805 PolarHBondContact O-N 2.89Å; K805-S809 PolarHBondContact O-N 2.93Å; K805-S809 PolarHBondContact O-OG 3.1Å
806	F	90.8	Very high	89.9	Confident	5 Å²	5	65.9 Å²	65.9	2%	0.022	33%	0.326	C	S	.	.	H	α-helix	trans	-75.2	-33.4	178.4	-69	-61.5	0	0	0	113.5	L636 D643 D644 F646 L802 A803 L804 D808 S809 F810	L636-F806 HydrophobicContact CD1-CD2 3.95Å; L636-F806 HydrophobicContact CD1-CE2 4.32Å; L636-F806 HydrophobicContact CD2-CD2 3.77Å; L636-F806 HydrophobicContact CD2-CE2 3.98Å; L636-F806 HydrophobicContact CG-CD2 4.34Å; D643-F806 HydrophobicContact CB-CZ 4.48Å; D643-F806 VanDerWaalsContact O-CE2 3.25Å; D643-F806 WeakPolarHBondContact O-CE2 3.4Å; D644-F806 HydrophobicContact CB-CE1 4.26Å; D644-F806 HydrophobicContact CB-CZ 4.24Å; D644-F806 WeakPolarHBondContact OD1-CE1 3.25Å; D644-F806 WeakPolarHBondContact OD1-CZ 3.41Å; F646-F806 HydrophobicContact CE1-CB 4.3Å; F646-F806 HydrophobicContact CE1-CG 4.33Å; F646-F806 HydrophobicContact CZ-CB 4.15Å; F646-F806 AromaticContact CZ-CD1 3.96Å; F646-F806 HydrophobicContact CZ-CD1 3.96Å; F646-F806 HydrophobicContact CZ-CD2 4.39Å; F646-F806 AromaticContact CZ-CG 3.91Å; F646-F806 HydrophobicContact CZ-CG 3.91Å; L802-F806 HydrophobicContact CB-CD2 4.48Å; L802-F806 HydrophobicContact CB-CE2 4.17Å; L802-F806 HydrophobicContact CD2-CE2 4.22Å; L802-F806 WeakPolarHBondContact O-CD2 3.49Å; L802-F806 PolarHBondContact O-N 3.43Å; A803-F806 PolarHBondContact O-N 3.46Å; L804-F806 VanDerWaalsContact C-N 3.28Å; L804-F806 PolarHBondContact O-N 3.14Å; F806-D808 VanDerWaalsContact C-N 3.26Å; F806-D808 PolarHBondContact O-N 3.01Å; F806-S809 WeakPolarHBondContact CA-OG 3.47Å; F806-S809 PolarHBondContact O-N 3.49Å; F806-S809 PolarHBondContact O-OG 2.93Å; F806-F810 WeakPolarHBondContact O-CA 3.28Å; F806-F810 WeakPolarHBondContact O-CB 3.38Å; F806-F810 PolarHBondContact O-N 2.83Å
807	R	89.9	Confident	88.5	Confident	66 Å²	66	70.2 Å²	70.2	25%	0.249	34%	0.341	C	S	.	.	H	α-helix	trans	-57.2	-44.4	172.2	-74.4	174.8	-176.8	-170.7	2.7	110.7	I625 V626 A803 L804 S811	I625-R807 VanDerWaalsContact O-CZ 3.25Å; I625-R807 PolarHBondContact O-NE 2.92Å; I625-R807 PolarHBondContact O-NH2 2.85Å; V626-R807 HydrophobicContact CB-CG 4.41Å; V626-R807 HydrophobicContact CG1-CG 3.94Å; A803-R807 WeakPolarHBondContact O-CG 3.5Å; A803-R807 PolarHBondContact O-N 3.27Å; L804-R807 PolarHBondContact O-N 2.91Å; R807-S811 WeakPolarHBondContact O-CB 3.21Å; R807-S811 PolarHBondContact O-N 3.38Å
808	D	89.1	Confident	86.7	Confident	121 Å²	121	69.9 Å²	69.9	65%	0.647	35%	0.347	S	S	*	.	H	α-helix	trans	-65	-45.9	178.4	-68.5	-19.9	0	0	0	112.2	L804 F806 S811	L804-D808 PolarHBondContact O-N 3.4Å; L804-D808 VanDerWaalsContact O-N 3.16Å; F806-D808 VanDerWaalsContact C-N 3.26Å; F806-D808 PolarHBondContact O-N 3.01Å; D808-S811 PolarHBondContact O-OG 3.2Å
809	S	90.1	Very high	84.5	Confident	46 Å²	46	72.7 Å²	72.7	32%	0.322	37%	0.365	S	S	.	.	H	α-helix	trans	-74.7	-34.1	-177.8	65.9	0	0	0	0	113.7	Y678 K805 F806	Y678-S809 PolarHBondContact OH-OG 3.47Å; K805-S809 PolarHBondContact O-N 2.93Å; K805-S809 PolarHBondContact O-OG 3.1Å; F806-S809 WeakPolarHBondContact CA-OG 3.47Å; F806-S809 PolarHBondContact O-N 3.49Å; F806-S809 PolarHBondContact O-OG 2.93Å
810	F	90.9	Very high	82.3	Confident	2 Å²	2	75.6 Å²	75.6	1%	0.009	38%	0.38	C	S	.	.	H	α-helix	trans	-83	-17.6	-179.1	-171.6	-107.9	0	0	0	112.9	V626 L634 C674 L675 Y678 F806 K812 Y813 D814	V626-F810 HydrophobicContact CG1-CD1 4.4Å; L634-F810 HydrophobicContact CD2-CD1 4.23Å; L634-F810 HydrophobicContact CD2-CE1 3.74Å; L634-F810 HydrophobicContact CD2-CZ 3.96Å; C674-F810 HydrophobicContact CB-CE2 4.14Å; C674-F810 HydrophobicContact CB-CZ 3.78Å; L675-F810 HydrophobicContact CD2-CE2 3.91Å; L675-F810 HydrophobicContact CD2-CZ 4.41Å; L675-F810 HydrophobicContact CG-CE2 4.38Å; Y678-F810 HydrophobicContact CD1-CD2 4.3Å; Y678-F810 HydrophobicContact CD2-CD2 4.08Å; Y678-F810 AromaticContact CG-CD2 3.9Å; Y678-F810 HydrophobicContact CG-CD2 3.9Å; Y678-F810 HydrophobicContact CG-CE2 4.45Å; F806-F810 WeakPolarHBondContact O-CA 3.28Å; F806-F810 WeakPolarHBondContact O-CB 3.38Å; F806-F810 PolarHBondContact O-N 2.83Å; F810-K812 PolarHBondContact O-N 3.31Å; F810-Y813 PolarHBondContact O-N 3.09Å; F810-D814 HydrophobicContact CD1-CB 3.91Å; F810-D814 HydrophobicContact CE1-CB 3.78Å; F810-D814 PolarHBondContact O-N 3.27Å
811	S	86.6	Confident	79.6	Confident	56 Å²	56	82.3 Å²	82.3	39%	0.392	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-32.5	-179.9	62.7	0	0	0	0	114.9	R807 D808 Y813	R807-S811 WeakPolarHBondContact O-CB 3.21Å; R807-S811 PolarHBondContact O-N 3.38Å; D808-S811 PolarHBondContact O-OG 3.2Å; S811-Y813 VanDerWaalsContact C-N 3.32Å; S811-Y813 PolarHBondContact O-N 2.81Å
812	K	88.4	Confident	78.9	Confident	180 Å²	180	79.6 Å²	79.6	78%	0.783	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-24.3	178.5	-62	-178.4	-176.9	178	0	114.1	F810	F810-K812 PolarHBondContact O-N 3.31Å
813	Y	90.3	Very high	78.2	Confident	54 Å²	54	82.2 Å²	82.2	21%	0.212	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-18.9	-175.3	-59.9	-88	0	0	0	112.3	C674 Y678 D681 F810 S811 F815	C674-Y813 WeakPolarHBondContact CB-O 3.29Å; C674-Y813 PolarHBondContact SG-O 3.28Å; Y678-Y813 AromaticContact CD2-CD2 3.6Å; Y678-Y813 HydrophobicContact CD2-CD2 3.6Å; Y678-Y813 AromaticContact CD2-CE2 3.62Å; Y678-Y813 HydrophobicContact CD2-CE2 3.62Å; Y678-Y813 HydrophobicContact CD2-CG 4.43Å; Y678-Y813 HydrophobicContact CG-CD2 4.27Å; Y678-Y813 HydrophobicContact CG-CE2 4.43Å; D681-Y813 VanDerWaalsContact CB-OH 3.26Å; D681-Y813 WeakPolarHBondContact CB-OH 3.11Å; D681-Y813 PolarHBondContact OD2-OH 3.47Å; F810-Y813 PolarHBondContact O-N 3.09Å; S811-Y813 VanDerWaalsContact C-N 3.32Å; S811-Y813 PolarHBondContact O-N 2.81Å; Y813-F815 PolarHBondContact O-N 2.79Å
814	D	87.5	Confident	77.5	Confident	21 Å²	21	86.7 Å²	86.7	11%	0.112	45%	0.45	C	S	.	.			trans	-65.9	122.4	-179.5	-166.9	-1.4	0	0	0	110.8	S627 F810 N816 Q817	S627-D814 WeakPolarHBondContact CB-OD2 3.24Å; S627-D814 PolarHBondContact OG-OD1 2.81Å; S627-D814 PolarHBondContact OG-OD2 3.29Å; F810-D814 HydrophobicContact CD1-CB 3.91Å; F810-D814 HydrophobicContact CE1-CB 3.78Å; F810-D814 PolarHBondContact O-N 3.27Å; D814-N816 VanDerWaalsContact C-N 3.28Å; D814-N816 PolarHBondContact OD1-N 3.2Å; D814-Q817 WeakPolarHBondContact O-CG 3.48Å
815	F	88.4	Confident	76.6	Confident	62 Å²	62	86.5 Å²	86.5	27%	0.272	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-21.3	177.3	63.7	-90.3	0	0	0	112.3	S629 Q670 Y671 Y813 Q817	S629-F815 WeakPolarHBondContact OG-CE2 3.48Å; Q670-F815 HydrophobicContact CB-CD1 4.03Å; Q670-F815 HydrophobicContact CB-CE1 3.72Å; Q670-F815 HydrophobicContact CB-CE2 4.45Å; Q670-F815 HydrophobicContact CB-CZ 3.95Å; Q670-F815 VanDerWaalsContact OE1-CD2 3.3Å; Y671-F815 HydrophobicContact CD1-CD1 4.43Å; Y671-F815 AromaticContact CD1-CE1 3.5Å; Y671-F815 HydrophobicContact CD1-CE1 3.5Å; Y671-F815 HydrophobicContact CD1-CZ 4.19Å; Y671-F815 HydrophobicContact CD2-CE1 4.05Å; Y671-F815 HydrophobicContact CD2-CZ 4.03Å; Y671-F815 HydrophobicContact CE1-CD1 4.46Å; Y671-F815 AromaticContact CE1-CE1 3.55Å; Y671-F815 HydrophobicContact CE1-CE1 3.55Å; Y671-F815 AromaticContact CE1-CZ 3.95Å; Y671-F815 HydrophobicContact CE1-CZ 3.95Å; Y671-F815 HydrophobicContact CE2-CE1 4.13Å; Y671-F815 AromaticContact CE2-CZ 3.82Å; Y671-F815 HydrophobicContact CE2-CZ 3.82Å; Y671-F815 AromaticContact CG-CE1 3.75Å; Y671-F815 HydrophobicContact CG-CE1 3.75Å; Y671-F815 HydrophobicContact CG-CZ 4.21Å; Y671-F815 AromaticContact CZ-CE1 3.89Å; Y671-F815 AromaticContact CZ-CZ 3.78Å; Y813-F815 PolarHBondContact O-N 2.79Å; F815-Q817 PolarHBondContact O-N 3.19Å
816	N	77.3	Confident	75.7	Confident	36 Å²	36	83.6 Å²	83.6	19%	0.193	44%	0.441	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-13.5	-175.9	-69.5	-62.1	0	0	0	113.9	S629 Y671 D814 V818	S629-N816 WeakPolarHBondContact CB-ND2 3.44Å; S629-N816 WeakPolarHBondContact CB-OD1 3.43Å; S629-N816 PolarHBondContact OG-OD1 3.48Å; Y671-N816 PolarHBondContact OH-ND2 2.87Å; Y671-N816 VanDerWaalsContact OH-ND2 3.1Å; D814-N816 VanDerWaalsContact C-N 3.28Å; D814-N816 PolarHBondContact OD1-N 3.2Å; N816-V818 WeakPolarHBondContact O-CG2 3.28Å; N816-V818 PolarHBondContact O-N 3.29Å
817	Q	61.2	Low	74.7	Confident	165 Å²	165	88.8 Å²	88.8	77%	0.771	47%	0.469	S	S	*	.			trans	36.6	7.9	175.8	-68.4	-166	2.7	0	0	119.2	D814 F815 L819	D814-Q817 WeakPolarHBondContact O-CG 3.48Å; F815-Q817 PolarHBondContact O-N 3.19Å; Q817-L819 PolarHBondContact O-N 2.97Å
818	V	53.3	Low	73.6	Confident	117 Å²	117	90.4 Å²	90.4	71%	0.709	48%	0.484	S	S	*	.			trans	-96.6	98	176.6	178.4	0	0	0	0	105.6	N816 L820	N816-V818 WeakPolarHBondContact O-CG2 3.28Å; N816-V818 PolarHBondContact O-N 3.29Å; V818-L820 PolarHBondContact O-N 3.35Å
819	L	46	Very low	72.4	Confident	149 Å²	149	88.1 Å²	88.1	78%	0.78	47%	0.472	S	S	*	.			trans	-52.8	106.5	166	-75.9	159.7	0	0	0	107.8	Q817	Q817-L819 PolarHBondContact O-N 2.97Å
820	L	45.8	Very low	70.9	Confident	69 Å²	69	91.6 Å²	91.6	36%	0.361	48%	0.484	S	S	.	.			trans	-56	128.6	163	-74	162	0	0	0	107	I628 V818	I628-L820 HydrophobicContact CB-CD1 4.29Å; I628-L820 HydrophobicContact CD1-CD1 3.6Å; I628-L820 HydrophobicContact CD1-CD2 4.03Å; I628-L820 HydrophobicContact CD1-CG 4.47Å; I628-L820 HydrophobicContact CG1-CD1 3.76Å; V818-L820 PolarHBondContact O-N 3.35Å
821	P	35.6	Very low	69.1	Low	188 Å²	188	99.7 Å²	99.7	100%	1.221	53%	0.528	S	S	*	.			trans	-61.2	0	-177.5	24.2	-33	0	0	0	113.4

Retrieved 821 of 821 residues in 304.7 ms (Link to these results)

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