A0A077ZDZ9_TRITR Loading...

Ribosome assembly protein 1

AlphaFold DB , UniProt , Accession A0A077ZDZ9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,029 aa.

						>A0A077ZDZ9_TRITR|A0A077ZDZ9
MKRHSFAVGVVLIGEKNNSLHQAPVLLDYLKPILQARVSRHFVSMEKRYRLQSKPEFIRNVCIMAHVDHGKTSLADLLIATNGIISDRMAGKLRYMDSRIEEQERGITMKSSAISLIFENKGKSFLINLVDSPGHADFSGEVSAAAVLCDGVILVIDVVEGVCPQTIANLRLAWKEDLQLCLVLNKIDRLFTEMKMTPLEAYNRLVQVLEQANAVTGELFVSRELEDYERLSSSSVDANNSGNGNSSGAPDEEKHYFVPSSGNVAFASALDNWAFRLSDFAELWAKRLTCIDEQKLCNALWGDFYLDAKSKQPVHGASEKGKEPLFASMVLRNLASVYDAFLISGDADKAMKILKSLQISIQGAEVSRSDPRQKLQSVFGSWIPAASAVLRMVCDQLPPAGKLSQRRIERLLCGGSASSFRLLSPAAQALKPFIMNCTVADAPTIVFVSKMVPVESRLLDASIRKQATEMHYFIPDESTPCSANYVFVAFARVFTGKLVKGQKLYVIPSSSNGTHANGVEAQEVTIGDLFIMMGREYEPVESVCAGNLVCVAGVEKHILKSATLSTSLDCPSLCSLKAYAEPIVRVSVEPQQASDLPTLISGLKLLSLADPCVKAFVEDTGEHVLVTVGEMHLQRCLDDLHRRFAAGIDLKVSAPIVPFAETIIPPPEVDLANEIILPTQKPKRSSIVVRTTSQSYEFKLKALPLPLEIQQIIERNQDLLNMIDPCTNRLKVSSFPSEGTDVCQVRHRFSLLLNELKEAFMRQDSMWHGIEEKVWAFGPKKASLNMLINAVEDYNRPSVFDILCEDSVQAEYKLRQYDQSLVTGFHLRCRAGPMCDEPIRGVAFFVEDWNDLNPEATSHGESCDAHIGQIINSVKDGLRLAFEAQPQRLVMPMYTCTIQATGEVLGKVHAVLNRRGGKVFREELKDSINLFEVCASLPVVESFGFAEELRKRASGLAWPQLVFSHWEIFPVDPFWVPTTEEEVVHYGEMVDNVNLAKKYVNAVRRRKGLPVKEKLVLHAEKQRTLARKV
					

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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	31.4	Very low	31.1	Very low	242 Å²	242	155 Å²	155	100%	1.192	83%	0.833	S	S	*	*				0	117	0	-84.6	178.3	170.6	0	0	108.8
2	K	30.7	Very low	31.1	Very low	202 Å²	202	155.4 Å²	155.4	88%	0.878	83%	0.833	S	S	*	*			trans	37.6	113.8	155.8	-68.1	-177.8	-179.5	178.4	0	117.4
3	R	31.6	Very low	31.2	Very low	244 Å²	244	154.4 Å²	154.4	92%	0.921	83%	0.825	S	S	*	*				-169.2	149.1	59.8	-103.6	166.9	179.2	173.3	-0.8	111.9
4	H	30	Very low	31.2	Very low	172 Å²	172	148.4 Å²	148.4	80%	0.796	82%	0.818	S	S	*	*			trans	-59.3	152.6	-179	-61.7	-58.8	0	0	0	116.9
5	S	32.3	Very low	31.4	Very low	125 Å²	125	150.1 Å²	150.1	87%	0.874	82%	0.818	S	S	*	*			trans	-155	124.6	141	-69.2	0	0	0	0	109.2
6	F	28.7	Very low	31.5	Very low	200 Å²	200	153.1 Å²	153.1	88%	0.877	82%	0.82	S	S	*	*			trans	-66.5	124.5	-174.9	-91	-110	0	0	0	112.5
7	A	32.8	Very low	31.6	Very low	97 Å²	97	153.1 Å²	153.1	80%	0.802	82%	0.82	S	S	*	*			trans	-133.3	118.6	153.4	0	0	0	0	0	107.3	G9	A7-G9 VanDerWaalsContact C-N 3.31Å; A7-G9 PolarHBondContact O-N 3.15Å
8	V	28.8	Very low	31.7	Very low	134 Å²	134	153.2 Å²	153.2	81%	0.812	82%	0.82	S	S	*	*			trans	-75.6	89.7	174.5	179	0	0	0	0	107.2	V10	V8-V10 HydrophobicContact CG1-CG2 4.41Å
9	G	32.4	Very low	31.7	Very low	60 Å²	60	150.9 Å²	150.9	62%	0.619	82%	0.818	S	S	*	*			trans	-105.4	105.4	162.5	0	0	0	0	0	108	A7 V11	A7-G9 VanDerWaalsContact C-N 3.31Å; A7-G9 PolarHBondContact O-N 3.15Å; G9-V11 PolarHBondContact O-N 3.48Å; G9-V11 VanDerWaalsContact O-N 3.09Å
10	V	31.6	Very low	31.8	Very low	120 Å²	120	151.3 Å²	151.3	73%	0.727	82%	0.818	S	S	*	*			trans	-76.8	94.6	169.4	176.7	0	0	0	0	106.9	V8 L12	V8-V10 HydrophobicContact CG1-CG2 4.41Å; V10-L12 HydrophobicContact CG1-CD1 4.41Å; V10-L12 HydrophobicContact CG1-CG 4.03Å
11	V	31.8	Very low	32.1	Very low	109 Å²	109	153.4 Å²	153.4	66%	0.661	82%	0.822	S	S	*	*			trans	-82.9	107.2	164.6	173.5	0	0	0	0	106.7	G9 I13	G9-V11 PolarHBondContact O-N 3.48Å; G9-V11 VanDerWaalsContact O-N 3.09Å; V11-I13 HydrophobicContact CG1-CB 4.42Å; V11-I13 HydrophobicContact CG1-CD1 3.64Å; V11-I13 HydrophobicContact CG1-CG1 3.59Å
12	L	31.4	Very low	32.4	Very low	160 Å²	160	150 Å²	150	84%	0.838	80%	0.804	S	S	*	*			trans	-95.9	83.5	163	-75.9	171.5	0	0	0	108.2	V10 G14	V10-L12 HydrophobicContact CG1-CD1 4.41Å; V10-L12 HydrophobicContact CG1-CG 4.03Å; L12-G14 PolarHBondContact O-N 3.43Å
13	I	31.8	Very low	33.1	Very low	142 Å²	142	144.3 Å²	144.3	73%	0.728	79%	0.794	S	S	*	*			trans	-75.1	97.9	154.1	-67.6	161.2	0	0	0	105.1	V11	V11-I13 HydrophobicContact CG1-CB 4.42Å; V11-I13 HydrophobicContact CG1-CD1 3.64Å; V11-I13 HydrophobicContact CG1-CG1 3.59Å
14	G	31.2	Very low	33.8	Very low	70 Å²	70	137.1 Å²	137.1	72%	0.722	78%	0.78	S	S	*	*			trans	-99.1	82	172.8	0	0	0	0	0	109.6	L12	L12-G14 PolarHBondContact O-N 3.43Å
15	E	33.9	Very low	34.7	Very low	175 Å²	175	134 Å²	134	82%	0.818	77%	0.772	S	S	*	*			trans	-51.7	140.1	154.2	-78.7	-176.7	144.8	0	0	109.1	N17	E15-N17 PolarHBondContact O-N 2.76Å
16	K	33	Very low	35.4	Very low	198 Å²	198	134.3 Å²	134.3	86%	0.861	76%	0.763	S	S	*	*	S	Bend	trans	-45.6	109.8	171.7	-68.2	172.6	175.6	175.7	0	109.7
17	N	34.3	Very low	36.2	Very low	152 Å²	152	130.6 Å²	130.6	81%	0.813	75%	0.752	S	S	*	*			trans	-179.4	119.5	131.4	-87.8	-26.5	0	0	0	111.7	E15	E15-N17 PolarHBondContact O-N 2.76Å
18	N	33	Very low	37	Very low	155 Å²	155	130.6 Å²	130.6	83%	0.829	74%	0.738	S	S	*	*			trans	11	137.2	156.8	-75	-21.2	0	0	0	121.1
19	S	31.6	Very low	38.1	Very low	111 Å²	111	132.8 Å²	132.8	78%	0.776	73%	0.733	S	S	*	*			trans	94.3	89.7	155.7	72.8	0	0	0	0	118
20	L	34.3	Very low	38.8	Very low	157 Å²	157	133.9 Å²	133.9	82%	0.822	73%	0.725	S	S	*	*			trans	-165.5	89.3	145.6	-106.4	137.1	0	0	0	111	Q22	L20-Q22 PolarHBondContact O-N 2.98Å; L20-Q22 VanDerWaalsContact O-N 3.15Å
21	H	37.7	Very low	39.5	Very low	196 Å²	196	133 Å²	133	91%	0.907	71%	0.711	S	S	*	*			trans	-67.6	95.3	157.9	-83.6	-74.9	0	0	0	108.7
22	Q	38	Very low	40.1	Very low	170 Å²	170	131.3 Å²	131.3	79%	0.794	70%	0.702	S	S	*	*			trans	-168.9	13.2	160.2	-110.4	167.8	28.4	0	0	117	L20	L20-Q22 PolarHBondContact O-N 2.98Å; L20-Q22 VanDerWaalsContact O-N 3.15Å
23	A	45.3	Very low	40.9	Very low	83 Å²	83	128.5 Å²	128.5	69%	0.686	69%	0.687	S	S	*	*			trans	-89.9	10.1	-176.1	0	0	0	0	0	120.5	V25	A23-V25 PolarHBondContact O-N 3.2Å
24	P	45.8	Very low	41.4	Very low	94 Å²	94	126.5 Å²	126.5	61%	0.61	68%	0.677	S	S	*	*	H	α-helix	trans	-76	-19.5	-177.9	-12.2	27.2	0	0	0	116.1
25	V	49.4	Very low	41.7	Very low	105 Å²	105	129.2 Å²	129.2	64%	0.636	67%	0.671	S	S	*	*	H	α-helix	trans	-82.2	-28.8	-166.4	-175.5	0	0	0	0	113.6	A23 Y29	A23-V25 PolarHBondContact O-N 3.2Å; V25-Y29 PolarHBondContact O-N 3.49Å
26	L	46.1	Very low	41.9	Very low	132 Å²	132	123.2 Å²	123.2	69%	0.691	65%	0.651	S	S	*	*	H	α-helix	trans	-75.1	-31.3	-178.2	-104.5	148.1	0	0	0	113	Y29 L30	L26-Y29 PolarHBondContact O-N 2.96Å; L26-L30 WeakPolarHBondContact O-CG 3.17Å; L26-L30 PolarHBondContact O-N 2.83Å
27	L	45.8	Very low	42.3	Very low	122 Å²	122	122.5 Å²	122.5	64%	0.639	64%	0.643	S	S	*	*	H	α-helix	trans	-72.1	-37.8	-180	-128.8	107.3	0	0	0	111.9	Y29 L30 K31	L27-Y29 VanDerWaalsContact C-N 3.34Å; L27-L30 PolarHBondContact O-N 3.09Å; L27-K31 WeakPolarHBondContact O-CG 3.44Å; L27-K31 PolarHBondContact O-N 3.43Å
28	D	48.9	Very low	42.5	Very low	97 Å²	97	118.8 Å²	118.8	52%	0.519	63%	0.626	S	S	.	*	H	α-helix	trans	-72	-27.5	176.9	-77.6	-19.6	0	0	0	112.7	K31 P32	D28-K31 IonicContact OD1-NZ 2.76Å; D28-K31 PolarHBondContact OD1-NZ 3.27Å; D28-P32 WeakPolarHBondContact O-CD 3.47Å
29	Y	52.5	Low	42.3	Very low	180 Å²	180	114.7 Å²	114.7	71%	0.706	61%	0.61	S	S	*	*	H	α-helix	trans	-71.5	-35.3	171.8	-111.9	-89.4	0	0	0	113.2	V25 L26 L27	V25-Y29 PolarHBondContact O-N 3.49Å; L26-Y29 PolarHBondContact O-N 2.96Å; L27-Y29 VanDerWaalsContact C-N 3.34Å
30	L	48.4	Very low	42.8	Very low	83 Å²	83	118.9 Å²	118.9	44%	0.435	61%	0.609	S	S	.	*	H	α-helix	trans	-83.9	-25.6	-180	-70	171.8	0	0	0	113	L26 L27 I33 L34	L26-L30 WeakPolarHBondContact O-CG 3.17Å; L26-L30 PolarHBondContact O-N 2.83Å; L27-L30 PolarHBondContact O-N 3.09Å; L30-I33 PolarHBondContact O-N 3.38Å; L30-I33 VanDerWaalsContact O-N 3.09Å; L30-L34 HydrophobicContact CB-CD1 4.16Å; L30-L34 WeakPolarHBondContact O-CB 3.43Å; L30-L34 WeakPolarHBondContact O-CG 3.4Å; L30-L34 PolarHBondContact O-N 2.77Å
31	K	45.9	Very low	43.5	Very low	101 Å²	101	117.8 Å²	117.8	44%	0.439	60%	0.599	S	S	.	*	H	α-helix	trans	-48.7	-51.6	177.7	-94.7	178.4	-169.8	160.2	0	114.2	L27 D28 I33 L34 Q35	L27-K31 WeakPolarHBondContact O-CG 3.44Å; L27-K31 PolarHBondContact O-N 3.43Å; D28-K31 IonicContact OD1-NZ 2.76Å; D28-K31 PolarHBondContact OD1-NZ 3.27Å; K31-I33 VanDerWaalsContact C-N 3.33Å; K31-I33 PolarHBondContact O-N 3.44Å; K31-L34 PolarHBondContact O-N 2.86Å; K31-Q35 VanDerWaalsContact O-CB 3.23Å; K31-Q35 WeakPolarHBondContact O-CB 3.32Å; K31-Q35 VanDerWaalsContact O-CG 3.32Å; K31-Q35 WeakPolarHBondContact O-CG 3.23Å; K31-Q35 PolarHBondContact O-N 2.97Å
32	P	43.4	Very low	43.5	Very low	74 Å²	74	115.3 Å²	115.3	48%	0.481	59%	0.586	S	S	.	*	H	α-helix	trans	-67.4	-32.2	179.6	22	-30.8	0	0	0	112.9	D28 A36	D28-P32 WeakPolarHBondContact O-CD 3.47Å; P32-A36 VanDerWaalsContact O-CB 3.24Å; P32-A36 WeakPolarHBondContact O-CB 3.24Å; P32-A36 PolarHBondContact O-N 2.81Å
33	I	48.3	Very low	43.9	Very low	101 Å²	101	112 Å²	112	52%	0.518	58%	0.577	S	S	.	*	H	α-helix	trans	-70.9	-43.3	177.4	-58.9	175.6	0	0	0	110.5	L30 K31 A36 R37	L30-I33 PolarHBondContact O-N 3.38Å; L30-I33 VanDerWaalsContact O-N 3.09Å; K31-I33 VanDerWaalsContact C-N 3.33Å; K31-I33 PolarHBondContact O-N 3.44Å; I33-A36 PolarHBondContact O-N 3.22Å; I33-R37 PolarHBondContact O-N 3.42Å
34	L	42.7	Very low	44.8	Very low	100 Å²	100	110 Å²	110	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-66	-45.1	174.3	-73.9	167.1	0	0	0	110.8	L30 K31 A36 R37 V38	L30-L34 HydrophobicContact CB-CD1 4.16Å; L30-L34 WeakPolarHBondContact O-CB 3.43Å; L30-L34 WeakPolarHBondContact O-CG 3.4Å; L30-L34 PolarHBondContact O-N 2.77Å; K31-L34 PolarHBondContact O-N 2.86Å; L34-A36 VanDerWaalsContact C-N 3.33Å; L34-A36 PolarHBondContact O-N 3.43Å; L34-R37 PolarHBondContact O-N 3Å; L34-V38 WeakPolarHBondContact O-CB 3.35Å; L34-V38 WeakPolarHBondContact O-CG2 3.2Å; L34-V38 PolarHBondContact O-N 2.82Å
35	Q	36.8	Very low	45.9	Very low	128 Å²	128	109 Å²	109	60%	0.598	55%	0.546	S	S	*	.	H	α-helix	trans	-61.2	-38.7	174.3	-81	177.2	-25.1	0	0	112	K31 S39	K31-Q35 VanDerWaalsContact O-CB 3.23Å; K31-Q35 WeakPolarHBondContact O-CB 3.32Å; K31-Q35 VanDerWaalsContact O-CG 3.32Å; K31-Q35 WeakPolarHBondContact O-CG 3.23Å; K31-Q35 PolarHBondContact O-N 2.97Å; Q35-S39 WeakPolarHBondContact O-CB 3.14Å; Q35-S39 PolarHBondContact O-N 3.15Å; Q35-S39 PolarHBondContact O-OG 2.97Å
36	A	38.2	Very low	47.1	Very low	48 Å²	48	109.5 Å²	109.5	40%	0.397	54%	0.541	S	S	.	.	H	α-helix	trans	-66.7	-40.3	175.2	0	0	0	0	0	112.2	P32 I33 L34 R40	P32-A36 VanDerWaalsContact O-CB 3.24Å; P32-A36 WeakPolarHBondContact O-CB 3.24Å; P32-A36 PolarHBondContact O-N 2.81Å; I33-A36 PolarHBondContact O-N 3.22Å; L34-A36 VanDerWaalsContact C-N 3.33Å; L34-A36 PolarHBondContact O-N 3.43Å; A36-R40 WeakPolarHBondContact O-CB 3.32Å; A36-R40 VanDerWaalsContact O-CG 3.32Å; A36-R40 WeakPolarHBondContact O-CG 3.45Å; A36-R40 PolarHBondContact O-N 3.42Å
37	R	42.7	Very low	48.8	Very low	183 Å²	183	106 Å²	106	69%	0.691	52%	0.521	S	S	*	.	H	α-helix	trans	-66.7	-45.6	175.2	-96.2	-176.8	164.6	178.3	-5.1	112.3	I33 L34 R40 H41	I33-R37 PolarHBondContact O-N 3.42Å; L34-R37 PolarHBondContact O-N 3Å; R37-R40 PolarHBondContact O-N 2.96Å; R37-H41 PolarHBondContact O-N 3.42Å
38	V	37.1	Very low	50.5	Low	74 Å²	74	101.1 Å²	101.1	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-63.4	-46.4	177	173.2	0	0	0	0	109.9	L34 R40 H41 F42	L34-V38 WeakPolarHBondContact O-CB 3.35Å; L34-V38 WeakPolarHBondContact O-CG2 3.2Å; L34-V38 PolarHBondContact O-N 2.82Å; V38-R40 PolarHBondContact O-N 2.96Å; V38-H41 WeakPolarHBondContact O-CB 3.46Å; V38-H41 PolarHBondContact O-N 3.5Å; V38-H41 VanDerWaalsContact O-N 3.15Å; V38-F42 HydrophobicContact CG1-CD2 3.57Å; V38-F42 HydrophobicContact CG1-CE2 3.66Å; V38-F42 WeakPolarHBondContact O-CD2 3.48Å; V38-F42 PolarHBondContact O-N 2.85Å
39	S	29.8	Very low	52.1	Low	70 Å²	70	102.4 Å²	102.4	49%	0.49	49%	0.492	S	S	.	.	H	α-helix	trans	-62	-39.4	176.1	-71.4	0	0	0	0	112.9	Q35 H41 F42 V43	Q35-S39 WeakPolarHBondContact O-CB 3.14Å; Q35-S39 PolarHBondContact O-N 3.15Å; Q35-S39 PolarHBondContact O-OG 2.97Å; S39-H41 VanDerWaalsContact C-N 3.34Å; S39-H41 PolarHBondContact O-N 3.01Å; S39-F42 PolarHBondContact O-N 3.09Å; S39-V43 WeakPolarHBondContact O-CB 3.38Å; S39-V43 VanDerWaalsContact O-CG2 3.25Å; S39-V43 WeakPolarHBondContact O-CG2 3.43Å; S39-V43 PolarHBondContact O-N 3Å
40	R	42.5	Very low	53.7	Low	199 Å²	199	101.4 Å²	101.4	75%	0.751	49%	0.487	S	S	*	.	H	α-helix	trans	-62.7	-40.9	173.5	-78	-179.8	-172.5	-176.8	3.1	111.8	A36 R37 V38 S44	A36-R40 WeakPolarHBondContact O-CB 3.32Å; A36-R40 VanDerWaalsContact O-CG 3.32Å; A36-R40 WeakPolarHBondContact O-CG 3.45Å; A36-R40 PolarHBondContact O-N 3.42Å; R37-R40 PolarHBondContact O-N 2.96Å; V38-R40 PolarHBondContact O-N 2.96Å; R40-S44 WeakPolarHBondContact O-CB 3.25Å; R40-S44 PolarHBondContact O-N 3.45Å; R40-S44 VanDerWaalsContact O-N 3.11Å; R40-S44 PolarHBondContact O-OG 3.32Å
41	H	48.4	Very low	55.6	Low	133 Å²	133	98.3 Å²	98.3	62%	0.616	47%	0.471	S	S	*	.	H	α-helix	trans	-63.7	-50.2	174.4	-106.4	73.3	0	0	0	111.6	R37 V38 S39 V43 S44 M45	R37-H41 PolarHBondContact O-N 3.42Å; V38-H41 WeakPolarHBondContact O-CB 3.46Å; V38-H41 PolarHBondContact O-N 3.5Å; V38-H41 VanDerWaalsContact O-N 3.15Å; S39-H41 VanDerWaalsContact C-N 3.34Å; S39-H41 PolarHBondContact O-N 3.01Å; H41-V43 PolarHBondContact O-N 2.98Å; H41-S44 WeakPolarHBondContact O-CB 3.28Å; H41-S44 PolarHBondContact O-N 3.13Å; H41-S44 VanDerWaalsContact O-N 3.11Å; H41-S44 PolarHBondContact O-OG 3.19Å; H41-M45 VanDerWaalsContact O-CG 3.28Å; H41-M45 WeakPolarHBondContact O-CG 3.34Å; H41-M45 PolarHBondContact O-N 3.21Å; H41-M45 VanDerWaalsContact O-N 3.08Å
42	F	38	Very low	57.4	Low	145 Å²	145	94 Å²	94	64%	0.636	45%	0.452	S	S	*	.	H	α-helix	trans	-60.7	-44.2	180	-92	-85.5	0	0	0	113	V38 S39 S44 M45 E46	V38-F42 HydrophobicContact CG1-CD2 3.57Å; V38-F42 HydrophobicContact CG1-CE2 3.66Å; V38-F42 WeakPolarHBondContact O-CD2 3.48Å; V38-F42 PolarHBondContact O-N 2.85Å; S39-F42 PolarHBondContact O-N 3.09Å; F42-S44 VanDerWaalsContact C-N 3.26Å; F42-S44 PolarHBondContact O-N 3.4Å; F42-M45 PolarHBondContact O-N 3.23Å; F42-E46 PolarHBondContact O-N 3.03Å
43	V	45.4	Very low	59.5	Low	100 Å²	100	93 Å²	93	61%	0.606	45%	0.448	S	S	*	.	H	α-helix	trans	-64.2	-33.7	176.5	173.9	0	0	0	0	111.2	S39 H41 K47	S39-V43 WeakPolarHBondContact O-CB 3.38Å; S39-V43 VanDerWaalsContact O-CG2 3.25Å; S39-V43 WeakPolarHBondContact O-CG2 3.43Å; S39-V43 PolarHBondContact O-N 3Å; H41-V43 PolarHBondContact O-N 2.98Å; V43-K47 WeakPolarHBondContact O-CB 3.3Å; V43-K47 PolarHBondContact O-N 2.64Å
44	S	65	Low	61.4	Low	42 Å²	42	93.8 Å²	93.8	29%	0.294	45%	0.447	S	S	.	.	H	α-helix	trans	-69.6	-33.3	177.5	78.2	0	0	0	0	113.1	R40 H41 F42 R48	R40-S44 WeakPolarHBondContact O-CB 3.25Å; R40-S44 PolarHBondContact O-N 3.45Å; R40-S44 VanDerWaalsContact O-N 3.11Å; R40-S44 PolarHBondContact O-OG 3.32Å; H41-S44 WeakPolarHBondContact O-CB 3.28Å; H41-S44 PolarHBondContact O-N 3.13Å; H41-S44 VanDerWaalsContact O-N 3.11Å; H41-S44 PolarHBondContact O-OG 3.19Å; F42-S44 VanDerWaalsContact C-N 3.26Å; F42-S44 PolarHBondContact O-N 3.4Å; S44-R48 WeakPolarHBondContact O-CB 3.32Å; S44-R48 PolarHBondContact O-N 3.11Å
45	M	68.6	Low	63.5	Low	71 Å²	71	90.1 Å²	90.1	35%	0.35	43%	0.429	S	S	.	.	H	α-helix	trans	-69.5	-49.6	-179.1	-68.2	-74.4	-68.6	0	0	112.2	H41 F42 K47 R48 Y49 E538	H41-M45 VanDerWaalsContact O-CG 3.28Å; H41-M45 WeakPolarHBondContact O-CG 3.34Å; H41-M45 PolarHBondContact O-N 3.21Å; H41-M45 VanDerWaalsContact O-N 3.08Å; F42-M45 PolarHBondContact O-N 3.23Å; M45-K47 VanDerWaalsContact C-N 3.27Å; M45-K47 PolarHBondContact O-N 3.08Å; M45-R48 WeakPolarHBondContact O-CB 3.46Å; M45-R48 PolarHBondContact O-N 2.66Å; M45-Y49 PolarHBondContact O-N 3.22Å; M45-E538 HydrophobicContact CE-CG 3.94Å; M45-E538 WeakPolarHBondContact CE-OE1 3.35Å; M45-E538 VanDerWaalsContact SD-CD 3.54Å; M45-E538 VanDerWaalsContact SD-OE1 3.32Å
46	E	75	Confident	66	Low	116 Å²	116	90.3 Å²	90.3	54%	0.542	43%	0.43	S	S	.	.	H	α-helix	trans	-60.9	-40.5	175.7	-72.3	-171	-168	0	0	111.5	F42 Y49 R50	F42-E46 PolarHBondContact O-N 3.03Å; E46-Y49 PolarHBondContact O-N 3.37Å; E46-R50 VanDerWaalsContact O-CG 3.3Å; E46-R50 WeakPolarHBondContact O-CG 3.07Å; E46-R50 PolarHBondContact O-N 3.43Å; E46-R50 IonicContact OE2-CZ 2.96Å; E46-R50 IonicContact OE2-NH2 3.01Å; E46-R50 PolarHBondContact OE2-NH2 3.09Å
47	K	81.9	Confident	68.6	Low	60 Å²	60	90.2 Å²	90.2	26%	0.261	42%	0.421	S	S	.	.	H	α-helix	trans	-62.7	-43.5	176.7	-171.5	176.4	-177.5	179.4	0	111.1	V43 M45 R50 L51 I117 E119 S124	V43-K47 WeakPolarHBondContact O-CB 3.3Å; V43-K47 PolarHBondContact O-N 2.64Å; M45-K47 VanDerWaalsContact C-N 3.27Å; M45-K47 PolarHBondContact O-N 3.08Å; K47-R50 PolarHBondContact O-N 2.98Å; K47-L51 HydrophobicContact CG-CD1 4.3Å; K47-L51 WeakPolarHBondContact O-CG 3.45Å; K47-L51 PolarHBondContact O-N 3.03Å; K47-I117 HydrophobicContact CD-CG2 4.45Å; K47-E119 IonicContact NZ-OE1 3.99Å; K47-E119 PolarHBondContact NZ-OE1 3.11Å; K47-S124 WeakPolarHBondContact CE-OG 3.32Å; K47-S124 PolarHBondContact NZ-OG 3.47Å
48	R	81.7	Confident	71	Confident	19 Å²	19	81.5 Å²	81.5	7%	0.072	39%	0.388	C	S	.	.	H	α-helix	trans	-57.9	-51.3	174.1	-179.8	177.9	-83.9	153.1	-0.7	110.8	S44 M45 R50 L51 Q52 S115 I117 L126 M533 E538	S44-R48 WeakPolarHBondContact O-CB 3.32Å; S44-R48 PolarHBondContact O-N 3.11Å; M45-R48 WeakPolarHBondContact O-CB 3.46Å; M45-R48 PolarHBondContact O-N 2.66Å; R48-R50 VanDerWaalsContact C-N 3.31Å; R48-R50 PolarHBondContact O-N 3.37Å; R48-L51 PolarHBondContact O-N 3.37Å; R48-Q52 HydrophobicContact CG-CG 4.2Å; R48-Q52 WeakPolarHBondContact O-CG 2.83Å; R48-Q52 PolarHBondContact O-N 3.31Å; R48-S115 PolarHBondContact NH2-O 2.88Å; R48-I117 HydrophobicContact CB-CD1 4.13Å; R48-L126 HydrophobicContact CG-CD1 4.11Å; R48-M533 PolarHBondContact NH2-SD 3.37Å; R48-M533 VanDerWaalsContact NH2-SD 3.36Å; R48-E538 IonicContact CZ-OE2 3.61Å; R48-E538 IonicContact NH1-OE2 2.73Å; R48-E538 PolarHBondContact NH1-OE2 3.31Å
49	Y	82.1	Confident	73.7	Confident	123 Å²	123	78.9 Å²	78.9	48%	0.482	37%	0.37	S	S	.	.	H	α-helix	trans	-58.6	-42.5	-180	-175.1	-102.3	0	0	0	112.3	M45 E46 L51 Q52 S53	M45-Y49 PolarHBondContact O-N 3.22Å; E46-Y49 PolarHBondContact O-N 3.37Å; Y49-L51 VanDerWaalsContact C-N 3.34Å; Y49-L51 PolarHBondContact O-N 3.37Å; Y49-Q52 PolarHBondContact O-N 3.24Å; Y49-S53 PolarHBondContact O-N 3.37Å
50	R	86.4	Confident	76.9	Confident	160 Å²	160	75.6 Å²	75.6	60%	0.604	35%	0.347	S	S	*	.	H	α-helix	trans	-62	-40	174.8	-70.3	176.1	-163.4	176.5	10.5	112.2	E46 K47 R48 S53	E46-R50 VanDerWaalsContact O-CG 3.3Å; E46-R50 WeakPolarHBondContact O-CG 3.07Å; E46-R50 PolarHBondContact O-N 3.43Å; E46-R50 IonicContact OE2-CZ 2.96Å; E46-R50 IonicContact OE2-NH2 3.01Å; E46-R50 PolarHBondContact OE2-NH2 3.09Å; K47-R50 PolarHBondContact O-N 2.98Å; R48-R50 VanDerWaalsContact C-N 3.31Å; R48-R50 PolarHBondContact O-N 3.37Å; R50-S53 PolarHBondContact O-OG 3.47Å
51	L	87.3	Confident	79.4	Confident	18 Å²	18	66.1 Å²	66.1	9%	0.094	31%	0.311	C	S	.	.	H	α-helix	trans	-71.6	-38.7	177.3	-68.6	171.6	0	0	0	112.4	K47 R48 Y49 S53 K54 F57 I117 S124 L126	K47-L51 HydrophobicContact CG-CD1 4.3Å; K47-L51 WeakPolarHBondContact O-CG 3.45Å; K47-L51 PolarHBondContact O-N 3.03Å; R48-L51 PolarHBondContact O-N 3.37Å; Y49-L51 VanDerWaalsContact C-N 3.34Å; Y49-L51 PolarHBondContact O-N 3.37Å; L51-S53 PolarHBondContact O-N 3.49Å; L51-K54 PolarHBondContact O-N 3.37Å; L51-F57 HydrophobicContact CD2-CB 4.12Å; L51-F57 HydrophobicContact CD2-CG 4.5Å; L51-I117 HydrophobicContact CD1-CG2 4.13Å; L51-S124 VanDerWaalsContact CD2-O 3.25Å; L51-S124 WeakPolarHBondContact CD2-O 3.45Å; L51-L126 HydrophobicContact CB-CB 4.06Å
52	Q	85.2	Confident	81.6	Confident	9 Å²	9	59.8 Å²	59.8	4%	0.042	28%	0.282	C	S	.	.	H	α-helix	trans	-59.3	-29.7	175.8	-74.9	-179.4	-19.2	0	0	112.4	R48 Y49 K54 L126 N547	R48-Q52 HydrophobicContact CG-CG 4.2Å; R48-Q52 WeakPolarHBondContact O-CG 2.83Å; R48-Q52 PolarHBondContact O-N 3.31Å; Y49-Q52 PolarHBondContact O-N 3.24Å; Q52-K54 PolarHBondContact O-N 2.92Å; Q52-L126 HydrophobicContact CB-CD2 4.36Å; Q52-L126 HydrophobicContact CG-CD2 3.39Å; Q52-N547 WeakPolarHBondContact CG-OD1 3.3Å; Q52-N547 PolarHBondContact O-ND2 3.47Å
53	S	85.7	Confident	84.3	Confident	55 Å²	55	52.9 Å²	52.9	39%	0.385	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-15.6	176.8	74.5	0	0	0	0	114.2	Y49 R50 L51	Y49-S53 PolarHBondContact O-N 3.37Å; R50-S53 PolarHBondContact O-OG 3.47Å; L51-S53 PolarHBondContact O-N 3.49Å
54	K	88.9	Confident	86.7	Confident	116 Å²	116	48.2 Å²	48.2	50%	0.504	22%	0.223	S	C	.	.			trans	-118.4	99.2	-173.4	-64.4	-174.2	-179.6	-175.5	0	111.3	L51 Q52 E56 F57	L51-K54 PolarHBondContact O-N 3.37Å; Q52-K54 PolarHBondContact O-N 2.92Å; K54-E56 PolarHBondContact O-N 3.35Å; K54-F57 HydrophobicContact CB-CD2 3.82Å; K54-F57 HydrophobicContact CB-CE2 4.49Å; K54-F57 HydrophobicContact CD-CD2 4.08Å; K54-F57 HydrophobicContact CD-CE2 4.09Å; K54-F57 PolarHBondContact O-N 3.41Å; K54-F57 VanDerWaalsContact O-N 3.09Å
55	P	87.6	Confident	88	Confident	23 Å²	23	46.2 Å²	46.2	15%	0.149	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-61.8	-20.9	-174.7	23.9	-33.8	0	0	0	114.5	F57 I58 A400 C437	P55-F57 VanDerWaalsContact C-N 3.25Å; P55-F57 PolarHBondContact O-N 3.17Å; P55-I58 PolarHBondContact O-N 2.83Å; P55-A400 PolarHBondContact O-N 3.41Å; P55-C437 HydrophobicContact CB-CB 3.84Å; P55-C437 HydrophobicContact CG-CB 4.03Å
56	E	89.7	Confident	88.8	Confident	132 Å²	132	43.6 Å²	43.6	62%	0.617	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-62.6	-29.6	176	-60.4	-176.2	169.3	0	0	113.7	K54 R59 P399	K54-E56 PolarHBondContact O-N 3.35Å; E56-R59 PolarHBondContact O-NH1 2.76Å; E56-P399 WeakPolarHBondContact O-CB 3.39Å
57	F	91.6	Very high	89.3	Confident	46 Å²	46	39.1 Å²	39.1	20%	0.202	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-99.7	5.6	-177	-62.1	-74.3	0	0	0	112.9	L51 K54 P55 K123 S124 F125 L126	L51-F57 HydrophobicContact CD2-CB 4.12Å; L51-F57 HydrophobicContact CD2-CG 4.5Å; K54-F57 HydrophobicContact CB-CD2 3.82Å; K54-F57 HydrophobicContact CB-CE2 4.49Å; K54-F57 HydrophobicContact CD-CD2 4.08Å; K54-F57 HydrophobicContact CD-CE2 4.09Å; K54-F57 PolarHBondContact O-N 3.41Å; K54-F57 VanDerWaalsContact O-N 3.09Å; P55-F57 VanDerWaalsContact C-N 3.25Å; P55-F57 PolarHBondContact O-N 3.17Å; F57-K123 HydrophobicContact CE1-CB 4.4Å; F57-K123 HydrophobicContact CE1-CD 4.3Å; F57-S124 WeakPolarHBondContact CD1-O 3.28Å; F57-F125 HydrophobicContact CD1-CD1 4.24Å; F57-F125 HydrophobicContact CD1-CE1 4.1Å; F57-F125 CarbonylContact O-C 3.59Å; F57-F125 WeakPolarHBondContact O-CA 3.45Å; F57-L126 PolarHBondContact O-N 3.49Å
58	I	93.2	Very high	89.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	136.7	179.8	-55.6	174.1	0	0	0	109.4	P55 L126 A400 N547	P55-I58 PolarHBondContact O-N 2.83Å; I58-L126 CarbonylContact C-O 3.6Å; I58-L126 VanDerWaalsContact CA-O 3.32Å; I58-L126 WeakPolarHBondContact CA-O 3.11Å; I58-L126 HydrophobicContact CG1-CB 4.49Å; I58-L126 HydrophobicContact CG1-CD2 4.38Å; I58-A400 HydrophobicContact CB-CB 4.13Å; I58-A400 HydrophobicContact CG2-CB 4.24Å; I58-A400 PolarHBondContact O-N 3.3Å; I58-N547 WeakPolarHBondContact CD1-ND2 3.37Å; I58-N547 WeakPolarHBondContact CD1-OD1 3.34Å
59	R	94.8	Very high	89.9	Confident	20 Å²	20	40.3 Å²	40.3	8%	0.075	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	118.7	169.1	-63.3	-62.1	-179	-77.8	0.8	109.1	E56 V61 L126 I127 N128 V393 L397 P398 P399	E56-R59 PolarHBondContact O-NH1 2.76Å; R59-V61 HydrophobicContact CB-CG2 4.12Å; R59-L126 PolarHBondContact N-O 3.3Å; R59-I127 HydrophobicContact CB-CG1 4.37Å; R59-I127 CarbonylContact O-C 3.36Å; R59-I127 WeakPolarHBondContact O-CA 3.42Å; R59-N128 PolarHBondContact O-N 3.47Å; R59-V393 HydrophobicContact CB-CG1 4.08Å; R59-V393 HydrophobicContact CG-CG1 4.24Å; R59-L397 PolarHBondContact NE-O 2.95Å; R59-P398 WeakPolarHBondContact CD-O 3.41Å; R59-P398 PolarHBondContact NE-O 2.98Å; R59-P399 VanDerWaalsContact NH1-CA 3.26Å; R59-P399 VanDerWaalsContact NH1-CB 3.33Å
60	N	95.2	Very high	90.3	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.3	172.2	-55.3	-55.8	0	0	0	108.5	N128 D150 G151 G546	N60-N128 WeakPolarHBondContact OD1-CB 3.4Å; N60-N128 PolarHBondContact OD1-ND2 2.74Å; N60-D150 WeakPolarHBondContact CB-OD2 3.27Å; N60-D150 PolarHBondContact ND2-OD2 2.94Å; N60-D150 PolarHBondContact O-N 2.62Å; N60-G151 PolarHBondContact O-N 2.9Å; N60-G546 PolarHBondContact ND2-O 3.06Å; N60-G546 PolarHBondContact OD1-O 2.71Å
61	V	95.2	Very high	90.5	Very high	1 Å²	1	28 Å²	28	1%	0.006	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	132.6	-169.5	-172.4	0	0	0	0	109.9	R59 I127 N128 L129 V130 G151 I153 V393 L397	R59-V61 HydrophobicContact CB-CG2 4.12Å; V61-I127 HydrophobicContact CG2-CG2 4.32Å; V61-N128 PolarHBondContact N-O 2.91Å; V61-L129 CarbonylContact O-C 3.55Å; V61-L129 WeakPolarHBondContact O-CA 3.49Å; V61-V130 PolarHBondContact O-N 2.68Å; V61-G151 WeakPolarHBondContact CA-O 3.34Å; V61-I153 HydrophobicContact CG1-CD1 3.72Å; V61-I153 HydrophobicContact CG1-CG1 3.63Å; V61-V393 HydrophobicContact CG1-CG2 4.48Å; V61-V393 HydrophobicContact CG2-CG1 3.76Å; V61-L397 HydrophobicContact CB-CD1 4.27Å; V61-L397 HydrophobicContact CG1-CD1 3.84Å; V61-L397 HydrophobicContact CG2-CD1 3.47Å; V61-L397 VanDerWaalsContact CG2-CD1 3.47Å
62	C	95	Very high	90.6	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	144.5	168.3	57.8	0	0	0	0	111.5	V130 C149 G151 V152 I153	C62-V130 CarbonylContact C-O 3.5Å; C62-V130 VanDerWaalsContact CA-O 3.25Å; C62-V130 WeakPolarHBondContact CA-O 3.38Å; C62-V130 HydrophobicContact CB-CB 4.19Å; C62-C149 HydrophobicContact CB-CB 4.12Å; C62-G151 PolarHBondContact N-O 3.19Å; C62-G151 VanDerWaalsContact N-O 3.1Å; C62-V152 CarbonylContact O-C 3.6Å; C62-V152 WeakPolarHBondContact O-CA 3.25Å; C62-I153 PolarHBondContact O-N 2.88Å
63	I	95.5	Very high	90.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	122	169.9	-55.3	176.3	0	0	0	107.5	K71 A75 L78 L129 V130 S132 I153 V155	I63-K71 HydrophobicContact CG2-CB 3.79Å; I63-A75 HydrophobicContact CD1-CB 3.83Å; I63-L78 HydrophobicContact CD1-CD1 4.41Å; I63-L129 HydrophobicContact CD1-CD1 3.86Å; I63-L129 HydrophobicContact CD1-CD2 4.06Å; I63-L129 HydrophobicContact CD1-CG 4.21Å; I63-L129 HydrophobicContact CG1-CD1 3.7Å; I63-L129 HydrophobicContact CG1-CG 4.42Å; I63-V130 PolarHBondContact N-O 3.19Å; I63-S132 PolarHBondContact O-OG 3.21Å; I63-I153 WeakPolarHBondContact CA-O 3.14Å; I63-I153 HydrophobicContact CG1-CB 4.38Å; I63-I153 HydrophobicContact CG1-CD1 4.36Å; I63-V155 HydrophobicContact CG2-CG2 3.77Å
64	M	94.4	Very high	91.1	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	134.9	174.6	-68.4	-174.1	-176.6	0	0	109.6	V142 A146 V152 I153 L154 V155 N169 L172 L178	M64-V142 HydrophobicContact CE-CG1 3.95Å; M64-V142 HydrophobicContact CG-CG1 4.26Å; M64-V142 HydrophobicContact SD-CG1 4.23Å; M64-A146 HydrophobicContact CE-CB 3.49Å; M64-A146 VanDerWaalsContact CE-CB 3.49Å; M64-V152 HydrophobicContact CB-CG1 3.68Å; M64-V152 HydrophobicContact CE-CG1 4.49Å; M64-V152 HydrophobicContact CE-CG2 4.15Å; M64-V152 HydrophobicContact CG-CG1 3.6Å; M64-V152 HydrophobicContact SD-CG1 3.71Å; M64-V152 HydrophobicContact SD-CG2 4.22Å; M64-I153 PolarHBondContact N-O 2.58Å; M64-L154 HydrophobicContact CB-CD1 4.4Å; M64-L154 WeakPolarHBondContact O-CA 3.32Å; M64-V155 PolarHBondContact O-N 3Å; M64-N169 HydrophobicContact CB-CB 4.14Å; M64-N169 HydrophobicContact SD-CB 3.93Å; M64-L172 HydrophobicContact CE-CD2 4.15Å; M64-L178 HydrophobicContact CE-CD1 4.43Å
65	A	92.6	Very high	91.3	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	166.3	178.5	0	0	0	0	0	110.6	H69 K71 G134 V155 N169	A65-H69 HydrophobicContact CB-CB 3.95Å; A65-K71 HydrophobicContact CB-CB 3.76Å; A65-K71 HydrophobicContact CB-CD 4.21Å; A65-K71 HydrophobicContact CB-CG 4.5Å; A65-G134 VanDerWaalsContact O-CA 3.28Å; A65-G134 WeakPolarHBondContact O-CA 3.46Å; A65-V155 HydrophobicContact CB-CB 3.86Å; A65-N169 PolarHBondContact N-ND2 3.08Å; A65-N169 PolarHBondContact O-ND2 3.35Å
66	H	87.1	Confident	91.3	Very high	17 Å²	17	19.1 Å²	19.1	8%	0.079	10%	0.099	C	C	.	.			trans	-71.5	169.4	161.4	-168.1	34	0	0	0	110.6	H69 C163 Q165 Q960	H66-H69 VanDerWaalsContact CB-CE1 3.47Å; H66-H69 WeakPolarHBondContact CB-CE1 3.06Å; H66-H69 AromaticContact CD2-NE2 3.75Å; H66-H69 PolarHBondContact O-N 3.22Å; H66-C163 HydrophobicContact CB-CB 4.27Å; H66-C163 VanDerWaalsContact CD2-CB 3.45Å; H66-C163 WeakPolarHBondContact CD2-CB 3.35Å; H66-Q165 HydrophobicContact CB-CB 4.16Å; H66-Q165 VanDerWaalsContact ND1-CB 3.31Å; H66-Q165 WeakPolarHBondContact ND1-CB 3.3Å; H66-Q960 PolarHBondContact CE1-OE1 3.39Å
67	V	85.1	Confident	91.3	Very high	22 Å²	22	13.2 Å²	13.2	13%	0.133	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	141	175.6	-174.6	0	0	0	0	108.9	H69 I107 G134 H135	V67-H69 PolarHBondContact O-N 3.44Å; V67-I107 HydrophobicContact CG1-CG2 3.92Å; V67-G134 VanDerWaalsContact CG2-O 3.27Å; V67-G134 WeakPolarHBondContact CG2-O 3.25Å; V67-G134 PolarHBondContact N-O 3.26Å; V67-H135 HydrophobicContact CG2-CB 3.8Å
68	D	86.1	Confident	91.2	Very high	102 Å²	102	11 Å²	11	55%	0.545	6%	0.062	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	7.3	179.9	-159.1	49.1	0	0	0	117.4	G70 K186	D68-G70 PolarHBondContact O-N 3.01Å; D68-K186 WeakPolarHBondContact O-CE 3.33Å; D68-K186 PolarHBondContact O-NZ 3.38Å; D68-K186 IonicContact OD2-NZ 3.24Å; D68-K186 PolarHBondContact OD2-NZ 3.36Å
69	H	90.3	Very high	91	Very high	1 Å²	1	11 Å²	11	1%	0.005	6%	0.062	C	C	.	.	S	Bend	trans	-67.3	0.7	171.9	-79.9	-158.8	0	0	0	114.3	A65 H66 V67 V155 D157 E160 N185	A65-H69 HydrophobicContact CB-CB 3.95Å; H66-H69 VanDerWaalsContact CB-CE1 3.47Å; H66-H69 WeakPolarHBondContact CB-CE1 3.06Å; H66-H69 AromaticContact CD2-NE2 3.75Å; H66-H69 PolarHBondContact O-N 3.22Å; V67-H69 PolarHBondContact O-N 3.44Å; H69-V155 PolarHBondContact ND1-O 2.83Å; H69-V155 VanDerWaalsContact ND1-O 3.12Å; H69-V155 VanDerWaalsContact O-CG1 3.3Å; H69-V155 WeakPolarHBondContact O-CG1 3.38Å; H69-D157 PolarHBondContact ND1-N 3.06Å; H69-E160 IonicContact CD2-OE2 3.87Å; H69-E160 IonicContact NE2-OE2 2.86Å; H69-E160 PolarHBondContact NE2-OE2 3.46Å; H69-N185 PolarHBondContact O-ND2 3.14Å
70	G	88.7	Confident	90.5	Very high	11 Å²	11	10.3 Å²	10.3	11%	0.113	6%	0.06	C	C	.	.	S	Bend	trans	89.2	19.6	175.7	0	0	0	0	0	115.5	D68 T72 S73 L74	D68-G70 PolarHBondContact O-N 3.01Å; G70-T72 PolarHBondContact O-N 2.92Å; G70-S73 PolarHBondContact O-N 3.33Å; G70-L74 WeakPolarHBondContact O-CB 3.25Å; G70-L74 PolarHBondContact O-N 3.06Å
71	K	91.4	Very high	89.8	Confident	14 Å²	14	13.7 Å²	13.7	6%	0.061	8%	0.081	C	C	.	.	H	α-helix	trans	-53.6	-47.8	178.4	74.1	-167.3	-160.4	-44.5	0	113.6	I63 A65 L74 A75 T108 S132	I63-K71 HydrophobicContact CG2-CB 3.79Å; A65-K71 HydrophobicContact CB-CB 3.76Å; A65-K71 HydrophobicContact CB-CD 4.21Å; A65-K71 HydrophobicContact CB-CG 4.5Å; K71-L74 WeakPolarHBondContact O-CB 3.45Å; K71-L74 PolarHBondContact O-N 3.43Å; K71-A75 PolarHBondContact O-N 3.46Å; K71-T108 WeakPolarHBondContact CE-OG1 3.45Å; K71-T108 PolarHBondContact NZ-OG1 3.08Å; K71-S132 WeakPolarHBondContact CE-O 3.39Å
72	T	89.3	Confident	89	Confident	7 Å²	7	16 Å²	16	4%	0.043	9%	0.093	C	C	.	.	H	α-helix	trans	-75.6	-36.2	-175.1	-49.4	0	0	0	0	110.6	G70 L74 A75 D76 R94 T108	G70-T72 PolarHBondContact O-N 2.92Å; T72-L74 VanDerWaalsContact C-N 3.33Å; T72-A75 WeakPolarHBondContact O-CB 2.97Å; T72-A75 PolarHBondContact O-N 3.36Å; T72-D76 PolarHBondContact O-N 3.14Å; T72-R94 HydrophobicContact CG2-CB 3.76Å; T72-R94 HydrophobicContact CG2-CG 3.82Å; T72-T108 PolarHBondContact OG1-OG1 2.86Å; T72-T108 VanDerWaalsContact OG1-OG1 3.05Å
73	S	90.3	Very high	88	Confident	28 Å²	28	19 Å²	19	20%	0.196	13%	0.125	C	C	.	.	H	α-helix	trans	-63.8	-41.2	172.1	-57.7	0	0	0	0	111.2	G70 D76 L77 G91	G70-S73 PolarHBondContact O-N 3.33Å; S73-D76 PolarHBondContact O-N 2.67Å; S73-L77 WeakPolarHBondContact O-CG 3.08Å; S73-L77 PolarHBondContact O-N 3.22Å; S73-G91 PolarHBondContact OG-O 2.85Å
74	L	92.3	Very high	87	Confident	0 Å²	0	22 Å²	22	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63	-45.2	173	-176.5	65.1	0	0	0	111.2	G70 K71 T72 D76 L77 L78 I153 V155 V183 A269 V389	G70-L74 WeakPolarHBondContact O-CB 3.25Å; G70-L74 PolarHBondContact O-N 3.06Å; K71-L74 WeakPolarHBondContact O-CB 3.45Å; K71-L74 PolarHBondContact O-N 3.43Å; T72-L74 VanDerWaalsContact C-N 3.33Å; L74-D76 PolarHBondContact O-N 2.96Å; L74-L77 WeakPolarHBondContact O-CB 3.47Å; L74-L77 PolarHBondContact O-N 2.69Å; L74-L78 WeakPolarHBondContact O-CG 3.37Å; L74-L78 PolarHBondContact O-N 2.82Å; L74-L78 VanDerWaalsContact O-N 3.1Å; L74-I153 HydrophobicContact CD2-CG2 4.21Å; L74-V155 HydrophobicContact CD2-CG2 3.74Å; L74-V183 HydrophobicContact CD2-CG1 4.31Å; L74-V183 HydrophobicContact CD2-CG2 4.46Å; L74-A269 HydrophobicContact CB-CB 4.21Å; L74-A269 HydrophobicContact CD1-CB 4.44Å; L74-V389 HydrophobicContact CD1-CG2 4.33Å
75	A	91.3	Very high	86	Confident	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-56.4	-48	176.2	0	0	0	0	0	111.7	I63 K71 T72 L77 L78 I79 M96	I63-A75 HydrophobicContact CD1-CB 3.83Å; K71-A75 PolarHBondContact O-N 3.46Å; T72-A75 WeakPolarHBondContact O-CB 2.97Å; T72-A75 PolarHBondContact O-N 3.36Å; A75-L77 VanDerWaalsContact C-N 3.29Å; A75-L77 PolarHBondContact O-N 2.98Å; A75-L78 WeakPolarHBondContact O-CB 3.41Å; A75-L78 PolarHBondContact O-N 2.62Å; A75-L78 VanDerWaalsContact O-N 3.12Å; A75-I79 WeakPolarHBondContact O-CG1 3.46Å; A75-I79 PolarHBondContact O-N 3.03Å; A75-M96 HydrophobicContact CB-CG 4.46Å
76	D	89.1	Confident	85.1	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-58.4	-39.1	177.4	-78.1	-11	0	0	0	112.7	T72 S73 L74 I79 A80 R94 Y95	T72-D76 PolarHBondContact O-N 3.14Å; S73-D76 PolarHBondContact O-N 2.67Å; L74-D76 PolarHBondContact O-N 2.96Å; D76-I79 PolarHBondContact O-N 2.87Å; D76-A80 WeakPolarHBondContact O-CB 3.22Å; D76-A80 PolarHBondContact O-N 3.27Å; D76-R94 WeakPolarHBondContact OD2-CA 3.46Å; D76-R94 PolarHBondContact OD2-N 3.38Å; D76-Y95 WeakPolarHBondContact OD1-CB 3.44Å; D76-Y95 PolarHBondContact OD1-N 3.01Å
77	L	88.8	Confident	84.4	Confident	8 Å²	8	30.2 Å²	30.2	4%	0.042	19%	0.19	C	C	.	.	H	α-helix	trans	-63.7	-42.3	175.7	-69.7	-179.9	0	0	0	112.1	S73 L74 A75 I79 A80 T81 A90 A269 N272 A385	S73-L77 WeakPolarHBondContact O-CG 3.08Å; S73-L77 PolarHBondContact O-N 3.22Å; L74-L77 WeakPolarHBondContact O-CB 3.47Å; L74-L77 PolarHBondContact O-N 2.69Å; A75-L77 VanDerWaalsContact C-N 3.29Å; A75-L77 PolarHBondContact O-N 2.98Å; L77-I79 VanDerWaalsContact C-N 3.29Å; L77-I79 PolarHBondContact O-N 3.12Å; L77-A80 PolarHBondContact O-N 2.98Å; L77-T81 PolarHBondContact O-OG1 2.89Å; L77-A90 HydrophobicContact CD2-CB 3.89Å; L77-A269 HydrophobicContact CD1-CB 3.95Å; L77-A269 VanDerWaalsContact CD1-O 3.23Å; L77-A269 WeakPolarHBondContact CD1-O 3.32Å; L77-N272 HydrophobicContact CD2-CB 4.1Å; L77-N272 WeakPolarHBondContact CD2-OD1 3.21Å; L77-A385 HydrophobicContact CD1-CB 3.9Å
78	L	89.9	Confident	83.9	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63	-39.7	176.9	-61	178.4	0	0	0	111.1	I63 L74 A75 T81 L116 L129 A386 V389 L390	I63-L78 HydrophobicContact CD1-CD1 4.41Å; L74-L78 WeakPolarHBondContact O-CG 3.37Å; L74-L78 PolarHBondContact O-N 2.82Å; L74-L78 VanDerWaalsContact O-N 3.1Å; A75-L78 WeakPolarHBondContact O-CB 3.41Å; A75-L78 PolarHBondContact O-N 2.62Å; A75-L78 VanDerWaalsContact O-N 3.12Å; L78-T81 WeakPolarHBondContact O-CB 3.45Å; L78-T81 PolarHBondContact O-N 2.67Å; L78-L116 HydrophobicContact CB-CD1 3.96Å; L78-L129 HydrophobicContact CB-CD2 4.25Å; L78-L129 HydrophobicContact CD1-CD1 4.28Å; L78-L129 HydrophobicContact CD1-CD2 3.77Å; L78-A386 HydrophobicContact CD2-CB 3.89Å; L78-V389 HydrophobicContact CD1-CG1 4.47Å; L78-V389 HydrophobicContact CD2-CB 4.11Å; L78-V389 HydrophobicContact CD2-CG1 4.11Å; L78-L390 HydrophobicContact CD2-CD2 3.86Å; L78-L390 HydrophobicContact CD2-CG 3.87Å
79	I	88	Confident	83.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-68.3	-39.6	179.5	-63.4	167.5	0	0	0	111.4	A75 D76 L77 T81 N82 I84 I85 Y95 M96 I114 L116	A75-I79 WeakPolarHBondContact O-CG1 3.46Å; A75-I79 PolarHBondContact O-N 3.03Å; D76-I79 PolarHBondContact O-N 2.87Å; L77-I79 VanDerWaalsContact C-N 3.29Å; L77-I79 PolarHBondContact O-N 3.12Å; I79-T81 PolarHBondContact O-N 2.65Å; I79-N82 PolarHBondContact O-N 2.83Å; I79-N82 VanDerWaalsContact O-N 3.13Å; I79-I84 HydrophobicContact CG2-CB 3.74Å; I79-I84 HydrophobicContact CG2-CD1 4.2Å; I79-I84 HydrophobicContact CG2-CG1 4.49Å; I79-I84 HydrophobicContact CG2-CG2 3.85Å; I79-I85 HydrophobicContact CB-CD1 3.91Å; I79-I85 HydrophobicContact CG2-CD1 3.44Å; I79-I85 VanDerWaalsContact CG2-CD1 3.44Å; I79-I85 HydrophobicContact CG2-CG1 3.8Å; I79-Y95 HydrophobicContact CD1-CD1 4.15Å; I79-Y95 HydrophobicContact CG2-CD1 4.47Å; I79-M96 HydrophobicContact CD1-CG 3.65Å; I79-M96 HydrophobicContact CD1-SD 3.61Å; I79-I114 HydrophobicContact CD1-CD1 4.09Å; I79-I114 HydrophobicContact CD1-CG2 4.18Å; I79-I114 HydrophobicContact CG1-CD1 4Å; I79-I114 HydrophobicContact CG1-CG2 4.06Å; I79-I114 HydrophobicContact CG2-CD1 3.93Å; I79-L116 HydrophobicContact CG1-CD2 4.41Å
80	A	84.9	Confident	82.4	Confident	5 Å²	5	36.5 Å²	36.5	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-58.4	-32.2	179.2	0	0	0	0	0	113.1	D76 L77 N82 G83 A90	D76-A80 WeakPolarHBondContact O-CB 3.22Å; D76-A80 PolarHBondContact O-N 3.27Å; L77-A80 PolarHBondContact O-N 2.98Å; A80-N82 PolarHBondContact O-N 3.23Å; A80-N82 VanDerWaalsContact O-N 3.14Å; A80-G83 PolarHBondContact O-N 3.47Å; A80-A90 HydrophobicContact CB-CB 3.62Å
81	T	80.8	Confident	81.6	Confident	70 Å²	70	36.7 Å²	36.7	43%	0.429	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-28.7	178.7	-56	0	0	0	0	113.2	L77 L78 I79 G83 A386	L77-T81 PolarHBondContact O-OG1 2.89Å; L78-T81 WeakPolarHBondContact O-CB 3.45Å; L78-T81 PolarHBondContact O-N 2.67Å; I79-T81 PolarHBondContact O-N 2.65Å; T81-G83 VanDerWaalsContact C-N 3.29Å; T81-A386 WeakPolarHBondContact OG1-CB 3.45Å
82	N	79	Confident	80.9	Confident	50 Å²	50	41.7 Å²	41.7	27%	0.267	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88	3.8	178.4	-81.3	-105.2	0	0	0	112.8	I79 A80 I84 L116 I117	I79-N82 PolarHBondContact O-N 2.83Å; I79-N82 VanDerWaalsContact O-N 3.13Å; A80-N82 PolarHBondContact O-N 3.23Å; A80-N82 VanDerWaalsContact O-N 3.14Å; N82-I84 HydrophobicContact CB-CD1 4.06Å; N82-I84 HydrophobicContact CB-CG1 4.04Å; N82-I84 PolarHBondContact O-N 2.9Å; N82-L116 HydrophobicContact CB-CD2 4.21Å; N82-I117 PolarHBondContact ND2-O 3.14Å; N82-I117 PolarHBondContact OD1-N 3.13Å; N82-I117 PolarHBondContact OD1-O 3.21Å; N82-I117 VanDerWaalsContact OD1-O 3.05Å
83	G	73.6	Confident	80.4	Confident	64 Å²	64	44.2 Å²	44.2	66%	0.66	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.7	12.7	-178.7	0	0	0	0	0	114.3	A80 T81	A80-G83 PolarHBondContact O-N 3.47Å; T81-G83 VanDerWaalsContact C-N 3.29Å
84	I	73.9	Confident	80	Confident	62 Å²	62	46.5 Å²	46.5	32%	0.318	25%	0.25	S	C	.	.	S	Bend	trans	-70	-40.8	176.1	-59.7	175.9	0	0	0	109.5	I79 N82 Y95 I114 L116 M533	I79-I84 HydrophobicContact CG2-CB 3.74Å; I79-I84 HydrophobicContact CG2-CD1 4.2Å; I79-I84 HydrophobicContact CG2-CG1 4.49Å; I79-I84 HydrophobicContact CG2-CG2 3.85Å; N82-I84 HydrophobicContact CB-CD1 4.06Å; N82-I84 HydrophobicContact CB-CG1 4.04Å; N82-I84 PolarHBondContact O-N 2.9Å; I84-Y95 HydrophobicContact CG2-CE1 4.33Å; I84-I114 HydrophobicContact CD1-CD1 3.87Å; I84-I114 HydrophobicContact CD1-CG1 4.41Å; I84-L116 HydrophobicContact CD1-CD2 4.22Å; I84-M533 HydrophobicContact CD1-CE 3.93Å
85	I	73.1	Confident	79.5	Confident	10 Å²	10	48.2 Å²	48.2	5%	0.051	26%	0.257	C	S	.	.	S	Bend	trans	-117.9	146.2	175.2	-57.5	165.2	0	0	0	107.9	I79 M89 L93 Y95	I79-I85 HydrophobicContact CB-CD1 3.91Å; I79-I85 HydrophobicContact CG2-CD1 3.44Å; I79-I85 VanDerWaalsContact CG2-CD1 3.44Å; I79-I85 HydrophobicContact CG2-CG1 3.8Å; I85-M89 HydrophobicContact CG2-CB 4.16Å; I85-L93 HydrophobicContact CG2-CD1 3.55Å; I85-Y95 HydrophobicContact CD1-CD1 4.13Å; I85-Y95 HydrophobicContact CD1-CD2 3.85Å; I85-Y95 HydrophobicContact CD1-CG 3.51Å; I85-Y95 HydrophobicContact CG1-CD2 3.88Å; I85-Y95 HydrophobicContact CG1-CE2 4.37Å; I85-Y95 HydrophobicContact CG1-CG 4.04Å
86	S	74.1	Confident	79.1	Confident	68 Å²	68	48.2 Å²	48.2	48%	0.476	26%	0.257	S	S	.	.			trans	-68.7	136.5	170.2	62.9	0	0	0	0	111.1	R88 M89 A90	S86-R88 PolarHBondContact O-N 2.82Å; S86-M89 PolarHBondContact O-N 2.85Å; S86-M89 VanDerWaalsContact OG-CG 3.25Å; S86-M89 WeakPolarHBondContact OG-CG 3.47Å; S86-A90 PolarHBondContact O-N 3.19Å
87	D	73.1	Confident	78.9	Confident	113 Å²	113	48.2 Å²	48.2	60%	0.604	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-31.6	179.1	-60.1	-36.2	0	0	0	113.9	M89 A90	D87-M89 VanDerWaalsContact C-N 3.25Å; D87-M89 PolarHBondContact O-N 3.48Å; D87-A90 WeakPolarHBondContact O-CB 3.35Å; D87-A90 PolarHBondContact O-N 3.05Å
88	R	73.3	Confident	78.4	Confident	177 Å²	177	50.2 Å²	50.2	67%	0.668	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-28.6	178	-64.9	-174.7	-178.6	177.2	1.6	114.1	S86	S86-R88 PolarHBondContact O-N 2.82Å
89	M	74.4	Confident	78	Confident	72 Å²	72	50.7 Å²	50.7	36%	0.355	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	-7.8	-176.8	-60.8	-64.5	-68.4	0	0	112.2	I85 S86 D87 K92 L93	I85-M89 HydrophobicContact CG2-CB 4.16Å; S86-M89 PolarHBondContact O-N 2.85Å; S86-M89 VanDerWaalsContact OG-CG 3.25Å; S86-M89 WeakPolarHBondContact OG-CG 3.47Å; D87-M89 VanDerWaalsContact C-N 3.25Å; D87-M89 PolarHBondContact O-N 3.48Å; M89-K92 PolarHBondContact O-N 3.36Å; M89-L93 HydrophobicContact CB-CD1 3.32Å; M89-L93 HydrophobicContact CB-CG 3.83Å; M89-L93 HydrophobicContact CE-CD1 4.29Å; M89-L93 HydrophobicContact CE-CD2 3.74Å; M89-L93 HydrophobicContact CE-CG 3.85Å; M89-L93 HydrophobicContact CG-CD1 4.22Å; M89-L93 PolarHBondContact O-N 2.71Å
90	A	72.3	Confident	77.6	Confident	8 Å²	8	55.4 Å²	55.4	7%	0.066	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	136.8	176	0	0	0	0	0	110.5	L77 A80 S86 D87 K92	L77-A90 HydrophobicContact CD2-CB 3.89Å; A80-A90 HydrophobicContact CB-CB 3.62Å; S86-A90 PolarHBondContact O-N 3.19Å; D87-A90 WeakPolarHBondContact O-CB 3.35Å; D87-A90 PolarHBondContact O-N 3.05Å; A90-K92 PolarHBondContact O-N 3.38Å
91	G	70.9	Confident	77.4	Confident	15 Å²	15	55.6 Å²	55.6	16%	0.155	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-15.1	-178	0	0	0	0	0	115.4	S73	S73-G91 PolarHBondContact OG-O 2.85Å
92	K	76.2	Confident	77.6	Confident	118 Å²	118	52.2 Å²	52.2	51%	0.513	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-32.1	-177.4	-63.8	-180	-177.7	174.5	0	113.8	M89 A90	M89-K92 PolarHBondContact O-N 3.36Å; A90-K92 PolarHBondContact O-N 3.38Å
93	L	78.7	Confident	77.7	Confident	60 Å²	60	53.8 Å²	53.8	31%	0.314	28%	0.282	S	S	.	.	S	Bend	trans	-72.5	-31.1	-175.5	-84.3	165.2	0	0	0	113.4	I85 M89	I85-L93 HydrophobicContact CG2-CD1 3.55Å; M89-L93 HydrophobicContact CB-CD1 3.32Å; M89-L93 HydrophobicContact CB-CG 3.83Å; M89-L93 HydrophobicContact CE-CD1 4.29Å; M89-L93 HydrophobicContact CE-CD2 3.74Å; M89-L93 HydrophobicContact CE-CG 3.85Å; M89-L93 HydrophobicContact CG-CD1 4.22Å; M89-L93 PolarHBondContact O-N 2.71Å
94	R	81.6	Confident	78.1	Confident	76 Å²	76	57.7 Å²	57.7	29%	0.287	28%	0.283	S	S	.	.			trans	49.9	61.7	-165.5	-58.9	-171	-178.2	137.9	-11.6	110.8	T72 D76 M96 D97 G106	T72-R94 HydrophobicContact CG2-CB 3.76Å; T72-R94 HydrophobicContact CG2-CG 3.82Å; D76-R94 WeakPolarHBondContact OD2-CA 3.46Å; D76-R94 PolarHBondContact OD2-N 3.38Å; R94-M96 VanDerWaalsContact C-N 3.27Å; R94-M96 PolarHBondContact O-N 2.83Å; R94-D97 HydrophobicContact CB-CB 4.05Å; R94-D97 WeakPolarHBondContact CD-OD2 3.48Å; R94-D97 WeakPolarHBondContact O-CB 3.38Å; R94-D97 PolarHBondContact O-N 2.8Å; R94-G106 VanDerWaalsContact NH1-CA 3.33Å
95	Y	82.8	Confident	78.4	Confident	36 Å²	36	58.8 Å²	58.8	14%	0.141	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-37.3	-170.1	-178.7	-96.3	0	0	0	113.1	D76 I79 I84 I85 D97 I114 R535	D76-Y95 WeakPolarHBondContact OD1-CB 3.44Å; D76-Y95 PolarHBondContact OD1-N 3.01Å; I79-Y95 HydrophobicContact CD1-CD1 4.15Å; I79-Y95 HydrophobicContact CG2-CD1 4.47Å; I84-Y95 HydrophobicContact CG2-CE1 4.33Å; I85-Y95 HydrophobicContact CD1-CD1 4.13Å; I85-Y95 HydrophobicContact CD1-CD2 3.85Å; I85-Y95 HydrophobicContact CD1-CG 3.51Å; I85-Y95 HydrophobicContact CG1-CD2 3.88Å; I85-Y95 HydrophobicContact CG1-CE2 4.37Å; I85-Y95 HydrophobicContact CG1-CG 4.04Å; Y95-D97 VanDerWaalsContact C-N 3.28Å; Y95-D97 PolarHBondContact O-N 2.88Å; Y95-I114 HydrophobicContact CE1-CD1 4.2Å; Y95-R535 PolarHBondContact O-NE 3.39Å
96	M	82.9	Confident	78.8	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-23.6	178.9	-62.8	-58.4	-76.5	0	0	113.5	A75 I79 R94 S98 S112 I114 D131	A75-M96 HydrophobicContact CB-CG 4.46Å; I79-M96 HydrophobicContact CD1-CG 3.65Å; I79-M96 HydrophobicContact CD1-SD 3.61Å; R94-M96 VanDerWaalsContact C-N 3.27Å; R94-M96 PolarHBondContact O-N 2.83Å; M96-S98 PolarHBondContact O-N 2.82Å; M96-S98 VanDerWaalsContact O-N 3.12Å; M96-S112 VanDerWaalsContact CE-O 3.25Å; M96-S112 WeakPolarHBondContact CE-O 3.41Å; M96-S112 PolarHBondContact O-OG 3.42Å; M96-I114 HydrophobicContact CE-CB 4.13Å; M96-I114 HydrophobicContact CE-CG2 4.02Å; M96-I114 HydrophobicContact SD-CB 4.14Å; M96-I114 HydrophobicContact SD-CD1 4.5Å; M96-I114 HydrophobicContact SD-CG2 4.04Å; M96-D131 HydrophobicContact CB-CB 4.19Å; M96-D131 HydrophobicContact CE-CB 4.31Å; M96-D131 HydrophobicContact CG-CB 4.28Å
97	D	85.2	Confident	79.2	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.276	C	S	.	.			trans	-80	93.1	174.5	-67.9	-16	0	0	0	108.4	R94 Y95 E102 Q103 T108 R535	R94-D97 HydrophobicContact CB-CB 4.05Å; R94-D97 WeakPolarHBondContact CD-OD2 3.48Å; R94-D97 WeakPolarHBondContact O-CB 3.38Å; R94-D97 PolarHBondContact O-N 2.8Å; Y95-D97 VanDerWaalsContact C-N 3.28Å; Y95-D97 PolarHBondContact O-N 2.88Å; D97-E102 WeakPolarHBondContact CA-OE2 3.42Å; D97-E102 HydrophobicContact CB-CB 3.78Å; D97-Q103 HydrophobicContact CB-CG 4.46Å; D97-Q103 PolarHBondContact O-NE2 3.31Å; D97-T108 WeakPolarHBondContact OD1-CA 2.64Å; D97-T108 WeakPolarHBondContact OD1-CB 3.12Å; D97-T108 WeakPolarHBondContact OD1-CG2 3.45Å; D97-T108 PolarHBondContact OD1-OG1 3.39Å; D97-R535 PolarHBondContact O-NH2 2.93Å
98	S	78.7	Confident	79.8	Confident	49 Å²	49	52 Å²	52	34%	0.343	25%	0.248	S	C	.	.			trans	-83.1	-23.4	-176	60.1	0	0	0	0	112.7	M96 E102	M96-S98 PolarHBondContact O-N 2.82Å; M96-S98 VanDerWaalsContact O-N 3.12Å; S98-E102 PolarHBondContact N-OE2 2.79Å
99	R	80.4	Confident	80.2	Confident	10 Å²	10	43.6 Å²	43.6	4%	0.038	22%	0.216	C	C	.	.	S	Bend	trans	-83.9	143.4	-177.8	-57.9	178.3	163	-135.9	-2	110.6	E101 E102 Q103 D639	R99-E101 VanDerWaalsContact C-N 3.3Å; R99-E101 IonicContact NH1-OE2 3.3Å; R99-E101 PolarHBondContact O-N 2.73Å; R99-E102 HydrophobicContact CB-CB 4.23Å; R99-E102 HydrophobicContact CB-CG 3.84Å; R99-E102 WeakPolarHBondContact CB-OE2 3.09Å; R99-E102 HydrophobicContact CG-CG 4.38Å; R99-E102 PolarHBondContact N-OE2 2.97Å; R99-E102 VanDerWaalsContact N-OE2 3.1Å; R99-E102 PolarHBondContact O-N 2.8Å; R99-Q103 PolarHBondContact O-N 2.88Å; R99-D639 IonicContact CZ-OD1 3.97Å; R99-D639 IonicContact CZ-OD2 2.59Å; R99-D639 VanDerWaalsContact NH1-CG 3.26Å; R99-D639 IonicContact NH1-OD1 2.99Å; R99-D639 PolarHBondContact NH1-OD1 3.06Å; R99-D639 IonicContact NH1-OD2 3.23Å; R99-D639 PolarHBondContact NH1-OD2 2.87Å; R99-D639 IonicContact NH2-OD1 2.9Å; R99-D639 PolarHBondContact NH2-OD1 3.49Å; R99-D639 IonicContact NH2-OD2 3.58Å; R99-D639 PolarHBondContact NH2-OD2 3.32Å
100	I	80.7	Confident	80.8	Confident	100 Å²	100	41 Å²	41	51%	0.513	20%	0.203	S	C	.	.	H	α-helix	trans	-58.9	-45.5	174.7	-61.6	169.6	0	0	0	110.1	E102 Q103 E104	I100-E102 VanDerWaalsContact C-N 3.29Å; I100-E102 PolarHBondContact O-N 2.86Å; I100-Q103 WeakPolarHBondContact O-CB 3.2Å; I100-Q103 PolarHBondContact O-N 3.38Å; I100-Q103 VanDerWaalsContact O-N 3.09Å; I100-E104 HydrophobicContact CG2-CG 4.19Å; I100-E104 WeakPolarHBondContact CG2-OE1 3.36Å; I100-E104 WeakPolarHBondContact O-CG 3.23Å; I100-E104 PolarHBondContact O-N 2.7Å
101	E	80.6	Confident	81.5	Confident	8 Å²	8	40.6 Å²	40.6	4%	0.037	20%	0.2	C	C	.	.	H	α-helix	trans	-59.2	-35.1	178	-64.9	152.5	-155.9	0	0	113.3	R99 R105 M109 R642	R99-E101 VanDerWaalsContact C-N 3.3Å; R99-E101 IonicContact NH1-OE2 3.3Å; R99-E101 PolarHBondContact O-N 2.73Å; E101-R105 WeakPolarHBondContact O-CB 3.43Å; E101-R105 VanDerWaalsContact O-CG 3.23Å; E101-R105 WeakPolarHBondContact O-CG 3.4Å; E101-R105 PolarHBondContact O-N 3.08Å; E101-M109 HydrophobicContact CB-CE 3.41Å; E101-M109 VanDerWaalsContact CB-CE 3.41Å; E101-R642 IonicContact OE1-CZ 3.62Å; E101-R642 IonicContact OE1-NH1 3.53Å; E101-R642 PolarHBondContact OE1-NH1 2.88Å
102	E	83.3	Confident	82.3	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66.4	-42.6	176.9	-71.4	173.7	148.6	0	0	110.4	D97 S98 R99 I100 G106 I107 M109 K110	D97-E102 WeakPolarHBondContact CA-OE2 3.42Å; D97-E102 HydrophobicContact CB-CB 3.78Å; S98-E102 PolarHBondContact N-OE2 2.79Å; R99-E102 HydrophobicContact CB-CB 4.23Å; R99-E102 HydrophobicContact CB-CG 3.84Å; R99-E102 WeakPolarHBondContact CB-OE2 3.09Å; R99-E102 HydrophobicContact CG-CG 4.38Å; R99-E102 PolarHBondContact N-OE2 2.97Å; R99-E102 VanDerWaalsContact N-OE2 3.1Å; R99-E102 PolarHBondContact O-N 2.8Å; I100-E102 VanDerWaalsContact C-N 3.29Å; I100-E102 PolarHBondContact O-N 2.86Å; E102-G106 PolarHBondContact O-N 2.91Å; E102-I107 VanDerWaalsContact CA-O 3.3Å; E102-I107 WeakPolarHBondContact CA-O 3.49Å; E102-I107 WeakPolarHBondContact CB-O 3.43Å; E102-I107 WeakPolarHBondContact CG-O 3.35Å; E102-I107 PolarHBondContact O-N 2.97Å; E102-M109 HydrophobicContact CG-CB 3.93Å; E102-M109 HydrophobicContact CG-CE 3.64Å; E102-M109 HydrophobicContact CG-CG 3.95Å; E102-M109 WeakPolarHBondContact OE1-CA 3.07Å; E102-M109 PolarHBondContact OE1-N 2.83Å; E102-K110 PolarHBondContact OE1-N 2.86Å
103	Q	81.5	Confident	83.1	Confident	82 Å²	82	34.8 Å²	34.8	38%	0.383	17%	0.172	S	C	.	.	H	α-helix	trans	-66.7	-44.7	178.2	-66.1	172.2	21	0	0	111.6	D97 R99 I100	D97-Q103 HydrophobicContact CB-CG 4.46Å; D97-Q103 PolarHBondContact O-NE2 3.31Å; R99-Q103 PolarHBondContact O-N 2.88Å; I100-Q103 WeakPolarHBondContact O-CB 3.2Å; I100-Q103 PolarHBondContact O-N 3.38Å; I100-Q103 VanDerWaalsContact O-N 3.09Å
104	E	82.8	Confident	83.7	Confident	146 Å²	146	32 Å²	32	68%	0.682	16%	0.157	S	C	*	.	H	α-helix	trans	-64.1	-47.7	177.5	-72.6	176.9	171.5	0	0	112.3	I100	I100-E104 HydrophobicContact CG2-CG 4.19Å; I100-E104 WeakPolarHBondContact CG2-OE1 3.36Å; I100-E104 WeakPolarHBondContact O-CG 3.23Å; I100-E104 PolarHBondContact O-N 2.7Å
105	R	80.2	Confident	84.2	Confident	85 Å²	85	28.7 Å²	28.7	32%	0.321	15%	0.146	S	C	.	.	H	α-helix	trans	-77.4	-22.1	-175.3	-69.3	177.2	172.4	-154	-11.1	113.4	E101 I107	E101-R105 WeakPolarHBondContact O-CB 3.43Å; E101-R105 VanDerWaalsContact O-CG 3.23Å; E101-R105 WeakPolarHBondContact O-CG 3.4Å; E101-R105 PolarHBondContact O-N 3.08Å; R105-I107 HydrophobicContact CB-CD1 4.44Å; R105-I107 HydrophobicContact CB-CG1 3.92Å
106	G	81.1	Confident	84.6	Confident	26 Å²	26	27 Å²	27	27%	0.268	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.7	5.9	-176.5	0	0	0	0	0	115.8	R94 E102	R94-G106 VanDerWaalsContact NH1-CA 3.33Å; E102-G106 PolarHBondContact O-N 2.91Å
107	I	82.6	Confident	84.9	Confident	21 Å²	21	28.1 Å²	28.1	11%	0.108	15%	0.145	C	C	.	.	S	Bend	trans	-131.6	138.2	-169.1	65.7	176.7	0	0	0	111	V67 E102 R105 M109 F138 M631	V67-I107 HydrophobicContact CG1-CG2 3.92Å; E102-I107 VanDerWaalsContact CA-O 3.3Å; E102-I107 WeakPolarHBondContact CA-O 3.49Å; E102-I107 WeakPolarHBondContact CB-O 3.43Å; E102-I107 WeakPolarHBondContact CG-O 3.35Å; E102-I107 PolarHBondContact O-N 2.97Å; R105-I107 HydrophobicContact CB-CD1 4.44Å; R105-I107 HydrophobicContact CB-CG1 3.92Å; I107-M109 HydrophobicContact CD1-CG 4.36Å; I107-M109 HydrophobicContact CG1-CG 4.1Å; I107-F138 HydrophobicContact CD1-CE2 4.37Å; I107-M631 HydrophobicContact CD1-CE 3.81Å
108	T	85.2	Confident	85.2	Confident	2 Å²	2	29 Å²	29	1%	0.012	15%	0.149	C	C	.	.			trans	-73.4	128.6	169	-50.5	0	0	0	0	108.5	K71 T72 D97 K110 P133	K71-T108 WeakPolarHBondContact CE-OG1 3.45Å; K71-T108 PolarHBondContact NZ-OG1 3.08Å; T72-T108 PolarHBondContact OG1-OG1 2.86Å; T72-T108 VanDerWaalsContact OG1-OG1 3.05Å; D97-T108 WeakPolarHBondContact OD1-CA 2.64Å; D97-T108 WeakPolarHBondContact OD1-CB 3.12Å; D97-T108 WeakPolarHBondContact OD1-CG2 3.45Å; D97-T108 PolarHBondContact OD1-OG1 3.39Å; T108-K110 WeakPolarHBondContact CG2-O 3.23Å; T108-P133 WeakPolarHBondContact O-CB 3.38Å
109	M	83	Confident	85.7	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.16	C	C	.	.			trans	-114.2	-26	-179	-61.9	-168.3	-72.3	0	0	112.3	E101 E102 I107 F138 R635	E101-M109 HydrophobicContact CB-CE 3.41Å; E101-M109 VanDerWaalsContact CB-CE 3.41Å; E102-M109 HydrophobicContact CG-CB 3.93Å; E102-M109 HydrophobicContact CG-CE 3.64Å; E102-M109 HydrophobicContact CG-CG 3.95Å; E102-M109 WeakPolarHBondContact OE1-CA 3.07Å; E102-M109 PolarHBondContact OE1-N 2.83Å; I107-M109 HydrophobicContact CD1-CG 4.36Å; I107-M109 HydrophobicContact CG1-CG 4.1Å; M109-F138 HydrophobicContact CB-CD2 4.37Å; M109-F138 HydrophobicContact CB-CE1 4.4Å; M109-F138 HydrophobicContact CB-CE2 4.01Å; M109-F138 HydrophobicContact CB-CZ 4.02Å; M109-F138 HydrophobicContact CG-CD2 4.38Å; M109-F138 HydrophobicContact CG-CE2 3.63Å; M109-F138 HydrophobicContact CG-CZ 3.75Å; M109-F138 HydrophobicContact SD-CE2 4.29Å; M109-F138 HydrophobicContact SD-CZ 3.89Å; M109-R635 HydrophobicContact CE-CG 4.32Å; M109-R635 HydrophobicContact SD-CB 4.4Å; M109-R635 HydrophobicContact SD-CG 3.96Å
110	K	85.9	Confident	86	Confident	17 Å²	17	32.5 Å²	32.5	7%	0.074	16%	0.161	C	C	.	.	S	Bend	trans	-120.1	137.8	-179.5	-176.6	-178.3	179	-174.7	0	110.8	E102 T108 S112 P453	E102-K110 PolarHBondContact OE1-N 2.86Å; T108-K110 WeakPolarHBondContact CG2-O 3.23Å; K110-S112 PolarHBondContact O-N 3.01Å; K110-P453 PolarHBondContact NZ-O 2.93Å
111	S	86.9	Confident	86.1	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.007	17%	0.172	C	C	.	.			trans	-72.6	128.8	172.8	-55.6	0	0	0	0	111.2	D131 P133 E141 K450	S111-D131 VanDerWaalsContact CA-O 3.24Å; S111-D131 WeakPolarHBondContact CA-O 3.43Å; S111-P133 VanDerWaalsContact OG-CD 3.31Å; S111-P133 WeakPolarHBondContact OG-CD 3.39Å; S111-E141 WeakPolarHBondContact CB-OE2 3.4Å; S111-E141 PolarHBondContact N-OE2 3.09Å; S111-E141 PolarHBondContact OG-O 3.34Å; S111-E141 PolarHBondContact OG-OE2 3Å; S111-K450 PolarHBondContact O-NZ 3.19Å
112	S	88.9	Confident	86.3	Confident	6 Å²	6	39.4 Å²	39.4	4%	0.042	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	149.2	-179.9	-68.9	0	0	0	0	110.2	M96 K110 V130 D131	M96-S112 VanDerWaalsContact CE-O 3.25Å; M96-S112 WeakPolarHBondContact CE-O 3.41Å; M96-S112 PolarHBondContact O-OG 3.42Å; K110-S112 PolarHBondContact O-N 3.01Å; S112-V130 CarbonylContact O-C 3.53Å; S112-V130 WeakPolarHBondContact O-CA 3.47Å; S112-D131 PolarHBondContact N-O 3.05Å; S112-D131 PolarHBondContact O-N 3Å
113	A	92.2	Very high	86.6	Confident	5 Å²	5	45.5 Å²	45.5	4%	0.041	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	150.5	-177.1	0	0	0	0	0	113	L129 V130 F490 M532 G534	A113-L129 CarbonylContact C-O 3.58Å; A113-L129 VanDerWaalsContact CA-O 3.25Å; A113-L129 WeakPolarHBondContact CA-O 3.47Å; A113-V130 HydrophobicContact CB-CG2 4.02Å; A113-F490 HydrophobicContact CB-CE2 3.94Å; A113-F490 HydrophobicContact CB-CZ 3.66Å; A113-M532 HydrophobicContact CB-CB 4.27Å; A113-M532 HydrophobicContact CB-CG 4.5Å; A113-M532 HydrophobicContact CB-SD 3.97Å; A113-M532 PolarHBondContact N-SD 2.86Å; A113-M532 CarbonylContact O-C 3.56Å; A113-M532 WeakPolarHBondContact O-CG 3.24Å; A113-G534 PolarHBondContact O-N 3.31Å
114	I	91.7	Very high	87	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	138.6	176.3	-168.9	156.7	0	0	0	111	I79 I84 Y95 M96 L116 L129 M533	I79-I114 HydrophobicContact CD1-CD1 4.09Å; I79-I114 HydrophobicContact CD1-CG2 4.18Å; I79-I114 HydrophobicContact CG1-CD1 4Å; I79-I114 HydrophobicContact CG1-CG2 4.06Å; I79-I114 HydrophobicContact CG2-CD1 3.93Å; I84-I114 HydrophobicContact CD1-CD1 3.87Å; I84-I114 HydrophobicContact CD1-CG1 4.41Å; Y95-I114 HydrophobicContact CE1-CD1 4.2Å; M96-I114 HydrophobicContact CE-CB 4.13Å; M96-I114 HydrophobicContact CE-CG2 4.02Å; M96-I114 HydrophobicContact SD-CB 4.14Å; M96-I114 HydrophobicContact SD-CD1 4.5Å; M96-I114 HydrophobicContact SD-CG2 4.04Å; I114-L116 HydrophobicContact CG1-CD2 4.24Å; I114-L116 HydrophobicContact CG2-CD2 4.43Å; I114-L116 HydrophobicContact CG2-CG 4.45Å; I114-L129 HydrophobicContact CG2-CB 3.99Å; I114-L129 HydrophobicContact CG2-CD2 4.32Å; I114-L129 PolarHBondContact N-O 3.35Å; I114-L129 PolarHBondContact O-N 3.03Å; I114-M533 HydrophobicContact CD1-CE 4.38Å; I114-M533 HydrophobicContact CG1-CE 3.88Å; I114-M533 HydrophobicContact CG1-SD 4.33Å
115	S	91.5	Very high	87.5	Confident	6 Å²	6	36.8 Å²	36.8	4%	0.042	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	120.4	176.5	-64	0	0	0	0	111.3	R48 N128	R48-S115 PolarHBondContact NH2-O 2.88Å; S115-N128 WeakPolarHBondContact CB-OD1 3.49Å; S115-N128 PolarHBondContact OG-OD1 3.04Å
116	L	90.9	Very high	88.1	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	142	-179.9	-57.1	177.9	0	0	0	110.6	L78 I79 N82 I84 I114 I127 L129	L78-L116 HydrophobicContact CB-CD1 3.96Å; I79-L116 HydrophobicContact CG1-CD2 4.41Å; N82-L116 HydrophobicContact CB-CD2 4.21Å; I84-L116 HydrophobicContact CD1-CD2 4.22Å; I114-L116 HydrophobicContact CG1-CD2 4.24Å; I114-L116 HydrophobicContact CG2-CD2 4.43Å; I114-L116 HydrophobicContact CG2-CG 4.45Å; L116-I127 HydrophobicContact CB-CB 4.49Å; L116-I127 PolarHBondContact N-O 3.4Å; L116-I127 PolarHBondContact O-N 3.22Å; L116-L129 HydrophobicContact CD1-CD2 4.24Å
117	I	90.8	Very high	88.7	Confident	25 Å²	25	31.6 Å²	31.6	13%	0.128	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	128.5	171.4	-57.5	176.2	0	0	0	107.8	K47 R48 L51 N82 F125 L126	K47-I117 HydrophobicContact CD-CG2 4.45Å; R48-I117 HydrophobicContact CB-CD1 4.13Å; L51-I117 HydrophobicContact CD1-CG2 4.13Å; N82-I117 PolarHBondContact ND2-O 3.14Å; N82-I117 PolarHBondContact OD1-N 3.13Å; N82-I117 PolarHBondContact OD1-O 3.21Å; N82-I117 VanDerWaalsContact OD1-O 3.05Å; I117-F125 WeakPolarHBondContact CA-O 3.27Å; I117-L126 HydrophobicContact CG1-CD1 4.39Å
118	F	90.6	Very high	89.2	Confident	18 Å²	18	30.7 Å²	30.7	8%	0.079	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	134.8	178.9	-173.9	-114.1	0	0	0	111.5	N120 S124 F125 I127 L390 R391	F118-N120 HydrophobicContact CD1-CB 4.07Å; F118-N120 HydrophobicContact CE1-CB 3.82Å; F118-S124 CarbonylContact O-C 3.47Å; F118-S124 WeakPolarHBondContact O-CA 3.34Å; F118-F125 PolarHBondContact N-O 3.15Å; F118-F125 PolarHBondContact O-N 2.85Å; F118-I127 HydrophobicContact CB-CD1 3.94Å; F118-L390 HydrophobicContact CB-CD1 4.14Å; F118-L390 HydrophobicContact CD1-CB 3.7Å; F118-L390 HydrophobicContact CD2-CB 3.93Å; F118-L390 HydrophobicContact CD2-CD1 3.5Å; F118-L390 VanDerWaalsContact CD2-CD1 3.5Å; F118-L390 HydrophobicContact CD2-CG 4.37Å; F118-L390 HydrophobicContact CE1-CB 3.75Å; F118-L390 HydrophobicContact CE2-CB 3.99Å; F118-L390 HydrophobicContact CE2-CD1 4.02Å; F118-L390 HydrophobicContact CG-CB 3.79Å; F118-L390 HydrophobicContact CG-CD1 3.84Å; F118-L390 HydrophobicContact CG-CG 4.44Å; F118-L390 HydrophobicContact CZ-CB 3.91Å; F118-R391 HydrophobicContact CE1-CG 3.74Å; F118-R391 HydrophobicContact CZ-CG 3.86Å
119	E	89.1	Confident	89.7	Confident	126 Å²	126	30.7 Å²	30.7	59%	0.589	17%	0.166	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	116.9	174.9	-65.9	-171.3	170	0	0	110	K47 K123	K47-E119 IonicContact NZ-OE1 3.99Å; K47-E119 PolarHBondContact NZ-OE1 3.11Å; E119-K123 CarbonylContact C-O 3.57Å; E119-K123 WeakPolarHBondContact CA-O 3.44Å
120	N	86.6	Confident	90.2	Very high	8 Å²	8	30.7 Å²	30.7	4%	0.043	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	124.2	176.8	-173.4	21.9	0	0	0	109.6	F118 G122 K123 F125 D395	F118-N120 HydrophobicContact CD1-CB 4.07Å; F118-N120 HydrophobicContact CE1-CB 3.82Å; N120-G122 PolarHBondContact O-N 2.82Å; N120-G122 VanDerWaalsContact O-N 3.14Å; N120-K123 PolarHBondContact N-O 3.31Å; N120-K123 PolarHBondContact O-N 3.31Å; N120-F125 HydrophobicContact CB-CD2 4.07Å; N120-F125 HydrophobicContact CB-CE2 3.88Å; N120-D395 PolarHBondContact ND2-OD1 3.17Å; N120-D395 VanDerWaalsContact ND2-OD1 3.12Å
121	K	83.5	Confident	90.5	Very high	171 Å²	171	30 Å²	30	74%	0.743	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.2	42.5	177.6	-63.3	170.4	-179.1	168.3	0	113.4	K123	K121-K123 VanDerWaalsContact C-N 3.29Å; K121-K123 PolarHBondContact O-N 3.24Å
122	G	84.3	Confident	90.8	Very high	82 Å²	82	30 Å²	30	85%	0.845	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.5	-0.5	-179.9	0	0	0	0	0	115.9	N120	N120-G122 PolarHBondContact O-N 2.82Å; N120-G122 VanDerWaalsContact O-N 3.14Å
123	K	88.8	Confident	90.8	Very high	127 Å²	127	29.7 Å²	29.7	55%	0.552	16%	0.161	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	135.8	175.2	-67.8	174.6	177.6	-178.9	0	110.1	F57 E119 N120 K121 F125	F57-K123 HydrophobicContact CE1-CB 4.4Å; F57-K123 HydrophobicContact CE1-CD 4.3Å; E119-K123 CarbonylContact C-O 3.57Å; E119-K123 WeakPolarHBondContact CA-O 3.44Å; N120-K123 PolarHBondContact N-O 3.31Å; N120-K123 PolarHBondContact O-N 3.31Å; K121-K123 VanDerWaalsContact C-N 3.29Å; K121-K123 PolarHBondContact O-N 3.24Å; K123-F125 HydrophobicContact CB-CD2 4.4Å; K123-F125 HydrophobicContact CB-CE2 3.63Å; K123-F125 HydrophobicContact CB-CZ 4.07Å; K123-F125 HydrophobicContact CD-CZ 4.49Å; K123-F125 WeakPolarHBondContact O-CD2 3.35Å
124	S	90.9	Very high	90.2	Very high	27 Å²	27	29.6 Å²	29.6	19%	0.189	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	132.2	173.1	-61.1	0	0	0	0	110.4	K47 L51 F57 F118	K47-S124 WeakPolarHBondContact CE-OG 3.32Å; K47-S124 PolarHBondContact NZ-OG 3.47Å; L51-S124 VanDerWaalsContact CD2-O 3.25Å; L51-S124 WeakPolarHBondContact CD2-O 3.45Å; F57-S124 WeakPolarHBondContact CD1-O 3.28Å; F118-S124 CarbonylContact O-C 3.47Å; F118-S124 WeakPolarHBondContact O-CA 3.34Å
125	F	92.1	Very high	89.9	Confident	19 Å²	19	31 Å²	31	8%	0.083	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	147.7	177.9	-65.4	-93.9	0	0	0	110	F57 I117 F118 N120 K123 C394	F57-F125 HydrophobicContact CD1-CD1 4.24Å; F57-F125 HydrophobicContact CD1-CE1 4.1Å; F57-F125 CarbonylContact O-C 3.59Å; F57-F125 WeakPolarHBondContact O-CA 3.45Å; I117-F125 WeakPolarHBondContact CA-O 3.27Å; F118-F125 PolarHBondContact N-O 3.15Å; F118-F125 PolarHBondContact O-N 2.85Å; N120-F125 HydrophobicContact CB-CD2 4.07Å; N120-F125 HydrophobicContact CB-CE2 3.88Å; K123-F125 HydrophobicContact CB-CD2 4.4Å; K123-F125 HydrophobicContact CB-CE2 3.63Å; K123-F125 HydrophobicContact CB-CZ 4.07Å; K123-F125 HydrophobicContact CD-CZ 4.49Å; K123-F125 WeakPolarHBondContact O-CD2 3.35Å; F125-C394 HydrophobicContact CD2-CB 4.48Å; F125-C394 HydrophobicContact CE2-CB 4.49Å
126	L	93.1	Very high	89.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	116.4	169.6	-178.2	69.7	0	0	0	108.6	R48 L51 Q52 F57 I58 R59 I117	R48-L126 HydrophobicContact CG-CD1 4.11Å; L51-L126 HydrophobicContact CB-CB 4.06Å; Q52-L126 HydrophobicContact CB-CD2 4.36Å; Q52-L126 HydrophobicContact CG-CD2 3.39Å; F57-L126 PolarHBondContact O-N 3.49Å; I58-L126 CarbonylContact C-O 3.6Å; I58-L126 VanDerWaalsContact CA-O 3.32Å; I58-L126 WeakPolarHBondContact CA-O 3.11Å; I58-L126 HydrophobicContact CG1-CB 4.49Å; I58-L126 HydrophobicContact CG1-CD2 4.38Å; R59-L126 PolarHBondContact N-O 3.3Å; I117-L126 HydrophobicContact CG1-CD1 4.39Å
127	I	93.6	Very high	89	Confident	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	109.7	-177.8	-57.2	174	0	0	0	107.7	R59 V61 L116 F118 L129 L390 V393	R59-I127 HydrophobicContact CB-CG1 4.37Å; R59-I127 CarbonylContact O-C 3.36Å; R59-I127 WeakPolarHBondContact O-CA 3.42Å; V61-I127 HydrophobicContact CG2-CG2 4.32Å; L116-I127 HydrophobicContact CB-CB 4.49Å; L116-I127 PolarHBondContact N-O 3.4Å; L116-I127 PolarHBondContact O-N 3.22Å; F118-I127 HydrophobicContact CB-CD1 3.94Å; I127-L129 PolarHBondContact O-N 2.9Å; I127-L390 HydrophobicContact CD1-CB 4.28Å; I127-L390 HydrophobicContact CD1-CD2 3.76Å; I127-L390 HydrophobicContact CD1-CG 4.47Å; I127-V393 HydrophobicContact CD1-CG1 4.08Å; I127-V393 HydrophobicContact CG1-CG1 4.4Å; I127-V393 HydrophobicContact CG2-CG1 4.16Å
128	N	94.7	Very high	88.8	Confident	3 Å²	3	30.7 Å²	30.7	2%	0.016	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	103.5	173.3	-62.5	-37.4	0	0	0	107.9	R59 N60 V61 S115 L548	R59-N128 PolarHBondContact O-N 3.47Å; N60-N128 WeakPolarHBondContact OD1-CB 3.4Å; N60-N128 PolarHBondContact OD1-ND2 2.74Å; V61-N128 PolarHBondContact N-O 2.91Å; S115-N128 WeakPolarHBondContact CB-OD1 3.49Å; S115-N128 PolarHBondContact OG-OD1 3.04Å; N128-L548 HydrophobicContact CB-CD1 3.88Å; N128-L548 HydrophobicContact CB-CG 4.12Å
129	L	94.2	Very high	88.5	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	126.6	-177.6	-174.1	69.6	0	0	0	110	V61 I63 L78 A113 I114 L116 I127 I153	V61-L129 CarbonylContact O-C 3.55Å; V61-L129 WeakPolarHBondContact O-CA 3.49Å; I63-L129 HydrophobicContact CD1-CD1 3.86Å; I63-L129 HydrophobicContact CD1-CD2 4.06Å; I63-L129 HydrophobicContact CD1-CG 4.21Å; I63-L129 HydrophobicContact CG1-CD1 3.7Å; I63-L129 HydrophobicContact CG1-CG 4.42Å; L78-L129 HydrophobicContact CB-CD2 4.25Å; L78-L129 HydrophobicContact CD1-CD1 4.28Å; L78-L129 HydrophobicContact CD1-CD2 3.77Å; A113-L129 CarbonylContact C-O 3.58Å; A113-L129 VanDerWaalsContact CA-O 3.25Å; A113-L129 WeakPolarHBondContact CA-O 3.47Å; I114-L129 HydrophobicContact CG2-CB 3.99Å; I114-L129 HydrophobicContact CG2-CD2 4.32Å; I114-L129 PolarHBondContact N-O 3.35Å; I114-L129 PolarHBondContact O-N 3.03Å; L116-L129 HydrophobicContact CD1-CD2 4.24Å; I127-L129 PolarHBondContact O-N 2.9Å; L129-I153 HydrophobicContact CD1-CD1 4.32Å
130	V	94.3	Very high	88.3	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117	174.1	-173.1	0	0	0	0	109.2	V61 C62 I63 S112 A113 A145 F490 L548	V61-V130 PolarHBondContact O-N 2.68Å; C62-V130 CarbonylContact C-O 3.5Å; C62-V130 VanDerWaalsContact CA-O 3.25Å; C62-V130 WeakPolarHBondContact CA-O 3.38Å; C62-V130 HydrophobicContact CB-CB 4.19Å; I63-V130 PolarHBondContact N-O 3.19Å; S112-V130 CarbonylContact O-C 3.53Å; S112-V130 WeakPolarHBondContact O-CA 3.47Å; A113-V130 HydrophobicContact CB-CG2 4.02Å; V130-A145 HydrophobicContact CG1-CB 3.72Å; V130-F490 HydrophobicContact CG2-CZ 4.31Å; V130-L548 HydrophobicContact CG2-CD1 3.7Å
131	D	92.9	Very high	88.4	Confident	2 Å²	2	24 Å²	24	1%	0.011	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	123.5	171.8	-167.4	19.1	0	0	0	108.5	M96 S111 S112	M96-D131 HydrophobicContact CB-CB 4.19Å; M96-D131 HydrophobicContact CE-CB 4.31Å; M96-D131 HydrophobicContact CG-CB 4.28Å; S111-D131 VanDerWaalsContact CA-O 3.24Å; S111-D131 WeakPolarHBondContact CA-O 3.43Å; S112-D131 PolarHBondContact N-O 3.05Å; S112-D131 PolarHBondContact O-N 3Å
132	S	91.7	Very high	88.8	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.101	C	C	.	.			trans	-112.7	150.4	-176.7	76.7	0	0	0	0	111.1	I63 K71	I63-S132 PolarHBondContact O-OG 3.21Å; K71-S132 WeakPolarHBondContact CE-O 3.39Å
133	P	89.3	Confident	89	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.063	C	C	.	.			trans	-67	144.9	-178.8	27.2	-33.4	0	0	0	111.4	T108 S111 F138 E141 V142	T108-P133 WeakPolarHBondContact O-CB 3.38Å; S111-P133 VanDerWaalsContact OG-CD 3.31Å; S111-P133 WeakPolarHBondContact OG-CD 3.39Å; P133-F138 HydrophobicContact CB-CB 3.7Å; P133-F138 HydrophobicContact CB-CD2 4.19Å; P133-F138 HydrophobicContact CB-CG 4.31Å; P133-F138 HydrophobicContact CG-CB 3.53Å; P133-E141 HydrophobicContact CG-CB 3.6Å; P133-V142 HydrophobicContact CG-CG2 3.84Å; P133-V142 WeakPolarHBondContact O-CG2 3.38Å
134	G	80.5	Confident	89	Confident	3 Å²	3	6.2 Å²	6.2	3%	0.031	4%	0.037	C	C	.	.			trans	-95.6	-5.1	-178.2	0	0	0	0	0	114.4	A65 V67 Q165	A65-G134 VanDerWaalsContact O-CA 3.28Å; A65-G134 WeakPolarHBondContact O-CA 3.46Å; V67-G134 VanDerWaalsContact CG2-O 3.27Å; V67-G134 WeakPolarHBondContact CG2-O 3.25Å; V67-G134 PolarHBondContact N-O 3.26Å; G134-Q165 WeakPolarHBondContact O-CG 3.2Å
135	H	83.9	Confident	89	Confident	31 Å²	31	5 Å²	5	14%	0.144	3%	0.028	C	C	.	.	S	Bend	trans	-95.8	137.5	-175.1	-167	-69.4	0	0	0	110.8	V67 D137 F138	V67-H135 HydrophobicContact CG2-CB 3.8Å; H135-D137 VanDerWaalsContact C-N 3.31Å; H135-D137 IonicContact CE1-OD1 2.6Å; H135-D137 PolarHBondContact CE1-OD1 2.87Å; H135-D137 WeakPolarHBondContact ND1-CB 3.49Å; H135-D137 PolarHBondContact ND1-N 3.26Å; H135-D137 IonicContact ND1-OD1 3.32Å; H135-D137 PolarHBondContact O-N 3.31Å; H135-F138 HydrophobicContact CB-CD2 3.92Å; H135-F138 HydrophobicContact CB-CE2 4.28Å; H135-F138 PolarHBondContact O-N 3Å
136	A	80.2	Confident	88.9	Confident	8 Å²	8	4.1 Å²	4.1	7%	0.066	2%	0.024	C	C	.	.	G	3₁₀ helix	trans	-57.2	-38.9	-174.2	0	0	0	0	0	114	F138 S139 Y579 Q960 V962	A136-F138 PolarHBondContact O-N 2.89Å; A136-F138 VanDerWaalsContact O-N 3.1Å; A136-S139 VanDerWaalsContact O-CB 3.24Å; A136-S139 WeakPolarHBondContact O-CB 3.31Å; A136-S139 PolarHBondContact O-N 3.33Å; A136-S139 PolarHBondContact O-OG 3.21Å; A136-Y579 WeakPolarHBondContact CA-OH 2.97Å; A136-Q960 HydrophobicContact CB-CG 4.32Å; A136-V962 HydrophobicContact CB-CG2 4.44Å
137	D	83.9	Confident	88.7	Confident	14 Å²	14	4.2 Å²	4.2	8%	0.075	3%	0.025	C	C	.	.	G	3₁₀ helix	trans	-51.3	-27.6	173.3	-79.4	35.6	0	0	0	115.1	H135 G629 M631 H632	H135-D137 VanDerWaalsContact C-N 3.31Å; H135-D137 IonicContact CE1-OD1 2.6Å; H135-D137 PolarHBondContact CE1-OD1 2.87Å; H135-D137 WeakPolarHBondContact ND1-CB 3.49Å; H135-D137 PolarHBondContact ND1-N 3.26Å; H135-D137 IonicContact ND1-OD1 3.32Å; H135-D137 PolarHBondContact O-N 3.31Å; D137-G629 WeakPolarHBondContact OD2-CA 3.4Å; D137-M631 HydrophobicContact CB-CB 4.48Å; D137-M631 WeakPolarHBondContact OD2-CB 3.35Å; D137-M631 PolarHBondContact OD2-N 3.32Å; D137-M631 VanDerWaalsContact OD2-N 3.1Å; D137-H632 HydrophobicContact CB-CB 4.03Å; D137-H632 PolarHBondContact O-ND1 3.21Å; D137-H632 PolarHBondContact OD2-N 3.35Å
138	F	86.4	Confident	88.6	Confident	3 Å²	3	4.1 Å²	4.1	1%	0.013	2%	0.024	C	C	.	.	G	3₁₀ helix	trans	-104.5	23.8	179.8	-52.1	-58.3	0	0	0	112.6	I107 M109 P133 H135 A136 G140 E141 V142 H632 R635	I107-F138 HydrophobicContact CD1-CE2 4.37Å; M109-F138 HydrophobicContact CB-CD2 4.37Å; M109-F138 HydrophobicContact CB-CE1 4.4Å; M109-F138 HydrophobicContact CB-CE2 4.01Å; M109-F138 HydrophobicContact CB-CZ 4.02Å; M109-F138 HydrophobicContact CG-CD2 4.38Å; M109-F138 HydrophobicContact CG-CE2 3.63Å; M109-F138 HydrophobicContact CG-CZ 3.75Å; M109-F138 HydrophobicContact SD-CE2 4.29Å; M109-F138 HydrophobicContact SD-CZ 3.89Å; P133-F138 HydrophobicContact CB-CB 3.7Å; P133-F138 HydrophobicContact CB-CD2 4.19Å; P133-F138 HydrophobicContact CB-CG 4.31Å; P133-F138 HydrophobicContact CG-CB 3.53Å; H135-F138 HydrophobicContact CB-CD2 3.92Å; H135-F138 HydrophobicContact CB-CE2 4.28Å; H135-F138 PolarHBondContact O-N 3Å; A136-F138 PolarHBondContact O-N 2.89Å; A136-F138 VanDerWaalsContact O-N 3.1Å; F138-G140 PolarHBondContact O-N 3.41Å; F138-G140 VanDerWaalsContact O-N 3.16Å; F138-E141 HydrophobicContact CB-CB 4.5Å; F138-E141 WeakPolarHBondContact O-CB 3.21Å; F138-E141 PolarHBondContact O-N 3.42Å; F138-V142 PolarHBondContact O-N 3Å; F138-H632 HydrophobicContact CE1-CB 4.33Å; F138-R635 HydrophobicContact CE1-CB 4.33Å; F138-R635 VanDerWaalsContact CE1-CD 3.46Å
139	S	84.5	Confident	88.5	Confident	0 Å²	0	4 Å²	4	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-49	-37.8	175.3	50.9	0	0	0	0	114.5	A136 E141 V142 S143 Y579 A580	A136-S139 VanDerWaalsContact O-CB 3.24Å; A136-S139 WeakPolarHBondContact O-CB 3.31Å; A136-S139 PolarHBondContact O-N 3.33Å; A136-S139 PolarHBondContact O-OG 3.21Å; S139-E141 VanDerWaalsContact C-N 3.3Å; S139-E141 PolarHBondContact O-N 2.84Å; S139-V142 WeakPolarHBondContact O-CB 3.48Å; S139-V142 PolarHBondContact O-N 3.26Å; S139-S143 PolarHBondContact O-N 3.27Å; S139-S143 PolarHBondContact O-OG 2.94Å; S139-Y579 VanDerWaalsContact CB-CD1 3.48Å; S139-Y579 VanDerWaalsContact CB-CZ 3.47Å; S139-A580 VanDerWaalsContact OG-CB 3.3Å; S139-A580 WeakPolarHBondContact OG-CB 3.14Å
140	G	85.6	Confident	88.4	Confident	5 Å²	5	4 Å²	4	5%	0.052	2%	0.024	C	C	.	.	H	α-helix	trans	-60.6	-37.1	176.3	0	0	0	0	0	113.9	F138 S143 A144 C612	F138-G140 PolarHBondContact O-N 3.41Å; F138-G140 VanDerWaalsContact O-N 3.16Å; G140-S143 PolarHBondContact O-N 3.04Å; G140-A144 WeakPolarHBondContact O-CB 3.41Å; G140-A144 PolarHBondContact O-N 3.47Å; G140-C612 WeakPolarHBondContact CA-SG 3.5Å
141	E	88.7	Confident	88.4	Confident	7 Å²	7	4 Å²	4	3%	0.033	2%	0.024	C	C	.	.	H	α-helix	trans	-70.4	-34.5	176.1	-82.4	-78.7	-163.3	0	0	111.7	S111 P133 F138 S139 A145 K450	S111-E141 WeakPolarHBondContact CB-OE2 3.4Å; S111-E141 PolarHBondContact N-OE2 3.09Å; S111-E141 PolarHBondContact OG-O 3.34Å; S111-E141 PolarHBondContact OG-OE2 3Å; P133-E141 HydrophobicContact CG-CB 3.6Å; F138-E141 HydrophobicContact CB-CB 4.5Å; F138-E141 WeakPolarHBondContact O-CB 3.21Å; F138-E141 PolarHBondContact O-N 3.42Å; S139-E141 VanDerWaalsContact C-N 3.3Å; S139-E141 PolarHBondContact O-N 2.84Å; E141-A145 WeakPolarHBondContact O-CB 3.33Å; E141-A145 PolarHBondContact O-N 3.17Å; E141-A145 VanDerWaalsContact O-N 3.11Å; E141-K450 VanDerWaalsContact CD-NZ 3.26Å; E141-K450 IonicContact OE1-NZ 3.38Å; E141-K450 PolarHBondContact OE1-NZ 3.4Å; E141-K450 VanDerWaalsContact OE1-NZ 3.08Å; E141-K450 WeakPolarHBondContact OE2-CD 3.46Å; E141-K450 IonicContact OE2-NZ 2.78Å; E141-K450 PolarHBondContact OE2-NZ 2.75Å
142	V	90.7	Very high	88.5	Confident	0 Å²	0	4 Å²	4	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-67.1	-45.9	172.4	-172.6	0	0	0	0	110.6	M64 P133 F138 S139 A145 A146 L172	M64-V142 HydrophobicContact CE-CG1 3.95Å; M64-V142 HydrophobicContact CG-CG1 4.26Å; M64-V142 HydrophobicContact SD-CG1 4.23Å; P133-V142 HydrophobicContact CG-CG2 3.84Å; P133-V142 WeakPolarHBondContact O-CG2 3.38Å; F138-V142 PolarHBondContact O-N 3Å; S139-V142 WeakPolarHBondContact O-CB 3.48Å; S139-V142 PolarHBondContact O-N 3.26Å; V142-A145 PolarHBondContact O-N 3.47Å; V142-A146 VanDerWaalsContact O-CB 3.3Å; V142-A146 WeakPolarHBondContact O-CB 3.26Å; V142-A146 PolarHBondContact O-N 2.91Å; V142-L172 HydrophobicContact CG1-CD2 3.9Å
143	S	89	Confident	88.7	Confident	6 Å²	6	4 Å²	4	4%	0.042	2%	0.024	C	C	.	.	H	α-helix	trans	-61.4	-44.5	176	-64.1	0	0	0	0	112.3	S139 G140 A145 A146 V147	S139-S143 PolarHBondContact O-N 3.27Å; S139-S143 PolarHBondContact O-OG 2.94Å; G140-S143 PolarHBondContact O-N 3.04Å; S143-A145 VanDerWaalsContact C-N 3.32Å; S143-A145 PolarHBondContact O-N 2.96Å; S143-A146 PolarHBondContact O-N 3.07Å; S143-V147 WeakPolarHBondContact O-CG2 3.46Å; S143-V147 PolarHBondContact O-N 2.96Å
144	A	88.7	Confident	89	Confident	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.024	C	C	.	.	H	α-helix	trans	-60.7	-40.6	176.9	0	0	0	0	0	112.1	G140 S449 K450	G140-A144 WeakPolarHBondContact O-CB 3.41Å; G140-A144 PolarHBondContact O-N 3.47Å; A144-S449 WeakPolarHBondContact O-CB 3.47Å; A144-K450 HydrophobicContact CB-CB 4.39Å; A144-K450 HydrophobicContact CB-CD 4.41Å
145	A	90.5	Very high	89.8	Confident	1 Å²	1	4 Å²	4	1%	0.008	2%	0.023	C	C	.	.	H	α-helix	trans	-68.8	-42.2	175.8	0	0	0	0	0	112.9	V130 E141 V142 S143 V147 L148 C149	V130-A145 HydrophobicContact CG1-CB 3.72Å; E141-A145 WeakPolarHBondContact O-CB 3.33Å; E141-A145 PolarHBondContact O-N 3.17Å; E141-A145 VanDerWaalsContact O-N 3.11Å; V142-A145 PolarHBondContact O-N 3.47Å; S143-A145 VanDerWaalsContact C-N 3.32Å; S143-A145 PolarHBondContact O-N 2.96Å; A145-V147 PolarHBondContact O-N 3.45Å; A145-L148 PolarHBondContact O-N 3.35Å; A145-C149 PolarHBondContact O-N 2.87Å; A145-C149 PolarHBondContact O-SG 2.97Å
146	A	91.1	Very high	90.3	Very high	0 Å²	0	2.5 Å²	2.5	0%	0	2%	0.016	C	C	.	.	H	α-helix	trans	-60.4	-43.8	-176.6	0	0	0	0	0	112.7	M64 V142 S143 L148 C149 L172 L178	M64-A146 HydrophobicContact CE-CB 3.49Å; M64-A146 VanDerWaalsContact CE-CB 3.49Å; V142-A146 VanDerWaalsContact O-CB 3.3Å; V142-A146 WeakPolarHBondContact O-CB 3.26Å; V142-A146 PolarHBondContact O-N 2.91Å; S143-A146 PolarHBondContact O-N 3.07Å; A146-L148 PolarHBondContact O-N 3.35Å; A146-C149 PolarHBondContact O-N 3.13Å; A146-C149 VanDerWaalsContact O-N 3.14Å; A146-L172 HydrophobicContact CB-CD2 4.07Å; A146-L172 HydrophobicContact CB-CG 4.35Å; A146-L178 HydrophobicContact CB-CD1 4.15Å
147	V	88.6	Confident	90.9	Very high	2 Å²	2	2.1 Å²	2.1	1%	0.012	1%	0.013	C	C	.	.	H	α-helix	trans	-61.4	-33.5	-177.4	177.4	0	0	0	0	112	S143 A145 E176 R407 L411 F447 C574 L576	S143-V147 WeakPolarHBondContact O-CG2 3.46Å; S143-V147 PolarHBondContact O-N 2.96Å; A145-V147 PolarHBondContact O-N 3.45Å; V147-E176 WeakPolarHBondContact CG2-OE2 3.45Å; V147-R407 PolarHBondContact O-NH2 3.12Å; V147-L411 HydrophobicContact CG1-CD2 4.26Å; V147-F447 HydrophobicContact CB-CE1 4.28Å; V147-F447 HydrophobicContact CG1-CD1 3.87Å; V147-F447 HydrophobicContact CG1-CE1 3.41Å; V147-F447 VanDerWaalsContact CG1-CE1 3.41Å; V147-F447 HydrophobicContact CG1-CZ 4.25Å; V147-C574 HydrophobicContact CG1-CB 4.44Å; V147-L576 HydrophobicContact CB-CD2 4.44Å; V147-L576 HydrophobicContact CG2-CD2 3.66Å
148	L	90.9	Very high	91.3	Very high	0 Å²	0	1.4 Å²	1.4	0%	0	1%	0.009	C	C	.	.	H	α-helix	trans	-77.9	-23.9	179.4	-61.5	-176	0	0	0	113.6	A145 A146 F447 S449 F490 R492 L548	A145-L148 PolarHBondContact O-N 3.35Å; A146-L148 PolarHBondContact O-N 3.35Å; L148-F447 HydrophobicContact CD2-CD1 3.97Å; L148-S449 WeakPolarHBondContact CD1-OG 3.4Å; L148-F490 HydrophobicContact CD1-CD1 3.5Å; L148-F490 HydrophobicContact CD1-CE1 3.43Å; L148-F490 VanDerWaalsContact CD1-CE1 3.43Å; L148-F490 HydrophobicContact CD1-CG 4.19Å; L148-F490 HydrophobicContact CD1-CZ 4.05Å; L148-R492 HydrophobicContact CD2-CB 3.7Å; L148-R492 VanDerWaalsContact O-CD 3.24Å; L148-R492 WeakPolarHBondContact O-CD 3.38Å; L148-R492 PolarHBondContact O-NH1 3.25Å; L148-L548 HydrophobicContact CB-CD2 3.98Å
149	C	93.4	Very high	91.4	Very high	0 Å²	0	1.9 Å²	1.9	0%	0	1%	0.012	C	C	.	.			trans	-96.5	148.1	-169.7	-63	0	0	0	0	113.4	C62 A145 A146 L178 R407	C62-C149 HydrophobicContact CB-CB 4.12Å; A145-C149 PolarHBondContact O-N 2.87Å; A145-C149 PolarHBondContact O-SG 2.97Å; A146-C149 PolarHBondContact O-N 3.13Å; A146-C149 VanDerWaalsContact O-N 3.14Å; C149-L178 VanDerWaalsContact O-CD2 3.28Å; C149-L178 WeakPolarHBondContact O-CD2 3.17Å; C149-R407 PolarHBondContact O-NH1 3.36Å; C149-R407 PolarHBondContact O-NH2 3.44Å
150	D	92.5	Very high	91.3	Very high	2 Å²	2	3.8 Å²	3.8	1%	0.011	2%	0.021	C	C	.	.	S	Bend	trans	-85.6	-25.5	-178.8	-63.2	-47.9	0	0	0	113.7	N60 Q179 P398 L403 R407 R492	N60-D150 WeakPolarHBondContact CB-OD2 3.27Å; N60-D150 PolarHBondContact ND2-OD2 2.94Å; N60-D150 PolarHBondContact O-N 2.62Å; D150-Q179 PolarHBondContact O-N 3.48Å; D150-P398 HydrophobicContact CB-CG 4.44Å; D150-L403 WeakPolarHBondContact OD1-CD2 3.38Å; D150-R407 VanDerWaalsContact CA-NH1 3.31Å; D150-R407 PolarHBondContact O-NH1 3.03Å; D150-R407 IonicContact OD1-NH1 3.71Å; D150-R492 VanDerWaalsContact CG-NH1 3.34Å; D150-R492 IonicContact OD1-CZ 2.68Å; D150-R492 IonicContact OD1-NH1 2.78Å; D150-R492 PolarHBondContact OD1-NH1 3.12Å; D150-R492 IonicContact OD1-NH2 3.49Å; D150-R492 PolarHBondContact OD1-NH2 2.78Å; D150-R492 IonicContact OD2-CZ 3.25Å; D150-R492 IonicContact OD2-NH1 3.92Å; D150-R492 PolarHBondContact OD2-NH1 3.38Å; D150-R492 IonicContact OD2-NH2 3.41Å; D150-R492 PolarHBondContact OD2-NH2 3.31Å; D150-R492 VanDerWaalsContact OD2-NH2 3.15Å
151	G	93	Very high	91.2	Very high	0 Å²	0	3.5 Å²	3.5	0%	0	2%	0.018	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	175.1	176.3	0	0	0	0	0	113.4	N60 V61 C62 Q179	N60-G151 PolarHBondContact O-N 2.9Å; V61-G151 WeakPolarHBondContact CA-O 3.34Å; C62-G151 PolarHBondContact N-O 3.19Å; C62-G151 VanDerWaalsContact N-O 3.1Å; G151-Q179 CarbonylContact C-O 3.42Å; G151-Q179 WeakPolarHBondContact CA-O 3.47Å
152	V	94.9	Very high	91	Very high	1 Å²	1	3.7 Å²	3.7	1%	0.006	2%	0.02	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	134.6	-174	-174.4	0	0	0	0	110.3	C62 M64 A173 L178 Q179 L180 C181	C62-V152 CarbonylContact O-C 3.6Å; C62-V152 WeakPolarHBondContact O-CA 3.25Å; M64-V152 HydrophobicContact CB-CG1 3.68Å; M64-V152 HydrophobicContact CE-CG1 4.49Å; M64-V152 HydrophobicContact CE-CG2 4.15Å; M64-V152 HydrophobicContact CG-CG1 3.6Å; M64-V152 HydrophobicContact SD-CG1 3.71Å; M64-V152 HydrophobicContact SD-CG2 4.22Å; V152-A173 HydrophobicContact CG2-CB 4.06Å; V152-L178 HydrophobicContact CG2-CB 3.85Å; V152-L178 HydrophobicContact CG2-CD1 3.37Å; V152-L178 HydrophobicContact CG2-CG 4.23Å; V152-Q179 PolarHBondContact N-O 2.87Å; V152-L180 HydrophobicContact CB-CD2 3.83Å; V152-L180 HydrophobicContact CG1-CD2 4.45Å; V152-L180 HydrophobicContact CG2-CD2 4.13Å; V152-C181 PolarHBondContact O-N 2.88Å
153	I	96.5	Very high	90.6	Very high	1 Å²	1	3.8 Å²	3.8	1%	0.005	2%	0.02	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	105	160.5	-62.3	164.8	0	0	0	107	V61 C62 I63 M64 L74 L129 V155 C181 V183 V389 V393	V61-I153 HydrophobicContact CG1-CD1 3.72Å; V61-I153 HydrophobicContact CG1-CG1 3.63Å; C62-I153 PolarHBondContact O-N 2.88Å; I63-I153 WeakPolarHBondContact CA-O 3.14Å; I63-I153 HydrophobicContact CG1-CB 4.38Å; I63-I153 HydrophobicContact CG1-CD1 4.36Å; M64-I153 PolarHBondContact N-O 2.58Å; L74-I153 HydrophobicContact CD2-CG2 4.21Å; L129-I153 HydrophobicContact CD1-CD1 4.32Å; I153-V155 HydrophobicContact CG2-CG2 4.1Å; I153-C181 WeakPolarHBondContact CA-O 3.41Å; I153-V183 HydrophobicContact CG2-CB 4.44Å; I153-V183 HydrophobicContact CG2-CG2 3.59Å; I153-V389 HydrophobicContact CD1-CG1 4.04Å; I153-V393 HydrophobicContact CD1-CG2 3.78Å; I153-V393 HydrophobicContact CG1-CG2 4.04Å
154	L	96.1	Very high	90	Very high	2 Å²	2	5 Å²	5	1%	0.01	3%	0.028	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	118.6	175.9	-174.5	66.6	0	0	0	109.3	M64 I156 T166 N169 L170 C181 L182 V183 F257	M64-L154 HydrophobicContact CB-CD1 4.4Å; M64-L154 WeakPolarHBondContact O-CA 3.32Å; L154-I156 HydrophobicContact CD2-CD1 4.22Å; L154-I156 HydrophobicContact CG-CG1 4.3Å; L154-T166 HydrophobicContact CD1-CG2 4.16Å; L154-T166 HydrophobicContact CD2-CG2 4.08Å; L154-T166 HydrophobicContact CG-CG2 4.4Å; L154-N169 HydrophobicContact CD1-CB 4.35Å; L154-L170 HydrophobicContact CD2-CD1 4.3Å; L154-L170 HydrophobicContact CD2-CD2 3.58Å; L154-L170 HydrophobicContact CD2-CG 3.87Å; L154-C181 PolarHBondContact N-O 3.2Å; L154-L182 HydrophobicContact CB-CD1 4.47Å; L154-L182 HydrophobicContact CD2-CD1 4.27Å; L154-L182 HydrophobicContact CG-CD1 4.38Å; L154-V183 PolarHBondContact O-N 3.33Å; L154-F257 HydrophobicContact CD2-CZ 4.12Å
155	V	96.5	Very high	89.7	Confident	0 Å²	0	5 Å²	5	0%	0	3%	0.028	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.5	-179.4	-170.4	0	0	0	0	110.5	I63 M64 A65 H69 L74 I153 V183 N185	I63-V155 HydrophobicContact CG2-CG2 3.77Å; M64-V155 PolarHBondContact O-N 3Å; A65-V155 HydrophobicContact CB-CB 3.86Å; H69-V155 PolarHBondContact ND1-O 2.83Å; H69-V155 VanDerWaalsContact ND1-O 3.12Å; H69-V155 VanDerWaalsContact O-CG1 3.3Å; H69-V155 WeakPolarHBondContact O-CG1 3.38Å; L74-V155 HydrophobicContact CD2-CG2 3.74Å; I153-V155 HydrophobicContact CG2-CG2 4.1Å; V155-V183 WeakPolarHBondContact CA-O 3.49Å; V155-V183 HydrophobicContact CG2-CB 4.46Å; V155-N185 HydrophobicContact CG1-CB 3.68Å
156	I	94.3	Very high	89.6	Confident	0 Å²	0	5 Å²	5	0%	0	3%	0.028	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.1	180	-59.2	-172.8	0	0	0	109.3	L154 V158 G161 V162 T166 L182 V183 L184 N185 V208 A212	L154-I156 HydrophobicContact CD2-CD1 4.22Å; L154-I156 HydrophobicContact CG-CG1 4.3Å; I156-V158 PolarHBondContact O-N 3.17Å; I156-G161 WeakPolarHBondContact CG2-O 3.26Å; I156-V162 HydrophobicContact CD1-CG2 4.29Å; I156-T166 HydrophobicContact CD1-CG2 3.72Å; I156-T166 HydrophobicContact CG1-CG2 4.01Å; I156-L182 HydrophobicContact CB-CD1 4.26Å; I156-L182 HydrophobicContact CD1-CD1 3.47Å; I156-L182 VanDerWaalsContact CD1-CD1 3.47Å; I156-L182 HydrophobicContact CG1-CD1 3.66Å; I156-V183 PolarHBondContact N-O 3.27Å; I156-L184 HydrophobicContact CB-CD2 4.24Å; I156-N185 PolarHBondContact O-N 3.41Å; I156-V208 HydrophobicContact CG2-CG1 3.77Å; I156-A212 HydrophobicContact CD1-CB 4.32Å
157	D	92.9	Very high	89.3	Confident	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	123.6	167.8	-175.5	-22.2	0	0	0	108.8	H69 V159 E160 G161 K186 R189	H69-D157 PolarHBondContact ND1-N 3.06Å; D157-V159 PolarHBondContact O-N 3.5Å; D157-V159 WeakPolarHBondContact OD1-CB 3.46Å; D157-V159 PolarHBondContact OD1-N 2.79Å; D157-E160 HydrophobicContact CB-CB 4.21Å; D157-E160 HydrophobicContact CB-CG 4.37Å; D157-E160 PolarHBondContact O-N 2.97Å; D157-G161 WeakPolarHBondContact O-CA 3.41Å; D157-G161 PolarHBondContact O-N 2.88Å; D157-K186 WeakPolarHBondContact OD2-CD 3.22Å; D157-K186 WeakPolarHBondContact OD2-CE 3.41Å; D157-K186 IonicContact OD2-NZ 2.66Å; D157-K186 PolarHBondContact OD2-NZ 3.47Å; D157-R189 IonicContact OD2-NH1 3.64Å; D157-R189 PolarHBondContact OD2-NH1 2.77Å
158	V	92.3	Very high	89	Confident	0 Å²	0	8.1 Å²	8.1	0%	0	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-20.2	-179.5	-61.6	0	0	0	0	113.3	I156 L184 N185 I187 L190 R204 L205	I156-V158 PolarHBondContact O-N 3.17Å; V158-L184 HydrophobicContact CG1-CB 3.76Å; V158-L184 HydrophobicContact CG1-CD2 4.45Å; V158-N185 WeakPolarHBondContact CG1-O 3.47Å; V158-N185 WeakPolarHBondContact CG2-O 3.41Å; V158-N185 PolarHBondContact N-O 2.94Å; V158-I187 HydrophobicContact CG1-CG1 3.95Å; V158-I187 HydrophobicContact CG2-CG1 4.06Å; V158-L190 HydrophobicContact CB-CD1 4.4Å; V158-L190 HydrophobicContact CG2-CD1 3.78Å; V158-L190 HydrophobicContact CG2-CD2 3.97Å; V158-L190 HydrophobicContact CG2-CG 3.72Å; V158-R204 PolarHBondContact O-NE 2.87Å; V158-R204 PolarHBondContact O-NH2 3.4Å; V158-L205 HydrophobicContact CB-CD2 4.15Å; V158-L205 HydrophobicContact CG1-CD2 3.53Å
159	V	87.7	Confident	89	Confident	12 Å²	12	8.3 Å²	8.3	7%	0.073	5%	0.047	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-36.2	175.4	-178.1	0	0	0	0	111.4	D157 R189 L190 I928	D157-V159 PolarHBondContact O-N 3.5Å; D157-V159 WeakPolarHBondContact OD1-CB 3.46Å; D157-V159 PolarHBondContact OD1-N 2.79Å; V159-R189 HydrophobicContact CG2-CB 3.54Å; V159-R189 HydrophobicContact CG2-CG 4.48Å; V159-L190 HydrophobicContact CG2-CD2 4.03Å; V159-I928 HydrophobicContact CG1-CG2 4.4Å; V159-I928 WeakPolarHBondContact O-CD1 3.45Å
160	E	82.4	Confident	88.9	Confident	40 Å²	40	8.4 Å²	8.4	19%	0.187	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-38	178.5	-63.8	179.6	-159.2	0	0	111.3	H69 D157	H69-E160 IonicContact CD2-OE2 3.87Å; H69-E160 IonicContact NE2-OE2 2.86Å; H69-E160 PolarHBondContact NE2-OE2 3.46Å; D157-E160 HydrophobicContact CB-CB 4.21Å; D157-E160 HydrophobicContact CB-CG 4.37Å; D157-E160 PolarHBondContact O-N 2.97Å
161	G	85	Confident	88.6	Confident	0 Å²	0	14.2 Å²	14.2	0%	0	7%	0.07	C	C	.	.			trans	79.8	-149	-177	0	0	0	0	0	112.7	I156 D157 C163 R204	I156-G161 WeakPolarHBondContact CG2-O 3.26Å; D157-G161 WeakPolarHBondContact O-CA 3.41Å; D157-G161 PolarHBondContact O-N 2.88Å; G161-C163 PolarHBondContact O-N 3.36Å; G161-R204 VanDerWaalsContact CA-NH2 3.33Å
162	V	84.6	Confident	88.3	Confident	11 Å²	11	14.9 Å²	14.9	7%	0.067	7%	0.073	C	C	.	.	S	Bend	trans	-76.9	119.6	179.1	-177.5	0	0	0	0	109.7	I156 T166 I167 Q211 A212 V215 K925	I156-V162 HydrophobicContact CD1-CG2 4.29Å; V162-T166 HydrophobicContact CG1-CG2 4.14Å; V162-I167 HydrophobicContact CG1-CD1 4.48Å; V162-I167 HydrophobicContact CG1-CG1 3.9Å; V162-Q211 HydrophobicContact CB-CB 4.21Å; V162-Q211 HydrophobicContact CG2-CB 3.61Å; V162-A212 HydrophobicContact CG2-CB 4.13Å; V162-V215 HydrophobicContact CG1-CG2 4.33Å; V162-K925 PolarHBondContact O-NZ 3.34Å
163	C	82.5	Confident	88.1	Confident	1 Å²	1	14.9 Å²	14.9	1%	0.007	7%	0.074	C	C	.	.			trans	-108.6	164.2	179.7	-62.9	0	0	0	0	110.8	H66 G161 Q165 T166 I167 Q899	H66-C163 HydrophobicContact CB-CB 4.27Å; H66-C163 VanDerWaalsContact CD2-CB 3.45Å; H66-C163 WeakPolarHBondContact CD2-CB 3.35Å; G161-C163 PolarHBondContact O-N 3.36Å; C163-Q165 VanDerWaalsContact C-N 3.28Å; C163-Q165 PolarHBondContact O-N 3.1Å; C163-T166 WeakPolarHBondContact O-CA 3.31Å; C163-T166 WeakPolarHBondContact O-CB 3.48Å; C163-T166 PolarHBondContact O-N 3.06Å; C163-I167 PolarHBondContact O-N 2.83Å; C163-Q899 PolarHBondContact SG-NE2 3.05Å; C163-Q899 VanDerWaalsContact SG-NE2 3.43Å
164	P	74.8	Confident	87.5	Confident	32 Å²	32	16.4 Å²	16.4	21%	0.208	8%	0.079	C	C	.	.	H	α-helix	trans	-59.1	-35.3	-176.3	-23.3	32.5	0	0	0	113.8	T166 I167 A168 T897	P164-T166 VanDerWaalsContact C-N 3.32Å; P164-T166 PolarHBondContact O-N 2.85Å; P164-I167 WeakPolarHBondContact O-CB 3.24Å; P164-I167 PolarHBondContact O-N 3Å; P164-A168 PolarHBondContact O-N 3.12Å; P164-T897 HydrophobicContact CG-CG2 3.54Å
165	Q	82.8	Confident	86.8	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-65.6	-34.6	173.1	-167.3	63.7	41.4	0	0	112.8	H66 G134 C163 I167 A168 N169 Y579	H66-Q165 HydrophobicContact CB-CB 4.16Å; H66-Q165 VanDerWaalsContact ND1-CB 3.31Å; H66-Q165 WeakPolarHBondContact ND1-CB 3.3Å; G134-Q165 WeakPolarHBondContact O-CG 3.2Å; C163-Q165 VanDerWaalsContact C-N 3.28Å; C163-Q165 PolarHBondContact O-N 3.1Å; Q165-I167 VanDerWaalsContact C-N 3.3Å; Q165-I167 PolarHBondContact O-N 3.37Å; Q165-A168 PolarHBondContact O-N 3.28Å; Q165-N169 PolarHBondContact NE2-OD1 3.08Å; Q165-N169 WeakPolarHBondContact O-CB 3.45Å; Q165-N169 PolarHBondContact O-N 2.91Å; Q165-N169 PolarHBondContact O-ND2 3.45Å; Q165-N169 PolarHBondContact O-OD1 3.34Å; Q165-Y579 PolarHBondContact NE2-OH 3.29Å; Q165-Y579 VanDerWaalsContact NE2-OH 3.09Å; Q165-Y579 PolarHBondContact OE1-OH 2.66Å
166	T	87.8	Confident	86.2	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60.8	-43.6	173.6	-52.8	0	0	0	0	110.1	L154 I156 V162 C163 P164 N169 L170	L154-T166 HydrophobicContact CD1-CG2 4.16Å; L154-T166 HydrophobicContact CD2-CG2 4.08Å; L154-T166 HydrophobicContact CG-CG2 4.4Å; I156-T166 HydrophobicContact CD1-CG2 3.72Å; I156-T166 HydrophobicContact CG1-CG2 4.01Å; V162-T166 HydrophobicContact CG1-CG2 4.14Å; C163-T166 WeakPolarHBondContact O-CA 3.31Å; C163-T166 WeakPolarHBondContact O-CB 3.48Å; C163-T166 PolarHBondContact O-N 3.06Å; P164-T166 VanDerWaalsContact C-N 3.32Å; P164-T166 PolarHBondContact O-N 2.85Å; T166-N169 PolarHBondContact O-N 3.25Å; T166-L170 HydrophobicContact CG2-CD1 4.33Å; T166-L170 WeakPolarHBondContact O-CB 3.41Å; T166-L170 WeakPolarHBondContact O-CG 3.33Å; T166-L170 PolarHBondContact O-N 3.43Å
167	I	85.5	Confident	85.8	Confident	51 Å²	51	23.1 Å²	23.1	26%	0.262	11%	0.109	S	C	.	.	H	α-helix	trans	-62.9	-45.1	175.6	-58.1	174.1	0	0	0	110.8	V162 C163 P164 Q165 N169 L170 R171 V215	V162-I167 HydrophobicContact CG1-CD1 4.48Å; V162-I167 HydrophobicContact CG1-CG1 3.9Å; C163-I167 PolarHBondContact O-N 2.83Å; P164-I167 WeakPolarHBondContact O-CB 3.24Å; P164-I167 PolarHBondContact O-N 3Å; Q165-I167 VanDerWaalsContact C-N 3.3Å; Q165-I167 PolarHBondContact O-N 3.37Å; I167-N169 PolarHBondContact O-N 3.46Å; I167-L170 PolarHBondContact O-N 3.27Å; I167-R171 WeakPolarHBondContact O-CB 3.43Å; I167-R171 WeakPolarHBondContact O-CG 3.46Å; I167-R171 PolarHBondContact O-N 2.97Å; I167-V215 HydrophobicContact CB-CG1 4.46Å; I167-V215 HydrophobicContact CD1-CG2 4.41Å; I167-V215 HydrophobicContact CG1-CG1 4.31Å; I167-V215 HydrophobicContact CG1-CG2 4.04Å; I167-V215 HydrophobicContact CG2-CG1 4.02Å
168	A	83.7	Confident	85.7	Confident	17 Å²	17	23.3 Å²	23.3	14%	0.14	11%	0.11	C	C	.	.	H	α-helix	trans	-62	-41.3	177	0	0	0	0	0	112.3	P164 Q165 R171 L172 Y579	P164-A168 PolarHBondContact O-N 3.12Å; Q165-A168 PolarHBondContact O-N 3.28Å; A168-R171 PolarHBondContact O-N 3.34Å; A168-L172 WeakPolarHBondContact O-CB 3.35Å; A168-L172 PolarHBondContact O-N 2.79Å; A168-Y579 HydrophobicContact CB-CE1 4.36Å; A168-Y579 HydrophobicContact CB-CE2 4.26Å
169	N	90.4	Very high	85.6	Confident	3 Å²	3	25.9 Å²	25.9	2%	0.016	12%	0.122	C	C	.	.	H	α-helix	trans	-67.4	-40.6	177	-67.5	-13.1	0	0	0	111.6	M64 A65 L154 Q165 T166 I167 L172 A173	M64-N169 HydrophobicContact CB-CB 4.14Å; M64-N169 HydrophobicContact SD-CB 3.93Å; A65-N169 PolarHBondContact N-ND2 3.08Å; A65-N169 PolarHBondContact O-ND2 3.35Å; L154-N169 HydrophobicContact CD1-CB 4.35Å; Q165-N169 PolarHBondContact NE2-OD1 3.08Å; Q165-N169 WeakPolarHBondContact O-CB 3.45Å; Q165-N169 PolarHBondContact O-N 2.91Å; Q165-N169 PolarHBondContact O-ND2 3.45Å; Q165-N169 PolarHBondContact O-OD1 3.34Å; T166-N169 PolarHBondContact O-N 3.25Å; I167-N169 PolarHBondContact O-N 3.46Å; N169-L172 PolarHBondContact O-N 2.83Å; N169-A173 WeakPolarHBondContact O-CB 3.44Å; N169-A173 PolarHBondContact O-N 2.91Å
170	L	89.9	Confident	85.8	Confident	3 Å²	3	26.1 Å²	26.1	2%	0.016	12%	0.123	C	C	.	.	H	α-helix	trans	-61.8	-47.1	173.3	-78.2	170.6	0	0	0	111.4	L154 T166 I167 L172 A173 W174 L180 V215 L219 F257	L154-L170 HydrophobicContact CD2-CD1 4.3Å; L154-L170 HydrophobicContact CD2-CD2 3.58Å; L154-L170 HydrophobicContact CD2-CG 3.87Å; T166-L170 HydrophobicContact CG2-CD1 4.33Å; T166-L170 WeakPolarHBondContact O-CB 3.41Å; T166-L170 WeakPolarHBondContact O-CG 3.33Å; T166-L170 PolarHBondContact O-N 3.43Å; I167-L170 PolarHBondContact O-N 3.27Å; L170-L172 VanDerWaalsContact C-N 3.32Å; L170-L172 PolarHBondContact O-N 2.86Å; L170-A173 PolarHBondContact O-N 2.82Å; L170-W174 VanDerWaalsContact O-CB 3.28Å; L170-W174 WeakPolarHBondContact O-CB 3.42Å; L170-W174 PolarHBondContact O-N 3.5Å; L170-L180 HydrophobicContact CD2-CD1 3.73Å; L170-V215 HydrophobicContact CB-CG1 4.34Å; L170-V215 HydrophobicContact CD1-CB 4.08Å; L170-V215 HydrophobicContact CD1-CG1 3.73Å; L170-L219 HydrophobicContact CB-CD1 4.37Å; L170-F257 HydrophobicContact CD2-CE2 4.1Å; L170-F257 HydrophobicContact CD2-CZ 3.95Å
171	R	86.5	Confident	86.4	Confident	124 Å²	124	24.2 Å²	24.2	47%	0.468	11%	0.114	S	C	.	.	H	α-helix	trans	-58.2	-43.2	174.7	-79.9	173.8	178.3	-177.7	-0.2	112.1	I167 A168 K175 E218 L219	I167-R171 WeakPolarHBondContact O-CB 3.43Å; I167-R171 WeakPolarHBondContact O-CG 3.46Å; I167-R171 PolarHBondContact O-N 2.97Å; A168-R171 PolarHBondContact O-N 3.34Å; R171-K175 WeakPolarHBondContact O-CB 3.4Å; R171-K175 PolarHBondContact O-N 3.1Å; R171-E218 IonicContact NH2-OE1 3.35Å; R171-E218 PolarHBondContact NH2-OE1 3.37Å; R171-L219 HydrophobicContact CG-CD1 4.12Å; R171-L219 HydrophobicContact CG-CD2 3.56Å; R171-L219 HydrophobicContact CG-CG 4.45Å
172	L	87.6	Confident	86.9	Confident	14 Å²	14	24.2 Å²	24.2	7%	0.073	11%	0.114	C	C	.	.	H	α-helix	trans	-64.6	-49.2	176.7	-179.4	63.9	0	0	0	111.3	M64 V142 A146 A168 N169 L170 W174 K175 E176	M64-L172 HydrophobicContact CE-CD2 4.15Å; V142-L172 HydrophobicContact CG1-CD2 3.9Å; A146-L172 HydrophobicContact CB-CD2 4.07Å; A146-L172 HydrophobicContact CB-CG 4.35Å; A168-L172 WeakPolarHBondContact O-CB 3.35Å; A168-L172 PolarHBondContact O-N 2.79Å; N169-L172 PolarHBondContact O-N 2.83Å; L170-L172 VanDerWaalsContact C-N 3.32Å; L170-L172 PolarHBondContact O-N 2.86Å; L172-W174 VanDerWaalsContact C-N 3.28Å; L172-W174 PolarHBondContact O-N 2.85Å; L172-K175 PolarHBondContact O-N 2.71Å; L172-E176 HydrophobicContact CD1-CG 4.09Å; L172-E176 HydrophobicContact CG-CG 4.46Å; L172-E176 WeakPolarHBondContact O-CB 3.36Å; L172-E176 VanDerWaalsContact O-CG 3.29Å; L172-E176 WeakPolarHBondContact O-CG 3.35Å; L172-E176 PolarHBondContact O-N 3.42Å
173	A	89.4	Confident	87.5	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.008	11%	0.111	C	C	.	.	H	α-helix	trans	-61.7	-37.9	178.7	0	0	0	0	0	112.1	V152 N169 L170 E176 D177 L178 L180	V152-A173 HydrophobicContact CG2-CB 4.06Å; N169-A173 WeakPolarHBondContact O-CB 3.44Å; N169-A173 PolarHBondContact O-N 2.91Å; L170-A173 PolarHBondContact O-N 2.82Å; A173-E176 CarbonylContact O-C 3.59Å; A173-E176 PolarHBondContact O-N 3.03Å; A173-D177 PolarHBondContact O-N 2.79Å; A173-L178 HydrophobicContact CB-CB 4.2Å; A173-L178 HydrophobicContact CB-CD1 4.23Å; A173-L178 HydrophobicContact CB-CG 4.44Å; A173-L178 PolarHBondContact O-N 3.45Å; A173-L180 HydrophobicContact CB-CD2 3.54Å; A173-L180 HydrophobicContact CB-CG 4.49Å
174	W	85.4	Confident	88.2	Confident	32 Å²	32	23.7 Å²	23.7	12%	0.121	11%	0.111	C	C	.	.	H	α-helix	trans	-64	-50.6	174.4	-170.2	-102.7	0	0	0	112	L170 L172 E176 D177 T216 L219 F220 R223 H255	L170-W174 VanDerWaalsContact O-CB 3.28Å; L170-W174 WeakPolarHBondContact O-CB 3.42Å; L170-W174 PolarHBondContact O-N 3.5Å; L172-W174 VanDerWaalsContact C-N 3.28Å; L172-W174 PolarHBondContact O-N 2.85Å; W174-E176 PolarHBondContact O-N 3.32Å; W174-D177 PolarHBondContact O-N 3.33Å; W174-T216 HydrophobicContact CZ3-CG2 4.47Å; W174-L219 HydrophobicContact CB-CD1 3.95Å; W174-L219 HydrophobicContact CD2-CB 4.04Å; W174-L219 HydrophobicContact CG-CB 4.02Å; W174-L219 HydrophobicContact CG-CD1 4.14Å; W174-L219 PolarHBondContact NE1-O 3.46Å; W174-F220 HydrophobicContact CH2-CB 4.42Å; W174-F220 AromaticContact CH2-CD2 3.93Å; W174-F220 HydrophobicContact CH2-CD2 3.93Å; W174-F220 HydrophobicContact CZ2-CB 4.42Å; W174-F220 HydrophobicContact CZ2-CD2 4.2Å; W174-R223 HydrophobicContact CZ2-CB 4.41Å; W174-H255 HydrophobicContact CH2-CB 4.38Å; W174-H255 HydrophobicContact CZ3-CB 3.86Å; W174-H255 AromaticContact CZ3-CG 3.61Å; W174-H255 AromaticContact CZ3-ND1 3.67Å
175	K	81.5	Confident	89.2	Confident	116 Å²	116	22.3 Å²	22.3	50%	0.504	10%	0.102	S	C	.	.	H	α-helix	trans	-58.7	-35.4	175.5	-177.4	179.2	178.9	-178.9	0	111.7	R171 L172 D177 R410	R171-K175 WeakPolarHBondContact O-CB 3.4Å; R171-K175 PolarHBondContact O-N 3.1Å; L172-K175 PolarHBondContact O-N 2.71Å; K175-D177 VanDerWaalsContact C-N 3.31Å; K175-R410 WeakPolarHBondContact O-CD 3.41Å; K175-R410 VanDerWaalsContact O-CZ 3.32Å; K175-R410 PolarHBondContact O-NE 2.87Å; K175-R410 PolarHBondContact O-NH1 3.46Å
176	E	83.5	Confident	89.8	Confident	11 Å²	11	23.6 Å²	23.6	5%	0.051	11%	0.107	C	C	.	.	H	α-helix	trans	-82.5	-6.9	179.4	-66.2	-62.3	126.9	0	0	114.1	V147 L172 A173 W174 L178 R410	V147-E176 WeakPolarHBondContact CG2-OE2 3.45Å; L172-E176 HydrophobicContact CD1-CG 4.09Å; L172-E176 HydrophobicContact CG-CG 4.46Å; L172-E176 WeakPolarHBondContact O-CB 3.36Å; L172-E176 VanDerWaalsContact O-CG 3.29Å; L172-E176 WeakPolarHBondContact O-CG 3.35Å; L172-E176 PolarHBondContact O-N 3.42Å; A173-E176 CarbonylContact O-C 3.59Å; A173-E176 PolarHBondContact O-N 3.03Å; W174-E176 PolarHBondContact O-N 3.32Å; E176-L178 VanDerWaalsContact C-N 3.34Å; E176-L178 HydrophobicContact CB-CD1 4.11Å; E176-L178 HydrophobicContact CB-CD2 3.93Å; E176-L178 HydrophobicContact CB-CG 3.7Å; E176-R410 VanDerWaalsContact CA-CZ 3.43Å; E176-R410 VanDerWaalsContact CA-NH2 3.26Å; E176-R410 VanDerWaalsContact CD-NH2 3.29Å; E176-R410 PolarHBondContact O-NH2 3.46Å; E176-R410 IonicContact OE1-CZ 2.76Å; E176-R410 IonicContact OE1-NH1 3.65Å; E176-R410 PolarHBondContact OE1-NH1 3.25Å; E176-R410 IonicContact OE1-NH2 2.58Å; E176-R410 IonicContact OE2-CZ 2.7Å; E176-R410 IonicContact OE2-NH1 3.85Å; E176-R410 PolarHBondContact OE2-NH1 3.43Å; E176-R410 IonicContact OE2-NH2 3.77Å; E176-R410 PolarHBondContact OE2-NH2 3.2Å
177	D	86.4	Confident	90.1	Very high	17 Å²	17	23.6 Å²	23.6	9%	0.091	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	45.9	-174.1	-156.6	56.9	0	0	0	112.2	A173 W174 K175 R223 S404 R407	A173-D177 PolarHBondContact O-N 2.79Å; W174-D177 PolarHBondContact O-N 3.33Å; K175-D177 VanDerWaalsContact C-N 3.31Å; D177-R223 IonicContact OD1-NH1 3.44Å; D177-R223 PolarHBondContact OD1-NH1 3.5Å; D177-S404 WeakPolarHBondContact OD2-CB 3.4Å; D177-S404 PolarHBondContact OD2-OG 3.32Å; D177-R407 HydrophobicContact CB-CB 4.09Å
178	L	89.4	Confident	90.5	Very high	3 Å²	3	21.3 Å²	21.3	2%	0.016	10%	0.096	C	C	.	.			trans	-86.5	142.7	178.3	-50.6	-175	0	0	0	110.9	M64 A146 C149 V152 A173 E176	M64-L178 HydrophobicContact CE-CD1 4.43Å; A146-L178 HydrophobicContact CB-CD1 4.15Å; C149-L178 VanDerWaalsContact O-CD2 3.28Å; C149-L178 WeakPolarHBondContact O-CD2 3.17Å; V152-L178 HydrophobicContact CG2-CB 3.85Å; V152-L178 HydrophobicContact CG2-CD1 3.37Å; V152-L178 HydrophobicContact CG2-CG 4.23Å; A173-L178 HydrophobicContact CB-CB 4.2Å; A173-L178 HydrophobicContact CB-CD1 4.23Å; A173-L178 HydrophobicContact CB-CG 4.44Å; A173-L178 PolarHBondContact O-N 3.45Å; E176-L178 VanDerWaalsContact C-N 3.34Å; E176-L178 HydrophobicContact CB-CD1 4.11Å; E176-L178 HydrophobicContact CB-CD2 3.93Å; E176-L178 HydrophobicContact CB-CG 3.7Å
179	Q	91	Very high	90.9	Very high	54 Å²	54	22.8 Å²	22.8	25%	0.252	10%	0.098	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	133.9	171.7	-67.9	-64.8	-46.2	0	0	110.2	D150 G151 V152 L397 P398	D150-Q179 PolarHBondContact O-N 3.48Å; G151-Q179 CarbonylContact C-O 3.42Å; G151-Q179 WeakPolarHBondContact CA-O 3.47Å; V152-Q179 PolarHBondContact N-O 2.87Å; Q179-L397 HydrophobicContact CB-CD2 3.76Å; Q179-L397 WeakPolarHBondContact O-CD2 3.32Å; Q179-P398 HydrophobicContact CB-CG 4.37Å; Q179-P398 HydrophobicContact CG-CG 3.89Å
180	L	92.4	Very high	91	Very high	18 Å²	18	22.7 Å²	22.7	9%	0.094	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.1	-170.5	-65.2	173.9	0	0	0	111.3	V152 L170 A173 F257	V152-L180 HydrophobicContact CB-CD2 3.83Å; V152-L180 HydrophobicContact CG1-CD2 4.45Å; V152-L180 HydrophobicContact CG2-CD2 4.13Å; L170-L180 HydrophobicContact CD2-CD1 3.73Å; A173-L180 HydrophobicContact CB-CD2 3.54Å; A173-L180 HydrophobicContact CB-CG 4.49Å; L180-F257 HydrophobicContact CB-CE1 3.79Å; L180-F257 HydrophobicContact CB-CZ 4.06Å; L180-F257 HydrophobicContact CD1-CZ 3.98Å
181	C	94.5	Very high	91.1	Very high	0 Å²	0	23 Å²	23	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	131.3	166.5	-65.7	0	0	0	0	109.3	V152 I153 L154 M392 L397	V152-C181 PolarHBondContact O-N 2.88Å; I153-C181 WeakPolarHBondContact CA-O 3.41Å; L154-C181 PolarHBondContact N-O 3.2Å; C181-M392 HydrophobicContact CB-CE 3.59Å; C181-M392 HydrophobicContact CB-CG 4.24Å; C181-M392 HydrophobicContact CB-SD 3.94Å; C181-L397 VanDerWaalsContact SG-CD2 3.54Å
182	L	95.9	Very high	91.2	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	131.7	-177.1	177.4	63.1	0	0	0	111.1	L154 I156 L184 L209 F257 N263 V264 A265	L154-L182 HydrophobicContact CB-CD1 4.47Å; L154-L182 HydrophobicContact CD2-CD1 4.27Å; L154-L182 HydrophobicContact CG-CD1 4.38Å; I156-L182 HydrophobicContact CB-CD1 4.26Å; I156-L182 HydrophobicContact CD1-CD1 3.47Å; I156-L182 VanDerWaalsContact CD1-CD1 3.47Å; I156-L182 HydrophobicContact CG1-CD1 3.66Å; L182-L184 HydrophobicContact CD1-CD2 4.22Å; L182-L184 HydrophobicContact CD2-CD2 3.97Å; L182-L184 HydrophobicContact CD2-CG 4.3Å; L182-L184 HydrophobicContact CG-CD2 4.11Å; L182-L184 HydrophobicContact CG-CG 4.33Å; L182-L209 HydrophobicContact CD2-CD1 3.73Å; L182-F257 HydrophobicContact CB-CD1 3.48Å; L182-F257 VanDerWaalsContact CB-CD1 3.48Å; L182-F257 HydrophobicContact CB-CE1 3.7Å; L182-F257 HydrophobicContact CB-CG 4.07Å; L182-F257 HydrophobicContact CB-CZ 4.46Å; L182-F257 HydrophobicContact CD2-CB 3.98Å; L182-F257 HydrophobicContact CD2-CD1 4.17Å; L182-F257 HydrophobicContact CD2-CD2 4.23Å; L182-F257 HydrophobicContact CD2-CG 3.87Å; L182-F257 HydrophobicContact CG-CD1 4.42Å; L182-N263 PolarHBondContact N-O 2.82Å; L182-V264 HydrophobicContact CB-CG1 4.44Å; L182-V264 HydrophobicContact CB-CG2 4.35Å; L182-V264 HydrophobicContact CD2-CG1 4.19Å; L182-V264 HydrophobicContact CD2-CG2 4.36Å; L182-V264 HydrophobicContact CG-CG1 4.31Å; L182-V264 CarbonylContact O-C 3.52Å; L182-V264 WeakPolarHBondContact O-CA 3.32Å; L182-A265 PolarHBondContact O-N 3.21Å
183	V	97.2	Very high	91.3	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	109.6	170	-179.2	0	0	0	0	108.5	L74 I153 L154 V155 I156 N185 A265 A267 V389 M392	L74-V183 HydrophobicContact CD2-CG1 4.31Å; L74-V183 HydrophobicContact CD2-CG2 4.46Å; I153-V183 HydrophobicContact CG2-CB 4.44Å; I153-V183 HydrophobicContact CG2-CG2 3.59Å; L154-V183 PolarHBondContact O-N 3.33Å; V155-V183 WeakPolarHBondContact CA-O 3.49Å; V155-V183 HydrophobicContact CG2-CB 4.46Å; I156-V183 PolarHBondContact N-O 3.27Å; V183-N185 PolarHBondContact O-N 2.79Å; V183-A265 WeakPolarHBondContact CA-O 2.96Å; V183-A265 HydrophobicContact CG2-CB 4.4Å; V183-A267 HydrophobicContact CG1-CB 3.75Å; V183-V389 HydrophobicContact CG2-CG2 4.37Å; V183-M392 HydrophobicContact CG2-CE 3.73Å
184	L	96.8	Very high	91.1	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	103.2	170.9	-65	-176.8	0	0	0	108.4	I156 V158 L182 L205 V208 V264 A265 F266 A267	I156-L184 HydrophobicContact CB-CD2 4.24Å; V158-L184 HydrophobicContact CG1-CB 3.76Å; V158-L184 HydrophobicContact CG1-CD2 4.45Å; L182-L184 HydrophobicContact CD1-CD2 4.22Å; L182-L184 HydrophobicContact CD2-CD2 3.97Å; L182-L184 HydrophobicContact CD2-CG 4.3Å; L182-L184 HydrophobicContact CG-CD2 4.11Å; L182-L184 HydrophobicContact CG-CG 4.33Å; L184-L205 HydrophobicContact CD1-CD2 4.06Å; L184-V208 HydrophobicContact CD2-CG1 3.75Å; L184-V264 HydrophobicContact CD1-CG1 4.21Å; L184-V264 HydrophobicContact CG-CG1 4.24Å; L184-A265 PolarHBondContact N-O 2.93Å; L184-F266 HydrophobicContact CB-CD1 4.37Å; L184-F266 HydrophobicContact CD1-CD1 4.02Å; L184-F266 HydrophobicContact CD1-CE1 3.71Å; L184-A267 PolarHBondContact O-N 3.49Å
185	N	96.3	Very high	91.3	Very high	3 Å²	3	33 Å²	33	2%	0.016	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	166.3	-172.5	-167.2	29.2	0	0	0	112.1	H69 V155 I156 V158 V183 I187 A267 A269	H69-N185 PolarHBondContact O-ND2 3.14Å; V155-N185 HydrophobicContact CG1-CB 3.68Å; I156-N185 PolarHBondContact O-N 3.41Å; V158-N185 WeakPolarHBondContact CG1-O 3.47Å; V158-N185 WeakPolarHBondContact CG2-O 3.41Å; V158-N185 PolarHBondContact N-O 2.94Å; V183-N185 PolarHBondContact O-N 2.79Å; N185-I187 VanDerWaalsContact C-N 3.33Å; N185-I187 PolarHBondContact O-N 3.45Å; N185-A267 CarbonylContact C-O 3.51Å; N185-A267 WeakPolarHBondContact CA-O 3.48Å; N185-A269 PolarHBondContact OD1-N 3.15Å
186	K	94.4	Very high	91.8	Very high	27 Å²	27	29 Å²	29	12%	0.117	14%	0.136	C	C	.	.			trans	62.8	31.4	179.4	-48.5	-153.9	-155.1	155.7	0	115	D68 D157 D188 R189 A267	D68-K186 WeakPolarHBondContact O-CE 3.33Å; D68-K186 PolarHBondContact O-NZ 3.38Å; D68-K186 IonicContact OD2-NZ 3.24Å; D68-K186 PolarHBondContact OD2-NZ 3.36Å; D157-K186 WeakPolarHBondContact OD2-CD 3.22Å; D157-K186 WeakPolarHBondContact OD2-CE 3.41Å; D157-K186 IonicContact OD2-NZ 2.66Å; D157-K186 PolarHBondContact OD2-NZ 3.47Å; K186-D188 VanDerWaalsContact C-OD1 3.3Å; K186-D188 VanDerWaalsContact CA-OD1 3.26Å; K186-D188 WeakPolarHBondContact CA-OD1 3.44Å; K186-D188 PolarHBondContact O-N 2.87Å; K186-R189 HydrophobicContact CB-CG 4.1Å; K186-R189 WeakPolarHBondContact O-CB 3.39Å; K186-R189 PolarHBondContact O-N 2.87Å; K186-A267 PolarHBondContact N-O 2.82Å
187	I	95.3	Very high	92.2	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-60.1	-26	175.9	-63	174.6	0	0	0	112	V158 N185 R189 L190 F191 L205 F266 A267 W273	V158-I187 HydrophobicContact CG1-CG1 3.95Å; V158-I187 HydrophobicContact CG2-CG1 4.06Å; N185-I187 VanDerWaalsContact C-N 3.33Å; N185-I187 PolarHBondContact O-N 3.45Å; I187-R189 PolarHBondContact O-N 2.76Å; I187-L190 HydrophobicContact CG2-CD1 4.37Å; I187-L190 WeakPolarHBondContact O-CB 3.49Å; I187-L190 PolarHBondContact O-N 2.83Å; I187-L190 VanDerWaalsContact O-N 3.14Å; I187-F191 HydrophobicContact CG2-CE2 3.93Å; I187-L205 HydrophobicContact CD1-CD2 4.18Å; I187-L205 HydrophobicContact CG1-CD2 4.22Å; I187-F266 HydrophobicContact CD1-CB 3.6Å; I187-F266 HydrophobicContact CD1-CD1 3.97Å; I187-F266 HydrophobicContact CD1-CG 4.29Å; I187-A267 PolarHBondContact N-O 2.64Å; I187-W273 HydrophobicContact CB-CH2 3.81Å; I187-W273 HydrophobicContact CB-CZ2 4.12Å; I187-W273 HydrophobicContact CD1-CH2 4.02Å; I187-W273 HydrophobicContact CD1-CZ3 4.48Å; I187-W273 HydrophobicContact CG1-CH2 4.47Å; I187-W273 HydrophobicContact CG2-CH2 3.89Å; I187-W273 HydrophobicContact CG2-CZ2 4.27Å
188	D	93.1	Very high	92.5	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.016	16%	0.156	C	C	.	.	H	α-helix	trans	-54.6	-36.4	172.8	57.8	-67	0	0	0	113.1	K186 L190 F191 T192 S268 Y338 R372	K186-D188 VanDerWaalsContact C-OD1 3.3Å; K186-D188 VanDerWaalsContact CA-OD1 3.26Å; K186-D188 WeakPolarHBondContact CA-OD1 3.44Å; K186-D188 PolarHBondContact O-N 2.87Å; D188-L190 VanDerWaalsContact C-N 3.27Å; D188-L190 PolarHBondContact O-N 2.89Å; D188-F191 PolarHBondContact O-N 3.12Å; D188-T192 WeakPolarHBondContact O-CB 3.25Å; D188-T192 WeakPolarHBondContact O-CG2 3.48Å; D188-T192 PolarHBondContact O-N 3.33Å; D188-T192 PolarHBondContact O-OG1 3.47Å; D188-S268 WeakPolarHBondContact OD1-CB 3.18Å; D188-S268 PolarHBondContact OD1-OG 3.34Å; D188-Y338 HydrophobicContact CB-CE1 3.89Å; D188-Y338 HydrophobicContact CB-CE2 4.39Å; D188-Y338 VanDerWaalsContact CB-OH 3.25Å; D188-Y338 WeakPolarHBondContact CB-OH 3.23Å; D188-R372 IonicContact OD2-NH2 2.94Å; D188-R372 PolarHBondContact OD2-NH2 2.9Å; D188-R372 VanDerWaalsContact OD2-NH2 3.15Å
189	R	92.1	Very high	92.7	Very high	47 Å²	47	35.1 Å²	35.1	18%	0.177	17%	0.172	C	C	.	.	H	α-helix	trans	-66.2	-28.8	-179.4	-61.6	-178.9	68.7	-165.6	0.8	112.6	D157 V159 K186 I187 F191 E193 M194	D157-R189 IonicContact OD2-NH1 3.64Å; D157-R189 PolarHBondContact OD2-NH1 2.77Å; V159-R189 HydrophobicContact CG2-CB 3.54Å; V159-R189 HydrophobicContact CG2-CG 4.48Å; K186-R189 HydrophobicContact CB-CG 4.1Å; K186-R189 WeakPolarHBondContact O-CB 3.39Å; K186-R189 PolarHBondContact O-N 2.87Å; I187-R189 PolarHBondContact O-N 2.76Å; R189-F191 VanDerWaalsContact C-N 3.26Å; R189-F191 PolarHBondContact O-N 2.91Å; R189-E193 HydrophobicContact CB-CB 4.49Å; R189-E193 HydrophobicContact CB-CG 4.45Å; R189-E193 WeakPolarHBondContact CG-OE1 3.43Å; R189-E193 IonicContact CZ-OE2 2.9Å; R189-E193 VanDerWaalsContact CZ-OE2 3.23Å; R189-E193 IonicContact NE-OE1 3.47Å; R189-E193 PolarHBondContact NE-OE1 2.96Å; R189-E193 VanDerWaalsContact NE-OE1 3.13Å; R189-E193 IonicContact NE-OE2 3.72Å; R189-E193 PolarHBondContact NE-OE2 3.04Å; R189-E193 IonicContact NH2-OE2 3.15Å; R189-E193 PolarHBondContact NH2-OE2 3.23Å; R189-E193 WeakPolarHBondContact O-CB 3.37Å; R189-E193 PolarHBondContact O-N 2.9Å; R189-M194 PolarHBondContact O-N 3.11Å
190	L	92.6	Very high	92.7	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-61.2	-38.1	175.6	-59.1	-178.6	0	0	0	111.3	V158 V159 I187 D188 K195 M196 A201 R204	V158-L190 HydrophobicContact CB-CD1 4.4Å; V158-L190 HydrophobicContact CG2-CD1 3.78Å; V158-L190 HydrophobicContact CG2-CD2 3.97Å; V158-L190 HydrophobicContact CG2-CG 3.72Å; V159-L190 HydrophobicContact CG2-CD2 4.03Å; I187-L190 HydrophobicContact CG2-CD1 4.37Å; I187-L190 WeakPolarHBondContact O-CB 3.49Å; I187-L190 PolarHBondContact O-N 2.83Å; I187-L190 VanDerWaalsContact O-N 3.14Å; D188-L190 VanDerWaalsContact C-N 3.27Å; D188-L190 PolarHBondContact O-N 2.89Å; L190-K195 PolarHBondContact O-N 3.18Å; L190-K195 VanDerWaalsContact O-N 3.12Å; L190-M196 HydrophobicContact CB-SD 4.48Å; L190-M196 HydrophobicContact CD2-SD 3.9Å; L190-M196 PolarHBondContact O-N 3.37Å; L190-A201 HydrophobicContact CB-CB 4.4Å; L190-A201 HydrophobicContact CD1-CB 4.07Å; L190-R204 HydrophobicContact CD2-CG 4.12Å
191	F	92.1	Very high	92.8	Very high	9 Å²	9	36.4 Å²	36.4	4%	0.039	18%	0.177	C	C	.	.	H	α-helix	trans	-88.8	-36.6	-179.5	-54.8	-57.9	0	0	0	113.2	I187 D188 R189 K195 A201 L331 L334 A335 Y338	I187-F191 HydrophobicContact CG2-CE2 3.93Å; D188-F191 PolarHBondContact O-N 3.12Å; R189-F191 VanDerWaalsContact C-N 3.26Å; R189-F191 PolarHBondContact O-N 2.91Å; F191-K195 WeakPolarHBondContact O-CA 3.41Å; F191-A201 HydrophobicContact CE1-CB 4.04Å; F191-A201 HydrophobicContact CZ-CB 4.43Å; F191-L331 HydrophobicContact CZ-CB 4.15Å; F191-L331 HydrophobicContact CZ-CD2 3.95Å; F191-L334 HydrophobicContact CE2-CB 4.05Å; F191-L334 HydrophobicContact CZ-CB 4.44Å; F191-A335 HydrophobicContact CD1-CB 3.8Å; F191-A335 HydrophobicContact CE1-CB 3.79Å; F191-A335 HydrophobicContact CG-CB 4.34Å; F191-A335 HydrophobicContact CZ-CB 4.3Å; F191-Y338 HydrophobicContact CB-CD2 4.35Å; F191-Y338 AromaticContact CD2-CD2 3.7Å; F191-Y338 HydrophobicContact CD2-CD2 3.7Å; F191-Y338 AromaticContact CD2-CE2 3.91Å; F191-Y338 HydrophobicContact CD2-CE2 3.91Å; F191-Y338 HydrophobicContact CE2-CD2 4.43Å; F191-Y338 HydrophobicContact CE2-CE2 4.45Å; F191-Y338 HydrophobicContact CG-CD2 4.35Å
192	T	89.5	Confident	92.8	Very high	32 Å²	32	37.2 Å²	37.2	20%	0.196	18%	0.181	C	C	.	.	H	α-helix	trans	-90.3	-48.8	-170.9	56.4	0	0	0	0	112.9	D188 Y338 L342	D188-T192 WeakPolarHBondContact O-CB 3.25Å; D188-T192 WeakPolarHBondContact O-CG2 3.48Å; D188-T192 PolarHBondContact O-N 3.33Å; D188-T192 PolarHBondContact O-OG1 3.47Å; T192-Y338 HydrophobicContact CG2-CD1 3.95Å; T192-Y338 HydrophobicContact CG2-CE1 4.48Å; T192-Y338 HydrophobicContact CG2-CG 4.42Å; T192-L342 HydrophobicContact CG2-CD2 3.59Å
193	E	87.7	Confident	92.6	Very high	110 Å²	110	41.6 Å²	41.6	51%	0.514	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-53.7	-178.2	-65.3	176.8	-156.5	0	0	111.2	R189	R189-E193 HydrophobicContact CB-CB 4.49Å; R189-E193 HydrophobicContact CB-CG 4.45Å; R189-E193 WeakPolarHBondContact CG-OE1 3.43Å; R189-E193 IonicContact CZ-OE2 2.9Å; R189-E193 VanDerWaalsContact CZ-OE2 3.23Å; R189-E193 IonicContact NE-OE1 3.47Å; R189-E193 PolarHBondContact NE-OE1 2.96Å; R189-E193 VanDerWaalsContact NE-OE1 3.13Å; R189-E193 IonicContact NE-OE2 3.72Å; R189-E193 PolarHBondContact NE-OE2 3.04Å; R189-E193 IonicContact NH2-OE2 3.15Å; R189-E193 PolarHBondContact NH2-OE2 3.23Å; R189-E193 WeakPolarHBondContact O-CB 3.37Å; R189-E193 PolarHBondContact O-N 2.9Å
194	M	86.8	Confident	92.3	Very high	75 Å²	75	42 Å²	42	37%	0.369	21%	0.205	S	C	.	.	S	Bend	trans	-81.1	-17.8	-176.2	-59.5	-62.3	-71.7	0	0	113.3	R189 M196 I928	R189-M194 PolarHBondContact O-N 3.11Å; M194-M196 HydrophobicContact CB-CE 4.09Å; M194-M196 HydrophobicContact CB-CG 3.91Å; M194-M196 HydrophobicContact CB-SD 4.27Å; M194-M196 HydrophobicContact CE-CE 3.88Å; M194-M196 HydrophobicContact CG-CE 4.38Å; M194-M196 PolarHBondContact O-N 3.18Å; M194-I928 HydrophobicContact CE-CG2 4.16Å
195	K	89.2	Confident	92.1	Very high	165 Å²	165	41.9 Å²	41.9	72%	0.717	21%	0.205	S	C	*	.			trans	51.7	35.6	-179.7	-59.4	-179.7	180	176.9	0	114.1	L190 F191	L190-K195 PolarHBondContact O-N 3.18Å; L190-K195 VanDerWaalsContact O-N 3.12Å; F191-K195 WeakPolarHBondContact O-CA 3.41Å
196	M	90.7	Very high	91.8	Very high	33 Å²	33	43.3 Å²	43.3	16%	0.163	21%	0.214	C	C	.	.			trans	-69.3	147.3	179.1	-69.4	177.5	173.4	0	0	111.5	L190 M194 E200 A201	L190-M196 HydrophobicContact CB-SD 4.48Å; L190-M196 HydrophobicContact CD2-SD 3.9Å; L190-M196 PolarHBondContact O-N 3.37Å; M194-M196 HydrophobicContact CB-CE 4.09Å; M194-M196 HydrophobicContact CB-CG 3.91Å; M194-M196 HydrophobicContact CB-SD 4.27Å; M194-M196 HydrophobicContact CE-CE 3.88Å; M194-M196 HydrophobicContact CG-CE 4.38Å; M194-M196 PolarHBondContact O-N 3.18Å; M196-E200 WeakPolarHBondContact CA-OE2 3.37Å; M196-E200 HydrophobicContact CB-CB 4Å; M196-E200 HydrophobicContact CG-CB 4.36Å; M196-A201 HydrophobicContact CB-CB 4.47Å
197	T	93	Very high	91.6	Very high	67 Å²	67	44 Å²	44	41%	0.411	22%	0.218	S	C	.	.			trans	-68.5	158.6	168.5	65.6	0	0	0	0	110.9	L199 E200 A201	T197-L199 PolarHBondContact O-N 2.85Å; T197-L199 VanDerWaalsContact O-N 3.15Å; T197-E200 PolarHBondContact N-OE2 2.61Å; T197-E200 PolarHBondContact O-N 2.98Å; T197-E200 VanDerWaalsContact O-N 3.15Å; T197-E200 VanDerWaalsContact OG1-CD 3.28Å; T197-E200 VanDerWaalsContact OG1-CG 3.28Å; T197-E200 WeakPolarHBondContact OG1-CG 3.3Å; T197-E200 PolarHBondContact OG1-N 3.23Å; T197-E200 PolarHBondContact OG1-OE2 3.06Å; T197-A201 WeakPolarHBondContact O-CB 3.21Å; T197-A201 PolarHBondContact O-N 3.31Å
198	P	93.3	Very high	91.3	Very high	26 Å²	26	44 Å²	44	17%	0.169	22%	0.217	C	C	.	.	H	α-helix	trans	-55.8	-31.3	176.9	-28.1	36.4	0	0	0	114.2	Y202 L331 R332 A335	P198-Y202 WeakPolarHBondContact O-CB 3.4Å; P198-Y202 PolarHBondContact O-N 3.25Å; P198-L331 HydrophobicContact CB-CB 3.97Å; P198-L331 VanDerWaalsContact O-CD1 3.25Å; P198-L331 WeakPolarHBondContact O-CD1 3.01Å; P198-R332 HydrophobicContact CB-CB 4.5Å; P198-R332 HydrophobicContact CG-CB 4.31Å; P198-A335 HydrophobicContact CG-CB 4.37Å
199	L	92.3	Very high	91.2	Very high	65 Å²	65	44.4 Å²	44.4	34%	0.34	22%	0.22	S	C	.	.	H	α-helix	trans	-72.3	-46.3	176.5	-177.6	62.9	0	0	0	111.7	T197 A201 Y202 N203 P324	T197-L199 PolarHBondContact O-N 2.85Å; T197-L199 VanDerWaalsContact O-N 3.15Å; L199-A201 VanDerWaalsContact C-N 3.33Å; L199-A201 PolarHBondContact O-N 3.08Å; L199-Y202 WeakPolarHBondContact O-CB 3.38Å; L199-Y202 PolarHBondContact O-N 2.9Å; L199-N203 PolarHBondContact O-N 3.49Å; L199-P324 HydrophobicContact CD1-CG 4.34Å
200	E	92.5	Very high	91	Very high	99 Å²	99	47.9 Å²	47.9	46%	0.463	24%	0.238	S	C	.	.	H	α-helix	trans	-61.5	-42.7	174.9	-72.2	163.7	171.4	0	0	111.5	M196 T197 Y202 N203 R204	M196-E200 WeakPolarHBondContact CA-OE2 3.37Å; M196-E200 HydrophobicContact CB-CB 4Å; M196-E200 HydrophobicContact CG-CB 4.36Å; T197-E200 PolarHBondContact N-OE2 2.61Å; T197-E200 PolarHBondContact O-N 2.98Å; T197-E200 VanDerWaalsContact O-N 3.15Å; T197-E200 VanDerWaalsContact OG1-CD 3.28Å; T197-E200 VanDerWaalsContact OG1-CG 3.28Å; T197-E200 WeakPolarHBondContact OG1-CG 3.3Å; T197-E200 PolarHBondContact OG1-N 3.23Å; T197-E200 PolarHBondContact OG1-OE2 3.06Å; E200-Y202 VanDerWaalsContact C-N 3.32Å; E200-Y202 PolarHBondContact O-N 3.42Å; E200-N203 PolarHBondContact O-N 3.33Å; E200-R204 WeakPolarHBondContact O-CB 3.45Å; E200-R204 PolarHBondContact O-N 3.2Å
201	A	93.5	Very high	90.6	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62	-39.1	175.6	0	0	0	0	0	111.8	L190 F191 M196 T197 L199 R204 L205 L331	L190-A201 HydrophobicContact CB-CB 4.4Å; L190-A201 HydrophobicContact CD1-CB 4.07Å; F191-A201 HydrophobicContact CE1-CB 4.04Å; F191-A201 HydrophobicContact CZ-CB 4.43Å; M196-A201 HydrophobicContact CB-CB 4.47Å; T197-A201 WeakPolarHBondContact O-CB 3.21Å; T197-A201 PolarHBondContact O-N 3.31Å; L199-A201 VanDerWaalsContact C-N 3.33Å; L199-A201 PolarHBondContact O-N 3.08Å; A201-R204 PolarHBondContact O-N 3.02Å; A201-L205 VanDerWaalsContact O-CG 3.29Å; A201-L205 WeakPolarHBondContact O-CG 3.25Å; A201-L205 PolarHBondContact O-N 3.31Å; A201-L331 HydrophobicContact CB-CD1 4.08Å
202	Y	93.9	Very high	90.4	Very high	18 Å²	18	49.9 Å²	49.9	7%	0.071	25%	0.247	C	C	.	.	H	α-helix	trans	-62.3	-50	173.5	173.8	-106.6	0	0	0	111.7	P198 L199 E200 R204 L205 V206 W301 G302 P324 F326 A327	P198-Y202 WeakPolarHBondContact O-CB 3.4Å; P198-Y202 PolarHBondContact O-N 3.25Å; L199-Y202 WeakPolarHBondContact O-CB 3.38Å; L199-Y202 PolarHBondContact O-N 2.9Å; E200-Y202 VanDerWaalsContact C-N 3.32Å; E200-Y202 PolarHBondContact O-N 3.42Å; Y202-R204 PolarHBondContact O-N 3.43Å; Y202-L205 PolarHBondContact O-N 2.97Å; Y202-L205 VanDerWaalsContact O-N 3.08Å; Y202-V206 HydrophobicContact CD1-CG2 4.31Å; Y202-V206 HydrophobicContact CD2-CG2 4.29Å; Y202-V206 HydrophobicContact CE1-CG2 3.86Å; Y202-V206 HydrophobicContact CE2-CG2 3.87Å; Y202-V206 WeakPolarHBondContact O-CG2 3.32Å; Y202-V206 PolarHBondContact O-N 3.4Å; Y202-W301 HydrophobicContact CD2-CZ3 4.3Å; Y202-W301 HydrophobicContact CE2-CD2 4.45Å; Y202-W301 HydrophobicContact CE2-CE3 4.08Å; Y202-W301 HydrophobicContact CE2-CH2 4.25Å; Y202-W301 AromaticContact CE2-CZ3 3.96Å; Y202-W301 HydrophobicContact CE2-CZ3 3.96Å; Y202-G302 WeakPolarHBondContact OH-CA 3.48Å; Y202-G302 PolarHBondContact OH-N 2.83Å; Y202-G302 VanDerWaalsContact OH-N 3.14Å; Y202-G302 PolarHBondContact OH-O 3.09Å; Y202-P324 HydrophobicContact CD1-CB 4.21Å; Y202-P324 HydrophobicContact CD1-CG 3.86Å; Y202-P324 HydrophobicContact CE1-CB 3.88Å; Y202-P324 HydrophobicContact CE1-CG 3.63Å; Y202-F326 HydrophobicContact CD2-CB 3.76Å; Y202-F326 AromaticContact CD2-CD1 3.62Å; Y202-F326 HydrophobicContact CD2-CD1 3.62Å; Y202-F326 HydrophobicContact CD2-CG 4Å; Y202-F326 HydrophobicContact CE2-CB 3.73Å; Y202-F326 HydrophobicContact CE2-CD1 4.22Å; Y202-F326 HydrophobicContact CE2-CG 4.17Å; Y202-A327 HydrophobicContact CG-CB 4.44Å
203	N	91.8	Very high	90.4	Very high	91 Å²	91	49.8 Å²	49.8	49%	0.487	25%	0.246	S	C	.	.	H	α-helix	trans	-58.4	-39.2	178.5	-66.7	-17.3	0	0	0	111.4	L199 E200 V206 Q207	L199-N203 PolarHBondContact O-N 3.49Å; E200-N203 PolarHBondContact O-N 3.33Å; N203-V206 PolarHBondContact O-N 2.79Å; N203-Q207 WeakPolarHBondContact O-CB 3.21Å; N203-Q207 PolarHBondContact O-N 2.78Å
204	R	90.7	Very high	90.3	Very high	8 Å²	8	47.6 Å²	47.6	3%	0.03	25%	0.246	C	C	.	.	H	α-helix	trans	-62.7	-45	174.8	178.1	57.7	-171.6	148.6	2.4	112.3	V158 G161 L190 E200 A201 Y202 V206 Q207 V208 S927	V158-R204 PolarHBondContact O-NE 2.87Å; V158-R204 PolarHBondContact O-NH2 3.4Å; G161-R204 VanDerWaalsContact CA-NH2 3.33Å; L190-R204 HydrophobicContact CD2-CG 4.12Å; E200-R204 WeakPolarHBondContact O-CB 3.45Å; E200-R204 PolarHBondContact O-N 3.2Å; A201-R204 PolarHBondContact O-N 3.02Å; Y202-R204 PolarHBondContact O-N 3.43Å; R204-V206 VanDerWaalsContact C-N 3.34Å; R204-V206 PolarHBondContact O-N 3.41Å; R204-Q207 PolarHBondContact O-N 3Å; R204-V208 VanDerWaalsContact NH2-CG2 3.32Å; R204-V208 WeakPolarHBondContact O-CG2 3.39Å; R204-V208 PolarHBondContact O-N 3.23Å; R204-S927 PolarHBondContact NH1-OG 3.3Å
205	L	93.1	Very high	90.1	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-62.6	-41.3	177.6	-69.3	170.4	0	0	0	112	V158 L184 I187 A201 Y202 V208 L209 F266 W301 F326 L331	V158-L205 HydrophobicContact CB-CD2 4.15Å; V158-L205 HydrophobicContact CG1-CD2 3.53Å; L184-L205 HydrophobicContact CD1-CD2 4.06Å; I187-L205 HydrophobicContact CD1-CD2 4.18Å; I187-L205 HydrophobicContact CG1-CD2 4.22Å; A201-L205 VanDerWaalsContact O-CG 3.29Å; A201-L205 WeakPolarHBondContact O-CG 3.25Å; A201-L205 PolarHBondContact O-N 3.31Å; Y202-L205 PolarHBondContact O-N 2.97Å; Y202-L205 VanDerWaalsContact O-N 3.08Å; L205-V208 PolarHBondContact O-N 3.3Å; L205-L209 WeakPolarHBondContact O-CB 3.1Å; L205-L209 PolarHBondContact O-N 2.8Å; L205-L209 VanDerWaalsContact O-N 3.11Å; L205-F266 HydrophobicContact CD1-CD1 4.16Å; L205-F266 HydrophobicContact CD1-CE1 4.16Å; L205-F266 HydrophobicContact CD2-CD1 4.29Å; L205-F266 HydrophobicContact CD2-CE1 4.43Å; L205-W301 HydrophobicContact CB-CH2 4.1Å; L205-F326 HydrophobicContact CD1-CE1 3.8Å; L205-L331 HydrophobicContact CD1-CD1 4.23Å; L205-L331 HydrophobicContact CD1-CD2 4.1Å
206	V	91.2	Very high	89.9	Confident	33 Å²	33	37 Å²	37	20%	0.2	20%	0.2	C	C	.	.	H	α-helix	trans	-59.3	-49.2	175	172.3	0	0	0	0	110.3	Y202 N203 R204 V208 L209 E210 W301	Y202-V206 HydrophobicContact CD1-CG2 4.31Å; Y202-V206 HydrophobicContact CD2-CG2 4.29Å; Y202-V206 HydrophobicContact CE1-CG2 3.86Å; Y202-V206 HydrophobicContact CE2-CG2 3.87Å; Y202-V206 WeakPolarHBondContact O-CG2 3.32Å; Y202-V206 PolarHBondContact O-N 3.4Å; N203-V206 PolarHBondContact O-N 2.79Å; R204-V206 VanDerWaalsContact C-N 3.34Å; R204-V206 PolarHBondContact O-N 3.41Å; V206-V208 PolarHBondContact O-N 3.12Å; V206-L209 WeakPolarHBondContact O-CB 3.44Å; V206-L209 PolarHBondContact O-N 2.78Å; V206-L209 VanDerWaalsContact O-N 3.16Å; V206-E210 HydrophobicContact CG1-CG 4.34Å; V206-E210 WeakPolarHBondContact CG1-OE1 3.2Å; V206-E210 WeakPolarHBondContact O-CG 3.31Å; V206-E210 PolarHBondContact O-N 3.46Å; V206-W301 HydrophobicContact CG2-CH2 4.13Å; V206-W301 HydrophobicContact CG2-CZ2 3.79Å
207	Q	88.9	Confident	89.5	Confident	42 Å²	42	36.1 Å²	36.1	20%	0.196	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-41.2	179.9	-170.6	-161.2	23.1	0	0	113	N203 R204 L209 E210 Q211 S927	N203-Q207 WeakPolarHBondContact O-CB 3.21Å; N203-Q207 PolarHBondContact O-N 2.78Å; R204-Q207 PolarHBondContact O-N 3Å; Q207-L209 VanDerWaalsContact C-N 3.3Å; Q207-L209 PolarHBondContact O-N 3.19Å; Q207-E210 PolarHBondContact O-N 3.42Å; Q207-Q211 VanDerWaalsContact O-CG 3.27Å; Q207-Q211 WeakPolarHBondContact O-CG 3.39Å; Q207-Q211 PolarHBondContact O-N 3.32Å; Q207-S927 VanDerWaalsContact CD-OG 3.31Å; Q207-S927 PolarHBondContact NE2-OG 2.87Å; Q207-S927 PolarHBondContact OE1-OG 3.1Å
208	V	89.3	Confident	88.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.1	-39.9	176.7	174.9	0	0	0	0	111	I156 L184 R204 L205 V206 Q211 A212	I156-V208 HydrophobicContact CG2-CG1 3.77Å; L184-V208 HydrophobicContact CD2-CG1 3.75Å; R204-V208 VanDerWaalsContact NH2-CG2 3.32Å; R204-V208 WeakPolarHBondContact O-CG2 3.39Å; R204-V208 PolarHBondContact O-N 3.23Å; L205-V208 PolarHBondContact O-N 3.3Å; V206-V208 PolarHBondContact O-N 3.12Å; V208-Q211 PolarHBondContact O-N 3.07Å; V208-A212 PolarHBondContact O-N 3.25Å; V208-A212 VanDerWaalsContact O-N 3.09Å
209	L	90.5	Very high	88.2	Confident	12 Å²	12	37.3 Å²	37.3	6%	0.063	20%	0.198	C	C	.	.	H	α-helix	trans	-66.1	-43.5	176.9	-174.3	71.2	0	0	0	111.7	L182 L205 V206 Q207 A212 N213 F257 P259 V264 W301	L182-L209 HydrophobicContact CD2-CD1 3.73Å; L205-L209 WeakPolarHBondContact O-CB 3.1Å; L205-L209 PolarHBondContact O-N 2.8Å; L205-L209 VanDerWaalsContact O-N 3.11Å; V206-L209 WeakPolarHBondContact O-CB 3.44Å; V206-L209 PolarHBondContact O-N 2.78Å; V206-L209 VanDerWaalsContact O-N 3.16Å; Q207-L209 VanDerWaalsContact C-N 3.3Å; Q207-L209 PolarHBondContact O-N 3.19Å; L209-A212 PolarHBondContact O-N 3.09Å; L209-N213 WeakPolarHBondContact O-CB 3.31Å; L209-N213 PolarHBondContact O-N 3.4Å; L209-F257 HydrophobicContact CD1-CB 3.53Å; L209-P259 HydrophobicContact CD2-CG 3.71Å; L209-V264 HydrophobicContact CD1-CG2 4Å; L209-W301 HydrophobicContact CD2-CZ2 3.77Å
210	E	88.4	Confident	87.5	Confident	120 Å²	120	35.8 Å²	35.8	56%	0.561	19%	0.188	S	C	*	.	H	α-helix	trans	-60.4	-43.6	175.1	-74.4	173.8	172.5	0	0	111.7	V206 Q207 A212 N213 A214	V206-E210 HydrophobicContact CG1-CG 4.34Å; V206-E210 WeakPolarHBondContact CG1-OE1 3.2Å; V206-E210 WeakPolarHBondContact O-CG 3.31Å; V206-E210 PolarHBondContact O-N 3.46Å; Q207-E210 PolarHBondContact O-N 3.42Å; E210-A212 VanDerWaalsContact C-N 3.34Å; E210-A212 PolarHBondContact O-N 3.43Å; E210-N213 PolarHBondContact O-N 3.43Å; E210-A214 WeakPolarHBondContact O-CB 3.46Å; E210-A214 PolarHBondContact O-N 2.91Å
211	Q	85	Confident	86.7	Confident	51 Å²	51	34.9 Å²	34.9	24%	0.238	19%	0.189	C	C	.	.	H	α-helix	trans	-59.7	-44	174.9	-73.3	173	-2.6	0	0	111.9	V162 Q207 V208 A214 V215	V162-Q211 HydrophobicContact CB-CB 4.21Å; V162-Q211 HydrophobicContact CG2-CB 3.61Å; Q207-Q211 VanDerWaalsContact O-CG 3.27Å; Q207-Q211 WeakPolarHBondContact O-CG 3.39Å; Q207-Q211 PolarHBondContact O-N 3.32Å; V208-Q211 PolarHBondContact O-N 3.07Å; Q211-A214 PolarHBondContact O-N 3.29Å; Q211-V215 WeakPolarHBondContact O-CG2 3.49Å; Q211-V215 PolarHBondContact O-N 3.26Å
212	A	87.1	Confident	85.6	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.4	-41.6	178.2	0	0	0	0	0	111.5	I156 V162 V208 L209 E210 V215 T216 F257	I156-A212 HydrophobicContact CD1-CB 4.32Å; V162-A212 HydrophobicContact CG2-CB 4.13Å; V208-A212 PolarHBondContact O-N 3.25Å; V208-A212 VanDerWaalsContact O-N 3.09Å; L209-A212 PolarHBondContact O-N 3.09Å; E210-A212 VanDerWaalsContact C-N 3.34Å; E210-A212 PolarHBondContact O-N 3.43Å; A212-V215 PolarHBondContact O-N 3.32Å; A212-T216 PolarHBondContact O-N 3.43Å; A212-T216 VanDerWaalsContact O-N 3.09Å; A212-T216 PolarHBondContact O-OG1 3.32Å; A212-F257 HydrophobicContact CB-CD2 3.89Å; A212-F257 HydrophobicContact CB-CE2 4.12Å
213	N	90.1	Very high	84.4	Confident	31 Å²	31	38.4 Å²	38.4	17%	0.166	21%	0.21	C	C	.	.	H	α-helix	trans	-69.4	-32.3	176.9	-77.8	-23.8	0	0	0	113.2	L209 E210 V215 T216 G217 Y256 F257	L209-N213 WeakPolarHBondContact O-CB 3.31Å; L209-N213 PolarHBondContact O-N 3.4Å; E210-N213 PolarHBondContact O-N 3.43Å; N213-V215 VanDerWaalsContact C-N 3.34Å; N213-T216 PolarHBondContact O-N 3.19Å; N213-G217 PolarHBondContact O-N 2.76Å; N213-Y256 HydrophobicContact CB-CD1 4.11Å; N213-F257 PolarHBondContact ND2-O 3.46Å; N213-F257 WeakPolarHBondContact OD1-CB 3.49Å; N213-F257 WeakPolarHBondContact OD1-CD2 3.48Å; N213-F257 PolarHBondContact OD1-N 3.4Å
214	A	85.6	Confident	83.3	Confident	64 Å²	64	38.7 Å²	38.7	53%	0.529	21%	0.208	S	C	.	.	H	α-helix	trans	-62.5	-42.3	174	0	0	0	0	0	111.3	E210 Q211 G217 E218	E210-A214 WeakPolarHBondContact O-CB 3.46Å; E210-A214 PolarHBondContact O-N 2.91Å; Q211-A214 PolarHBondContact O-N 3.29Å; A214-G217 PolarHBondContact O-N 2.91Å; A214-E218 PolarHBondContact O-N 3.21Å
215	V	82.7	Confident	82	Confident	15 Å²	15	43.1 Å²	43.1	9%	0.091	23%	0.232	C	C	.	.	H	α-helix	trans	-65	-45	174.5	178	0	0	0	0	110.8	V162 I167 L170 Q211 A212 N213 G217 E218 L219	V162-V215 HydrophobicContact CG1-CG2 4.33Å; I167-V215 HydrophobicContact CB-CG1 4.46Å; I167-V215 HydrophobicContact CD1-CG2 4.41Å; I167-V215 HydrophobicContact CG1-CG1 4.31Å; I167-V215 HydrophobicContact CG1-CG2 4.04Å; I167-V215 HydrophobicContact CG2-CG1 4.02Å; L170-V215 HydrophobicContact CB-CG1 4.34Å; L170-V215 HydrophobicContact CD1-CB 4.08Å; L170-V215 HydrophobicContact CD1-CG1 3.73Å; Q211-V215 WeakPolarHBondContact O-CG2 3.49Å; Q211-V215 PolarHBondContact O-N 3.26Å; A212-V215 PolarHBondContact O-N 3.32Å; N213-V215 VanDerWaalsContact C-N 3.34Å; V215-G217 VanDerWaalsContact C-N 3.28Å; V215-G217 PolarHBondContact O-N 3.18Å; V215-E218 PolarHBondContact O-N 3.43Å; V215-L219 WeakPolarHBondContact O-CG 3.24Å; V215-L219 PolarHBondContact O-N 2.87Å
216	T	84.9	Confident	80.5	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-38.7	175.5	-56.1	0	0	0	0	111.7	W174 A212 N213 L219 F220 H255	W174-T216 HydrophobicContact CZ3-CG2 4.47Å; A212-T216 PolarHBondContact O-N 3.43Å; A212-T216 VanDerWaalsContact O-N 3.09Å; A212-T216 PolarHBondContact O-OG1 3.32Å; N213-T216 PolarHBondContact O-N 3.19Å; T216-L219 PolarHBondContact O-N 2.88Å; T216-F220 PolarHBondContact O-N 3.49Å; T216-H255 HydrophobicContact CG2-CB 4.28Å
217	G	82.5	Confident	79.1	Confident	13 Å²	13	48.1 Å²	48.1	13%	0.134	25%	0.254	C	S	.	.	H	α-helix	trans	-64.8	-42.2	176.3	0	0	0	0	0	113.1	N213 A214 V215 L219 F220 V221	N213-G217 PolarHBondContact O-N 2.76Å; A214-G217 PolarHBondContact O-N 2.91Å; V215-G217 VanDerWaalsContact C-N 3.28Å; V215-G217 PolarHBondContact O-N 3.18Å; G217-L219 VanDerWaalsContact C-N 3.29Å; G217-L219 PolarHBondContact O-N 2.86Å; G217-F220 WeakPolarHBondContact O-CB 3.49Å; G217-F220 PolarHBondContact O-N 3.2Å; G217-V221 WeakPolarHBondContact O-CG2 3.23Å; G217-V221 PolarHBondContact O-N 3.14Å
218	E	79.1	Confident	77.8	Confident	105 Å²	105	54.4 Å²	54.4	49%	0.491	28%	0.278	S	S	.	.	H	α-helix	trans	-56	-44.6	172.7	-175.9	-167.3	143.2	0	0	111.2	R171 A214 V215 S222	R171-E218 IonicContact NH2-OE1 3.35Å; R171-E218 PolarHBondContact NH2-OE1 3.37Å; A214-E218 PolarHBondContact O-N 3.21Å; V215-E218 PolarHBondContact O-N 3.43Å; E218-S222 WeakPolarHBondContact O-CB 3.32Å; E218-S222 PolarHBondContact O-N 3.17Å
219	L	79	Confident	76	Confident	14 Å²	14	60.3 Å²	60.3	7%	0.073	31%	0.305	C	S	.	.	H	α-helix	trans	-68.3	-34.7	178.7	-60.8	175.7	0	0	0	112.6	L170 R171 W174 V215 T216 G217 S222 R223	L170-L219 HydrophobicContact CB-CD1 4.37Å; R171-L219 HydrophobicContact CG-CD1 4.12Å; R171-L219 HydrophobicContact CG-CD2 3.56Å; R171-L219 HydrophobicContact CG-CG 4.45Å; W174-L219 HydrophobicContact CB-CD1 3.95Å; W174-L219 HydrophobicContact CD2-CB 4.04Å; W174-L219 HydrophobicContact CG-CB 4.02Å; W174-L219 HydrophobicContact CG-CD1 4.14Å; W174-L219 PolarHBondContact NE1-O 3.46Å; V215-L219 WeakPolarHBondContact O-CG 3.24Å; V215-L219 PolarHBondContact O-N 2.87Å; T216-L219 PolarHBondContact O-N 2.88Å; G217-L219 VanDerWaalsContact C-N 3.29Å; G217-L219 PolarHBondContact O-N 2.86Å; L219-S222 WeakPolarHBondContact CA-OG 3.1Å; L219-S222 PolarHBondContact O-OG 3.17Å; L219-R223 PolarHBondContact O-N 2.8Å
220	F	77.2	Confident	74.2	Confident	33 Å²	33	66.4 Å²	66.4	15%	0.145	33%	0.327	C	S	.	.	H	α-helix	trans	-65.1	-51.7	175.3	-172.1	-96.2	0	0	0	111.3	W174 T216 G217 S222 R223 E224 E252	W174-F220 HydrophobicContact CH2-CB 4.42Å; W174-F220 AromaticContact CH2-CD2 3.93Å; W174-F220 HydrophobicContact CH2-CD2 3.93Å; W174-F220 HydrophobicContact CZ2-CB 4.42Å; W174-F220 HydrophobicContact CZ2-CD2 4.2Å; T216-F220 PolarHBondContact O-N 3.49Å; G217-F220 WeakPolarHBondContact O-CB 3.49Å; G217-F220 PolarHBondContact O-N 3.2Å; F220-S222 VanDerWaalsContact C-N 3.3Å; F220-S222 PolarHBondContact O-N 3.35Å; F220-R223 WeakPolarHBondContact O-CB 3.26Å; F220-R223 PolarHBondContact O-N 3.04Å; F220-E224 HydrophobicContact CD1-CG 4.12Å; F220-E224 HydrophobicContact CE1-CG 3.71Å; F220-E224 WeakPolarHBondContact CE1-OE1 3.38Å; F220-E224 WeakPolarHBondContact CE1-OE2 3.14Å; F220-E224 HydrophobicContact CZ-CG 4.04Å; F220-E224 WeakPolarHBondContact CZ-OE1 3.49Å; F220-E224 PolarHBondContact O-N 2.93Å; F220-E252 HydrophobicContact CE1-CG 4.22Å; F220-E252 HydrophobicContact CE2-CG 4.45Å; F220-E252 HydrophobicContact CZ-CB 4.41Å; F220-E252 HydrophobicContact CZ-CG 3.72Å
221	V	75.3	Confident	72.6	Confident	79 Å²	79	66.1 Å²	66.1	48%	0.479	33%	0.329	S	S	.	.	H	α-helix	trans	-57.8	-44	177.5	174.1	0	0	0	0	110.9	G217 R223 E224 L225	G217-V221 WeakPolarHBondContact O-CG2 3.23Å; G217-V221 PolarHBondContact O-N 3.14Å; V221-R223 PolarHBondContact O-N 2.99Å; V221-E224 PolarHBondContact O-N 2.87Å; V221-L225 HydrophobicContact CG1-CD1 4Å; V221-L225 HydrophobicContact CG1-CG 4.45Å; V221-L225 VanDerWaalsContact O-CG 3.31Å; V221-L225 WeakPolarHBondContact O-CG 3.39Å; V221-L225 PolarHBondContact O-N 2.99Å
222	S	70.9	Confident	70.8	Confident	48 Å²	48	66.7 Å²	66.7	34%	0.336	34%	0.339	S	S	.	.	H	α-helix	trans	-58.1	-37	177.6	73	0	0	0	0	112.6	E218 L219 F220 E226	E218-S222 WeakPolarHBondContact O-CB 3.32Å; E218-S222 PolarHBondContact O-N 3.17Å; L219-S222 WeakPolarHBondContact CA-OG 3.1Å; L219-S222 PolarHBondContact O-OG 3.17Å; F220-S222 VanDerWaalsContact C-N 3.3Å; F220-S222 PolarHBondContact O-N 3.35Å; S222-E226 WeakPolarHBondContact O-CG 3.48Å; S222-E226 PolarHBondContact O-N 3.14Å; S222-E226 VanDerWaalsContact O-N 3.09Å
223	R	69.7	Low	68.9	Low	45 Å²	45	69.5 Å²	69.5	17%	0.17	36%	0.359	C	S	.	.	H	α-helix	trans	-74.5	-41.1	179.7	-176	-178.5	-175.4	152.8	13.3	112.3	W174 D177 L219 F220 V221 L225 E226 D227 R406	W174-R223 HydrophobicContact CZ2-CB 4.41Å; D177-R223 IonicContact OD1-NH1 3.44Å; D177-R223 PolarHBondContact OD1-NH1 3.5Å; L219-R223 PolarHBondContact O-N 2.8Å; F220-R223 WeakPolarHBondContact O-CB 3.26Å; F220-R223 PolarHBondContact O-N 3.04Å; V221-R223 PolarHBondContact O-N 2.99Å; R223-L225 VanDerWaalsContact C-N 3.27Å; R223-L225 PolarHBondContact O-N 3.43Å; R223-E226 PolarHBondContact O-N 2.94Å; R223-D227 IonicContact NE-OD2 3.83Å; R223-D227 WeakPolarHBondContact O-CB 3.36Å; R223-D227 PolarHBondContact O-N 2.85Å; R223-R406 VanDerWaalsContact NH2-CD 3.31Å
224	E	68.3	Low	66.8	Low	97 Å²	97	72.2 Å²	72.2	45%	0.453	38%	0.38	S	S	.	.	H	α-helix	trans	-62.1	-39.1	176.3	-69.5	-165.6	134.1	0	0	111.5	F220 V221 D227 Y228	F220-E224 HydrophobicContact CD1-CG 4.12Å; F220-E224 HydrophobicContact CE1-CG 3.71Å; F220-E224 WeakPolarHBondContact CE1-OE1 3.38Å; F220-E224 WeakPolarHBondContact CE1-OE2 3.14Å; F220-E224 HydrophobicContact CZ-CG 4.04Å; F220-E224 WeakPolarHBondContact CZ-OE1 3.49Å; F220-E224 PolarHBondContact O-N 2.93Å; V221-E224 PolarHBondContact O-N 2.87Å; E224-D227 PolarHBondContact O-N 3.31Å; E224-Y228 VanDerWaalsContact O-CB 3.25Å; E224-Y228 WeakPolarHBondContact O-CB 3.19Å; E224-Y228 PolarHBondContact O-N 3.43Å
225	L	63.7	Low	64.7	Low	100 Å²	100	73 Å²	73	52%	0.524	38%	0.382	S	S	.	.	H	α-helix	trans	-61.6	-48	172.6	-67.8	169.9	0	0	0	111.1	V221 R223 D227 Y228 E229	V221-L225 HydrophobicContact CG1-CD1 4Å; V221-L225 HydrophobicContact CG1-CG 4.45Å; V221-L225 VanDerWaalsContact O-CG 3.31Å; V221-L225 WeakPolarHBondContact O-CG 3.39Å; V221-L225 PolarHBondContact O-N 2.99Å; R223-L225 VanDerWaalsContact C-N 3.27Å; R223-L225 PolarHBondContact O-N 3.43Å; L225-D227 PolarHBondContact O-N 3.25Å; L225-Y228 PolarHBondContact O-N 2.98Å; L225-E229 WeakPolarHBondContact O-CB 3.5Å; L225-E229 WeakPolarHBondContact O-CG 3.31Å; L225-E229 PolarHBondContact O-N 2.83Å
226	E	61.3	Low	62.7	Low	92 Å²	92	78.3 Å²	78.3	43%	0.43	41%	0.414	S	S	.	.	H	α-helix	trans	-59.5	-43.4	175.8	-76.3	-177.4	-159.8	0	0	112.9	S222 R223 E229 R230	S222-E226 WeakPolarHBondContact O-CG 3.48Å; S222-E226 PolarHBondContact O-N 3.14Å; S222-E226 VanDerWaalsContact O-N 3.09Å; R223-E226 PolarHBondContact O-N 2.94Å; E226-E229 PolarHBondContact O-N 3.27Å; E226-R230 VanDerWaalsContact O-CG 3.28Å; E226-R230 WeakPolarHBondContact O-CG 3.3Å; E226-R230 PolarHBondContact O-N 2.83Å; E226-R230 IonicContact OE2-CZ 2.81Å; E226-R230 IonicContact OE2-NH2 3.03Å; E226-R230 PolarHBondContact OE2-NH2 3.22Å
227	D	62.3	Low	60.3	Low	46 Å²	46	85.7 Å²	85.7	25%	0.246	45%	0.453	C	S	.	.	H	α-helix	trans	-70.6	-36.6	-179	-76.1	-18.7	0	0	0	110.9	R223 E224 L225 R230 L231	R223-D227 IonicContact NE-OD2 3.83Å; R223-D227 WeakPolarHBondContact O-CB 3.36Å; R223-D227 PolarHBondContact O-N 2.85Å; E224-D227 PolarHBondContact O-N 3.31Å; L225-D227 PolarHBondContact O-N 3.25Å; D227-R230 PolarHBondContact O-N 3Å; D227-R230 IonicContact OD1-NH1 2.72Å; D227-R230 PolarHBondContact OD1-NH1 2.84Å; D227-L231 WeakPolarHBondContact O-CB 3.36Å; D227-L231 WeakPolarHBondContact O-CD1 3.31Å; D227-L231 VanDerWaalsContact O-CG 3.29Å; D227-L231 WeakPolarHBondContact O-CG 3.04Å; D227-L231 PolarHBondContact O-N 3.05Å
228	Y	60	Low	58.1	Low	174 Å²	174	89.1 Å²	89.1	68%	0.682	48%	0.48	S	S	*	.	H	α-helix	trans	-64.4	-44.2	172.7	-169.7	-95.1	0	0	0	111.8	E224 L225 L231 S232	E224-Y228 VanDerWaalsContact O-CB 3.25Å; E224-Y228 WeakPolarHBondContact O-CB 3.19Å; E224-Y228 PolarHBondContact O-N 3.43Å; L225-Y228 PolarHBondContact O-N 2.98Å; Y228-L231 PolarHBondContact O-N 2.91Å; Y228-S232 WeakPolarHBondContact O-CB 3.44Å; Y228-S232 PolarHBondContact O-N 2.76Å; Y228-S232 PolarHBondContact O-OG 3.22Å
229	E	52	Low	55.7	Low	124 Å²	124	92.4 Å²	92.4	58%	0.579	50%	0.501	S	S	*	.	H	α-helix	trans	-59.7	-46.3	174	-75.9	174.5	-175.8	0	0	111.2	L225 E226 L231 S232 S233	L225-E229 WeakPolarHBondContact O-CB 3.5Å; L225-E229 WeakPolarHBondContact O-CG 3.31Å; L225-E229 PolarHBondContact O-N 2.83Å; E226-E229 PolarHBondContact O-N 3.27Å; E229-L231 PolarHBondContact O-N 3.26Å; E229-S232 WeakPolarHBondContact CA-OG 3.5Å; E229-S232 PolarHBondContact O-N 2.77Å; E229-S232 PolarHBondContact O-OG 3.05Å; E229-S233 PolarHBondContact O-N 3.35Å; E229-S233 PolarHBondContact O-OG 3.42Å
230	R	53.1	Low	53.7	Low	140 Å²	140	98.9 Å²	98.9	53%	0.528	54%	0.536	S	S	.	.	H	α-helix	trans	-59.7	-45.2	175.4	-74.3	173.8	-170.6	144.4	12.2	112.2	E226 D227 S233 S234	E226-R230 VanDerWaalsContact O-CG 3.28Å; E226-R230 WeakPolarHBondContact O-CG 3.3Å; E226-R230 PolarHBondContact O-N 2.83Å; E226-R230 IonicContact OE2-CZ 2.81Å; E226-R230 IonicContact OE2-NH2 3.03Å; E226-R230 PolarHBondContact OE2-NH2 3.22Å; D227-R230 PolarHBondContact O-N 3Å; D227-R230 IonicContact OD1-NH1 2.72Å; D227-R230 PolarHBondContact OD1-NH1 2.84Å; R230-S233 PolarHBondContact O-N 2.89Å; R230-S233 PolarHBondContact O-OG 2.9Å; R230-S234 PolarHBondContact O-N 3.32Å; R230-S234 PolarHBondContact O-OG 3.23Å
231	L	55.3	Low	51.5	Low	114 Å²	114	103.1 Å²	103.1	60%	0.597	57%	0.57	S	S	*	*	H	α-helix	trans	-63.9	-45	178.5	-76.2	159.7	0	0	0	111.3	D227 Y228 E229 S233 S234 S235	D227-L231 WeakPolarHBondContact O-CB 3.36Å; D227-L231 WeakPolarHBondContact O-CD1 3.31Å; D227-L231 VanDerWaalsContact O-CG 3.29Å; D227-L231 WeakPolarHBondContact O-CG 3.04Å; D227-L231 PolarHBondContact O-N 3.05Å; Y228-L231 PolarHBondContact O-N 2.91Å; E229-L231 PolarHBondContact O-N 3.26Å; L231-S233 VanDerWaalsContact C-N 3.3Å; L231-S233 PolarHBondContact O-N 2.78Å; L231-S234 PolarHBondContact O-N 2.93Å; L231-S234 PolarHBondContact O-OG 2.75Å; L231-S235 PolarHBondContact O-N 3.07Å
232	S	46.9	Very low	49.4	Very low	63 Å²	63	102.7 Å²	102.7	44%	0.441	58%	0.581	S	S	.	*	H	α-helix	trans	-62.5	-35.7	177.9	73.6	0	0	0	0	112.9	Y228 E229 S234 S235	Y228-S232 WeakPolarHBondContact O-CB 3.44Å; Y228-S232 PolarHBondContact O-N 2.76Å; Y228-S232 PolarHBondContact O-OG 3.22Å; E229-S232 WeakPolarHBondContact CA-OG 3.5Å; E229-S232 PolarHBondContact O-N 2.77Å; E229-S232 PolarHBondContact O-OG 3.05Å; S232-S234 PolarHBondContact O-N 3.45Å; S232-S235 PolarHBondContact O-OG 3.5Å; S232-S235 VanDerWaalsContact O-OG 3.09Å
233	S	47	Very low	47.4	Very low	60 Å²	60	109 Å²	109	42%	0.42	61%	0.611	S	S	.	*	H	α-helix	trans	-69.2	-19.6	175	71.9	0	0	0	0	113.5	E229 R230 L231	E229-S233 PolarHBondContact O-N 3.35Å; E229-S233 PolarHBondContact O-OG 3.42Å; R230-S233 PolarHBondContact O-N 2.89Å; R230-S233 PolarHBondContact O-OG 2.9Å; L231-S233 VanDerWaalsContact C-N 3.3Å; L231-S233 PolarHBondContact O-N 2.78Å
234	S	46.3	Very low	45.5	Very low	87 Å²	87	110 Å²	110	61%	0.608	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-5.5	-177.8	67.1	0	0	0	0	114.8	R230 L231 S232	R230-S234 PolarHBondContact O-N 3.32Å; R230-S234 PolarHBondContact O-OG 3.23Å; L231-S234 PolarHBondContact O-N 2.93Å; L231-S234 PolarHBondContact O-OG 2.75Å; S232-S234 PolarHBondContact O-N 3.45Å
235	S	40.9	Very low	43.5	Very low	82 Å²	82	113 Å²	113	57%	0.573	65%	0.654	S	S	*	*			trans	-102.4	18.5	-169.1	55.5	0	0	0	0	116.2	L231 S232 D237	L231-S235 PolarHBondContact O-N 3.07Å; S232-S235 PolarHBondContact O-OG 3.5Å; S232-S235 VanDerWaalsContact O-OG 3.09Å; S235-D237 PolarHBondContact O-N 2.86Å
236	V	42	Very low	41.9	Very low	126 Å²	126	114.2 Å²	114.2	76%	0.764	67%	0.671	S	S	*	*	S	Bend	trans	-74.2	-13.1	178.2	-166.1	0	0	0	0	112.7
237	D	33.8	Very low	40.3	Very low	157 Å²	157	115.3 Å²	115.3	84%	0.84	69%	0.689	S	S	*	*	S	Bend	trans	-129.2	72.4	-179.6	-67.3	-43.9	0	0	0	113	S235	S235-D237 PolarHBondContact O-N 2.86Å
238	A	36.1	Very low	38.7	Very low	85 Å²	85	116 Å²	116	70%	0.702	71%	0.707	S	S	*	*			trans	-171.8	96.1	154.9	0	0	0	0	0	112.6	N240	A238-N240 VanDerWaalsContact C-N 3.35Å; A238-N240 PolarHBondContact O-N 3.37Å
239	N	29.8	Very low	37.3	Very low	174 Å²	174	111.5 Å²	111.5	93%	0.93	71%	0.706	S	S	*	*			trans	-64.9	94.7	154.1	-87.4	-28.6	0	0	0	108.7
240	N	37	Very low	36.8	Very low	150 Å²	150	109.9 Å²	109.9	80%	0.802	71%	0.706	S	S	*	*			trans	-151.7	108.1	155.3	-127.4	-7.8	0	0	0	111.7	A238 G242	A238-N240 VanDerWaalsContact C-N 3.35Å; A238-N240 PolarHBondContact O-N 3.37Å; N240-G242 PolarHBondContact O-N 2.91Å
241	S	29.8	Very low	36.7	Very low	123 Å²	123	108.1 Å²	108.1	86%	0.86	71%	0.707	S	S	*	*			trans	-62.1	106.1	170.2	49.4	0	0	0	0	110.4
242	G	32.3	Very low	36.5	Very low	70 Å²	70	106.9 Å²	106.9	72%	0.722	70%	0.698	S	S	*	*			trans	-130.7	104.2	172.2	0	0	0	0	0	110.3	N240 G244	N240-G242 PolarHBondContact O-N 2.91Å; G242-G244 PolarHBondContact O-N 3.28Å; G242-G244 VanDerWaalsContact O-N 3.08Å
243	N	28.5	Very low	36.9	Very low	180 Å²	180	111.2 Å²	111.2	96%	0.963	71%	0.712	S	S	*	*			trans	-61.1	103.2	173.9	-122.2	-0.4	0	0	0	109.6
244	G	29.7	Very low	37.7	Very low	65 Å²	65	114.3 Å²	114.3	67%	0.67	72%	0.718	S	S	*	*			trans	-117	103.2	177.2	0	0	0	0	0	110.8	G242 S246	G242-G244 PolarHBondContact O-N 3.28Å; G242-G244 VanDerWaalsContact O-N 3.08Å; G244-S246 PolarHBondContact O-N 3.37Å; G244-S246 VanDerWaalsContact O-N 3.11Å
245	N	26.3	Very low	38.9	Very low	161 Å²	161	111.6 Å²	111.6	86%	0.861	70%	0.695	S	S	*	*			trans	-57.1	110.9	170.6	-80.7	-18	0	0	0	110.4	S247	N245-S247 VanDerWaalsContact C-N 3.29Å; N245-S247 PolarHBondContact O-N 3.26Å
246	S	29.7	Very low	41	Very low	126 Å²	126	111 Å²	111	88%	0.881	68%	0.681	S	S	*	*			trans	-78.5	73.2	170.1	46.1	0	0	0	0	110.8	G244	G244-S246 PolarHBondContact O-N 3.37Å; G244-S246 VanDerWaalsContact O-N 3.11Å
247	S	27.6	Very low	43.2	Very low	115 Å²	115	105 Å²	105	80%	0.804	65%	0.645	S	S	*	*			trans	-99.4	92.1	162.3	56.6	0	0	0	0	107.9	N245	N245-S247 VanDerWaalsContact C-N 3.29Å; N245-S247 PolarHBondContact O-N 3.26Å
248	G	29.3	Very low	45.8	Very low	61 Å²	61	100 Å²	100	63%	0.629	62%	0.62	S	S	*	*			trans	-151.3	50.3	-169	0	0	0	0	0	114.4	P250	G248-P250 WeakPolarHBondContact O-CD 3.3Å
249	A	29.4	Very low	48.3	Very low	79 Å²	79	96.1 Å²	96.1	65%	0.653	59%	0.587	S	S	*	*			trans	-91.9	40.3	176.1	0	0	0	0	0	117.6
250	P	42.1	Very low	51	Low	89 Å²	89	90.2 Å²	90.2	58%	0.578	56%	0.56	S	S	*	*	S	Bend	trans	-108.4	-7.2	176.8	38	-32.6	0	0	0	116.9	G248	G248-P250 WeakPolarHBondContact O-CD 3.3Å
251	D	50.3	Low	53.2	Low	103 Å²	103	85.9 Å²	85.9	55%	0.551	54%	0.541	S	S	*	.	S	Bend	trans	-100.8	-18.7	-176	-83.3	-20.4	0	0	0	114.6	K254	D251-K254 IonicContact OD1-NZ 3.75Å; D251-K254 PolarHBondContact OD1-NZ 3.24Å
252	E	51.7	Low	56	Low	89 Å²	89	80.3 Å²	80.3	42%	0.416	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-65.5	-39.3	-178.1	-61.5	178.9	-164.7	0	0	112.7	F220 K254 Y256	F220-E252 HydrophobicContact CE1-CG 4.22Å; F220-E252 HydrophobicContact CE2-CG 4.45Å; F220-E252 HydrophobicContact CZ-CB 4.41Å; F220-E252 HydrophobicContact CZ-CG 3.72Å; E252-K254 PolarHBondContact O-N 2.99Å; E252-Y256 VanDerWaalsContact O-CD2 3.3Å; E252-Y256 WeakPolarHBondContact O-CD2 3.44Å
253	E	55	Low	58.8	Low	153 Å²	153	77.3 Å²	77.3	72%	0.715	47%	0.47	S	S	*	.	G	3₁₀ helix	trans	-68.7	-19.1	-173.9	-66.4	-173.4	166.5	0	0	113.7	H255	E253-H255 VanDerWaalsContact C-N 3.26Å; E253-H255 PolarHBondContact O-N 2.9Å
254	K	63.3	Low	61.9	Low	126 Å²	126	68.8 Å²	68.8	55%	0.548	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-67.9	-24.2	-172	-71.1	176.2	-177.5	161.3	0	113.7	D251 E252	D251-K254 IonicContact OD1-NZ 3.75Å; D251-K254 PolarHBondContact OD1-NZ 3.24Å; E252-K254 PolarHBondContact O-N 2.99Å
255	H	71.7	Confident	65.1	Low	29 Å²	29	65.7 Å²	65.7	13%	0.134	39%	0.393	C	S	.	.	S	Bend	trans	-98	-18.6	-175.6	-68.9	-74.9	0	0	0	114.1	W174 T216 E253	W174-H255 HydrophobicContact CH2-CB 4.38Å; W174-H255 HydrophobicContact CZ3-CB 3.86Å; W174-H255 AromaticContact CZ3-CG 3.61Å; W174-H255 AromaticContact CZ3-ND1 3.67Å; T216-H255 HydrophobicContact CG2-CB 4.28Å; E253-H255 VanDerWaalsContact C-N 3.26Å; E253-H255 PolarHBondContact O-N 2.9Å
256	Y	85	Confident	68.4	Low	69 Å²	69	58 Å²	58	27%	0.271	35%	0.352	S	S	.	.	S	Bend	trans	-73.3	141.6	179.4	-72.5	-77.6	0	0	0	111.4	N213 E252 V258 N263	N213-Y256 HydrophobicContact CB-CD1 4.11Å; E252-Y256 VanDerWaalsContact O-CD2 3.3Å; E252-Y256 WeakPolarHBondContact O-CD2 3.44Å; Y256-V258 PolarHBondContact O-N 2.93Å; Y256-N263 PolarHBondContact O-ND2 2.78Å
257	F	88.8	Confident	71.6	Confident	2 Å²	2	52 Å²	52	1%	0.009	31%	0.31	C	S	.	.			trans	-75.7	108.6	172.9	-58.4	-64.1	0	0	0	109.1	L154 L170 L180 L182 L209 A212 N213 V264	L154-F257 HydrophobicContact CD2-CZ 4.12Å; L170-F257 HydrophobicContact CD2-CE2 4.1Å; L170-F257 HydrophobicContact CD2-CZ 3.95Å; L180-F257 HydrophobicContact CB-CE1 3.79Å; L180-F257 HydrophobicContact CB-CZ 4.06Å; L180-F257 HydrophobicContact CD1-CZ 3.98Å; L182-F257 HydrophobicContact CB-CD1 3.48Å; L182-F257 VanDerWaalsContact CB-CD1 3.48Å; L182-F257 HydrophobicContact CB-CE1 3.7Å; L182-F257 HydrophobicContact CB-CG 4.07Å; L182-F257 HydrophobicContact CB-CZ 4.46Å; L182-F257 HydrophobicContact CD2-CB 3.98Å; L182-F257 HydrophobicContact CD2-CD1 4.17Å; L182-F257 HydrophobicContact CD2-CD2 4.23Å; L182-F257 HydrophobicContact CD2-CG 3.87Å; L182-F257 HydrophobicContact CG-CD1 4.42Å; L209-F257 HydrophobicContact CD1-CB 3.53Å; A212-F257 HydrophobicContact CB-CD2 3.89Å; A212-F257 HydrophobicContact CB-CE2 4.12Å; N213-F257 PolarHBondContact ND2-O 3.46Å; N213-F257 WeakPolarHBondContact OD1-CB 3.49Å; N213-F257 WeakPolarHBondContact OD1-CD2 3.48Å; N213-F257 PolarHBondContact OD1-N 3.4Å; F257-V264 HydrophobicContact CB-CG2 3.9Å
258	V	88.2	Confident	74.7	Confident	52 Å²	52	46.5 Å²	46.5	32%	0.315	27%	0.271	S	S	.	.			trans	-130.1	108.7	-176.4	-179.3	0	0	0	0	108.2	Y256 S260 S261 N263	Y256-V258 PolarHBondContact O-N 2.93Å; V258-S260 WeakPolarHBondContact CG1-OG 3.16Å; V258-S260 PolarHBondContact O-N 2.8Å; V258-S261 PolarHBondContact O-N 2.82Å; V258-S261 PolarHBondContact O-OG 2.8Å; V258-N263 PolarHBondContact N-OD1 3.15Å; V258-N263 PolarHBondContact O-OD1 2.66Å
259	P	89.6	Confident	77.6	Confident	3 Å²	3	43.7 Å²	43.7	2%	0.019	24%	0.242	C	C	.	.	G	3₁₀ helix	trans	-54.2	-32.1	-178	-33.2	39.4	0	0	0	115	L209 G262 V264 F266 L277 W301	L209-P259 HydrophobicContact CD2-CG 3.71Å; P259-G262 PolarHBondContact O-N 2.96Å; P259-V264 HydrophobicContact CB-CB 4.33Å; P259-V264 HydrophobicContact CG-CB 4.04Å; P259-V264 HydrophobicContact CG-CG1 4.32Å; P259-V264 HydrophobicContact CG-CG2 4.01Å; P259-F266 HydrophobicContact CB-CE2 4.33Å; P259-F266 HydrophobicContact CB-CZ 4.31Å; P259-F266 HydrophobicContact CG-CZ 4.21Å; P259-L277 VanDerWaalsContact C-CD1 3.47Å; P259-L277 HydrophobicContact CB-CD1 3.56Å; P259-L277 HydrophobicContact CB-CG 3.99Å; P259-L277 WeakPolarHBondContact O-CD1 3.48Å; P259-W301 HydrophobicContact CB-CD2 4.03Å; P259-W301 HydrophobicContact CB-CE3 4.39Å; P259-W301 HydrophobicContact CB-CG 4.08Å; P259-W301 HydrophobicContact CG-CD2 3.89Å; P259-W301 HydrophobicContact CG-CE3 4.38Å; P259-W301 HydrophobicContact CG-CG 4.22Å; P259-W301 HydrophobicContact CG-CZ2 4.1Å
260	S	84.6	Confident	80.3	Confident	50 Å²	50	43.6 Å²	43.6	35%	0.35	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-73.4	-25.5	177	55.2	0	0	0	0	113.8	V258 G262	V258-S260 WeakPolarHBondContact CG1-OG 3.16Å; V258-S260 PolarHBondContact O-N 2.8Å; S260-G262 PolarHBondContact O-N 3.5Å
261	S	85.1	Confident	82.5	Confident	59 Å²	59	39.4 Å²	39.4	41%	0.413	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-73.6	-17	172.9	77.9	0	0	0	0	111.9	V258 N263 Q396	V258-S261 PolarHBondContact O-N 2.82Å; V258-S261 PolarHBondContact O-OG 2.8Å; S261-N263 PolarHBondContact OG-OD1 3.45Å; S261-N263 VanDerWaalsContact OG-OD1 3.07Å; S261-Q396 PolarHBondContact O-NE2 3.16Å
262	G	87.3	Confident	84.3	Confident	6 Å²	6	36.1 Å²	36.1	6%	0.062	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	12.6	178.7	0	0	0	0	0	114.2	P259 S260 V264 M392 Q396	P259-G262 PolarHBondContact O-N 2.96Å; S260-G262 PolarHBondContact O-N 3.5Å; G262-V264 VanDerWaalsContact C-N 3.34Å; G262-M392 WeakPolarHBondContact O-CG 3.39Å; G262-Q396 PolarHBondContact O-NE2 3.49Å
263	N	91.7	Very high	86.2	Confident	7 Å²	7	31.9 Å²	31.9	4%	0.037	17%	0.166	C	C	.	.			trans	-88.1	2.3	173.5	71.3	-5.9	0	0	0	114.2	L182 Y256 V258 S261 Q396	L182-N263 PolarHBondContact N-O 2.82Å; Y256-N263 PolarHBondContact O-ND2 2.78Å; V258-N263 PolarHBondContact N-OD1 3.15Å; V258-N263 PolarHBondContact O-OD1 2.66Å; S261-N263 PolarHBondContact OG-OD1 3.45Å; S261-N263 VanDerWaalsContact OG-OD1 3.07Å; N263-Q396 HydrophobicContact CB-CG 4.27Å
264	V	94.6	Very high	88	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.6	173.6	-170.7	0	0	0	0	110.4	L182 L184 L209 F257 P259 G262 F266	L182-V264 HydrophobicContact CB-CG1 4.44Å; L182-V264 HydrophobicContact CB-CG2 4.35Å; L182-V264 HydrophobicContact CD2-CG1 4.19Å; L182-V264 HydrophobicContact CD2-CG2 4.36Å; L182-V264 HydrophobicContact CG-CG1 4.31Å; L182-V264 CarbonylContact O-C 3.52Å; L182-V264 WeakPolarHBondContact O-CA 3.32Å; L184-V264 HydrophobicContact CD1-CG1 4.21Å; L184-V264 HydrophobicContact CG-CG1 4.24Å; L209-V264 HydrophobicContact CD1-CG2 4Å; F257-V264 HydrophobicContact CB-CG2 3.9Å; P259-V264 HydrophobicContact CB-CB 4.33Å; P259-V264 HydrophobicContact CG-CB 4.04Å; P259-V264 HydrophobicContact CG-CG1 4.32Å; P259-V264 HydrophobicContact CG-CG2 4.01Å; G262-V264 VanDerWaalsContact C-N 3.34Å; V264-F266 HydrophobicContact CG1-CZ 4.44Å
265	A	95.6	Very high	89.5	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	141.7	170.2	0	0	0	0	0	111	L182 V183 L184 R276 M392	L182-A265 PolarHBondContact O-N 3.21Å; V183-A265 WeakPolarHBondContact CA-O 2.96Å; V183-A265 HydrophobicContact CG2-CB 4.4Å; L184-A265 PolarHBondContact N-O 2.93Å; A265-R276 HydrophobicContact CB-CG 4.28Å; A265-M392 HydrophobicContact CB-CE 4.12Å; A265-M392 HydrophobicContact CB-SD 3.84Å
266	F	96.5	Very high	90.5	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.4	175	-59.9	-85.1	0	0	0	108.5	L184 I187 L205 P259 V264 A274 F275 L277 W301 F326	L184-F266 HydrophobicContact CB-CD1 4.37Å; L184-F266 HydrophobicContact CD1-CD1 4.02Å; L184-F266 HydrophobicContact CD1-CE1 3.71Å; I187-F266 HydrophobicContact CD1-CB 3.6Å; I187-F266 HydrophobicContact CD1-CD1 3.97Å; I187-F266 HydrophobicContact CD1-CG 4.29Å; L205-F266 HydrophobicContact CD1-CD1 4.16Å; L205-F266 HydrophobicContact CD1-CE1 4.16Å; L205-F266 HydrophobicContact CD2-CD1 4.29Å; L205-F266 HydrophobicContact CD2-CE1 4.43Å; P259-F266 HydrophobicContact CB-CE2 4.33Å; P259-F266 HydrophobicContact CB-CZ 4.31Å; P259-F266 HydrophobicContact CG-CZ 4.21Å; V264-F266 HydrophobicContact CG1-CZ 4.44Å; F266-A274 CarbonylContact O-C 3.46Å; F266-A274 WeakPolarHBondContact O-CA 3.32Å; F266-A274 WeakPolarHBondContact O-CB 3.44Å; F266-F275 HydrophobicContact CB-CE1 4.08Å; F266-F275 HydrophobicContact CB-CE2 3.97Å; F266-F275 HydrophobicContact CB-CZ 3.71Å; F266-F275 HydrophobicContact CD2-CD2 4.31Å; F266-F275 AromaticContact CD2-CE2 3.75Å; F266-F275 HydrophobicContact CD2-CE2 3.75Å; F266-F275 HydrophobicContact CD2-CZ 4.26Å; F266-F275 HydrophobicContact CG-CE2 4.14Å; F266-F275 HydrophobicContact CG-CZ 4.18Å; F266-F275 PolarHBondContact N-O 3.05Å; F266-F275 PolarHBondContact O-N 3.44Å; F266-L277 HydrophobicContact CE2-CD2 4.1Å; F266-W301 AromaticContact CE1-CH2 3.92Å; F266-W301 HydrophobicContact CE1-CH2 3.92Å; F266-W301 AromaticContact CE1-CZ3 3.69Å; F266-W301 HydrophobicContact CE1-CZ3 3.69Å; F266-W301 HydrophobicContact CE2-CZ3 4.29Å; F266-W301 AromaticContact CZ-CE3 3.84Å; F266-W301 HydrophobicContact CZ-CE3 3.84Å; F266-W301 AromaticContact CZ-CH2 3.77Å; F266-W301 HydrophobicContact CZ-CH2 3.77Å; F266-W301 AromaticContact CZ-CZ3 3.29Å; F266-W301 HydrophobicContact CZ-CZ3 3.29Å; F266-F326 HydrophobicContact CD1-CZ 4.06Å; F266-F326 HydrophobicContact CD2-CE2 4.27Å; F266-F326 HydrophobicContact CD2-CZ 4.03Å; F266-F326 AromaticContact CE1-CZ 3.95Å; F266-F326 HydrophobicContact CE1-CZ 3.95Å; F266-F326 AromaticContact CE2-CE2 3.95Å; F266-F326 HydrophobicContact CE2-CE2 3.95Å; F266-F326 AromaticContact CE2-CZ 3.93Å; F266-F326 HydrophobicContact CE2-CZ 3.93Å; F266-F326 HydrophobicContact CG-CZ 4.1Å; F266-F326 HydrophobicContact CZ-CE2 4.17Å; F266-F326 AromaticContact CZ-CZ 3.9Å; F266-F326 HydrophobicContact CZ-CZ 3.9Å
267	A	95.4	Very high	90.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	155.9	-170.1	0	0	0	0	0	114.3	V183 L184 N185 K186 I187 W273 A274	V183-A267 HydrophobicContact CG1-CB 3.75Å; L184-A267 PolarHBondContact O-N 3.49Å; N185-A267 CarbonylContact C-O 3.51Å; N185-A267 WeakPolarHBondContact CA-O 3.48Å; K186-A267 PolarHBondContact N-O 2.82Å; I187-A267 PolarHBondContact N-O 2.64Å; A267-W273 WeakPolarHBondContact CA-O 3.27Å; A267-A274 HydrophobicContact CB-CB 3.57Å
268	S	93.7	Very high	90.9	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	103.3	151.3	177.7	0	0	0	0	108.3	D188 L270 D271 N272 W273	D188-S268 WeakPolarHBondContact OD1-CB 3.18Å; D188-S268 PolarHBondContact OD1-OG 3.34Å; S268-L270 PolarHBondContact O-N 3.25Å; S268-D271 PolarHBondContact O-N 2.99Å; S268-D271 PolarHBondContact OG-N 3.43Å; S268-N272 PolarHBondContact O-N 2.94Å; S268-N272 VanDerWaalsContact O-N 3.09Å; S268-W273 PolarHBondContact N-O 3.26Å; S268-W273 PolarHBondContact O-N 3.03Å
269	A	89.7	Confident	90.8	Very high	2 Å²	2	14.4 Å²	14.4	2%	0.017	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-23.7	177.4	0	0	0	0	0	112.5	L74 L77 N185	L74-A269 HydrophobicContact CB-CB 4.21Å; L74-A269 HydrophobicContact CD1-CB 4.44Å; L77-A269 HydrophobicContact CD1-CB 3.95Å; L77-A269 VanDerWaalsContact CD1-O 3.23Å; L77-A269 WeakPolarHBondContact CD1-O 3.32Å; N185-A269 PolarHBondContact OD1-N 3.15Å
270	L	87	Confident	90.6	Very high	77 Å²	77	14.4 Å²	14.4	40%	0.403	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-37.3	178.1	-172.7	52.8	0	0	0	111.8	S268 Q376	S268-L270 PolarHBondContact O-N 3.25Å; L270-Q376 PolarHBondContact O-NE2 2.82Å
271	D	87.8	Confident	90.8	Very high	1 Å²	1	12 Å²	12	1%	0.005	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	11.4	-176.4	-70	-38.4	0	0	0	113.5	S268 W273 Y338 R372 L375	S268-D271 PolarHBondContact O-N 2.99Å; S268-D271 PolarHBondContact OG-N 3.43Å; D271-W273 PolarHBondContact O-N 3.13Å; D271-Y338 PolarHBondContact OD2-OH 3.45Å; D271-R372 WeakPolarHBondContact OD1-CG 3.38Å; D271-R372 IonicContact OD1-CZ 3.47Å; D271-R372 IonicContact OD1-NE 3.33Å; D271-R372 PolarHBondContact OD1-NE 3.42Å; D271-R372 IonicContact OD1-NH2 3.8Å; D271-R372 PolarHBondContact OD1-NH2 3.13Å; D271-R372 IonicContact OD2-CZ 3.74Å; D271-R372 IonicContact OD2-NE 3.64Å; D271-R372 IonicContact OD2-NH2 3.78Å; D271-R372 PolarHBondContact OD2-NH2 3.31Å; D271-L375 HydrophobicContact CB-CD2 3.46Å; D271-L375 VanDerWaalsContact CB-CD2 3.46Å; D271-L375 WeakPolarHBondContact OD1-CD2 3.41Å
272	N	87.3	Confident	90.8	Very high	34 Å²	34	13 Å²	13	18%	0.182	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	41	173.9	-167.6	23.6	0	0	0	115.3	L77 S268	L77-N272 HydrophobicContact CD2-CB 4.1Å; L77-N272 WeakPolarHBondContact CD2-OD1 3.21Å; S268-N272 PolarHBondContact O-N 2.94Å; S268-N272 VanDerWaalsContact O-N 3.09Å
273	W	91.9	Very high	90.7	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	150.4	166.3	61.3	-85.2	0	0	0	114	I187 A267 S268 D271 F275 L334 Y338 F379 I383 A385	I187-W273 HydrophobicContact CB-CH2 3.81Å; I187-W273 HydrophobicContact CB-CZ2 4.12Å; I187-W273 HydrophobicContact CD1-CH2 4.02Å; I187-W273 HydrophobicContact CD1-CZ3 4.48Å; I187-W273 HydrophobicContact CG1-CH2 4.47Å; I187-W273 HydrophobicContact CG2-CH2 3.89Å; I187-W273 HydrophobicContact CG2-CZ2 4.27Å; A267-W273 WeakPolarHBondContact CA-O 3.27Å; S268-W273 PolarHBondContact N-O 3.26Å; S268-W273 PolarHBondContact O-N 3.03Å; D271-W273 PolarHBondContact O-N 3.13Å; W273-F275 AromaticContact CE3-CD1 3.85Å; W273-F275 HydrophobicContact CE3-CD1 3.85Å; W273-F275 AromaticContact CE3-CE1 3.89Å; W273-F275 HydrophobicContact CE3-CE1 3.89Å; W273-F275 HydrophobicContact CH2-CE1 4.26Å; W273-F275 AromaticContact CZ3-CD1 3.75Å; W273-F275 HydrophobicContact CZ3-CD1 3.75Å; W273-F275 AromaticContact CZ3-CE1 3.34Å; W273-F275 HydrophobicContact CZ3-CE1 3.34Å; W273-F275 HydrophobicContact CZ3-CZ 4.38Å; W273-L334 HydrophobicContact CH2-CD1 3.72Å; W273-L334 HydrophobicContact CZ2-CD1 4.22Å; W273-L334 HydrophobicContact CZ3-CD1 4.11Å; W273-Y338 AromaticContact NE1-CZ 3.96Å; W273-Y338 PolarHBondContact NE1-OH 3.15Å; W273-F379 HydrophobicContact CB-CB 3.9Å; W273-F379 HydrophobicContact CB-CD1 3.96Å; W273-F379 HydrophobicContact CB-CG 4.07Å; W273-F379 AromaticContact CD1-CD1 3.63Å; W273-F379 AromaticContact CD1-CD2 3.59Å; W273-F379 AromaticContact CD1-CE2 3.99Å; W273-F379 AromaticContact CD1-CG 3.41Å; W273-F379 VanDerWaalsContact CD1-CG 3.41Å; W273-F379 HydrophobicContact CG-CB 4.21Å; W273-F379 AromaticContact CG-CD1 3.77Å; W273-F379 HydrophobicContact CG-CD1 3.77Å; W273-F379 HydrophobicContact CG-CD2 4.48Å; W273-F379 HydrophobicContact CG-CE1 4.28Å; W273-F379 AromaticContact CG-CG 3.91Å; W273-F379 HydrophobicContact CG-CG 3.91Å; W273-I383 WeakPolarHBondContact CA-O 3.4Å; W273-I383 HydrophobicContact CB-CD1 3.74Å; W273-I383 HydrophobicContact CB-CG1 3.75Å; W273-I383 VanDerWaalsContact CB-O 3.3Å; W273-I383 WeakPolarHBondContact CB-O 3.48Å; W273-I383 HydrophobicContact CD2-CD1 4.05Å; W273-I383 HydrophobicContact CE3-CD1 3.78Å; W273-I383 HydrophobicContact CG-CD1 4.08Å; W273-A385 VanDerWaalsContact C-CB 3.46Å
274	A	94.1	Very high	90.3	Very high	2 Å²	2	17 Å²	17	2%	0.017	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157	153.5	167.1	0	0	0	0	0	109.7	F266 A267 I383 A385 A388 V389	F266-A274 CarbonylContact O-C 3.46Å; F266-A274 WeakPolarHBondContact O-CA 3.32Å; F266-A274 WeakPolarHBondContact O-CB 3.44Å; A267-A274 HydrophobicContact CB-CB 3.57Å; A274-I383 PolarHBondContact N-O 3.34Å; A274-A385 HydrophobicContact CB-CB 3.95Å; A274-A385 VanDerWaalsContact N-CA 3.29Å; A274-A388 HydrophobicContact CB-CB 4.14Å; A274-A388 VanDerWaalsContact O-CB 3.32Å; A274-A388 WeakPolarHBondContact O-CB 3.31Å; A274-V389 HydrophobicContact CB-CG2 4.32Å
275	F	94.1	Very high	89.8	Confident	2 Å²	2	18 Å²	18	1%	0.009	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	152.9	173.4	61.9	-90.6	0	0	0	110.9	F266 W273 F280 F326 V330 L334 I383	F266-F275 HydrophobicContact CB-CE1 4.08Å; F266-F275 HydrophobicContact CB-CE2 3.97Å; F266-F275 HydrophobicContact CB-CZ 3.71Å; F266-F275 HydrophobicContact CD2-CD2 4.31Å; F266-F275 AromaticContact CD2-CE2 3.75Å; F266-F275 HydrophobicContact CD2-CE2 3.75Å; F266-F275 HydrophobicContact CD2-CZ 4.26Å; F266-F275 HydrophobicContact CG-CE2 4.14Å; F266-F275 HydrophobicContact CG-CZ 4.18Å; F266-F275 PolarHBondContact N-O 3.05Å; F266-F275 PolarHBondContact O-N 3.44Å; W273-F275 AromaticContact CE3-CD1 3.85Å; W273-F275 HydrophobicContact CE3-CD1 3.85Å; W273-F275 AromaticContact CE3-CE1 3.89Å; W273-F275 HydrophobicContact CE3-CE1 3.89Å; W273-F275 HydrophobicContact CH2-CE1 4.26Å; W273-F275 AromaticContact CZ3-CD1 3.75Å; W273-F275 HydrophobicContact CZ3-CD1 3.75Å; W273-F275 AromaticContact CZ3-CE1 3.34Å; W273-F275 HydrophobicContact CZ3-CE1 3.34Å; W273-F275 HydrophobicContact CZ3-CZ 4.38Å; F275-F280 HydrophobicContact CD2-CB 4.06Å; F275-F280 HydrophobicContact CD2-CD2 4.33Å; F275-F280 HydrophobicContact CD2-CG 4.5Å; F275-F326 HydrophobicContact CE2-CE2 4.12Å; F275-F326 HydrophobicContact CE2-CZ 4.15Å; F275-F326 HydrophobicContact CZ-CZ 4.17Å; F275-V330 HydrophobicContact CE1-CG1 4.02Å; F275-V330 HydrophobicContact CE2-CG1 3.69Å; F275-V330 HydrophobicContact CZ-CG1 3.25Å; F275-L334 HydrophobicContact CE1-CD1 3.98Å; F275-L334 HydrophobicContact CZ-CD1 4.39Å; F275-I383 HydrophobicContact CD1-CD1 3.86Å; F275-I383 HydrophobicContact CE1-CD1 4.49Å
276	R	93.5	Very high	89.1	Confident	10 Å²	10	24.8 Å²	24.8	4%	0.038	13%	0.125	C	C	.	.			trans	-96.5	166.7	160.4	-58.8	172.6	-66.9	171.1	8.2	109.6	A265 S278 D279 F280 D395	A265-R276 HydrophobicContact CB-CG 4.28Å; R276-S278 PolarHBondContact O-N 2.9Å; R276-D279 VanDerWaalsContact CB-OD2 3.31Å; R276-D279 WeakPolarHBondContact CB-OD2 3.36Å; R276-D279 WeakPolarHBondContact CG-OD2 3.45Å; R276-D279 IonicContact CZ-OD1 4Å; R276-D279 IonicContact CZ-OD2 2.95Å; R276-D279 PolarHBondContact N-OD2 3.23Å; R276-D279 VanDerWaalsContact N-OD2 3.14Å; R276-D279 IonicContact NE-OD1 3.91Å; R276-D279 IonicContact NE-OD2 3.81Å; R276-D279 PolarHBondContact NE-OD2 2.9Å; R276-D279 IonicContact NH2-OD1 3.94Å; R276-D279 PolarHBondContact NH2-OD1 3.4Å; R276-D279 IonicContact NH2-OD2 2.98Å; R276-D279 PolarHBondContact O-N 2.77Å; R276-F280 PolarHBondContact O-N 2.75Å; R276-D395 IonicContact CZ-OD2 3.7Å; R276-D395 IonicContact NH1-OD2 3.01Å; R276-D395 PolarHBondContact NH1-OD2 2.91Å; R276-D395 IonicContact NH2-OD2 2.75Å
277	L	91.8	Very high	88.3	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-58.2	-37.4	173.4	-64.3	-171.3	0	0	0	112.3	P259 F266 F280 A281 L300 W301 F326	P259-L277 VanDerWaalsContact C-CD1 3.47Å; P259-L277 HydrophobicContact CB-CD1 3.56Å; P259-L277 HydrophobicContact CB-CG 3.99Å; P259-L277 WeakPolarHBondContact O-CD1 3.48Å; F266-L277 HydrophobicContact CE2-CD2 4.1Å; L277-F280 PolarHBondContact O-N 2.64Å; L277-A281 WeakPolarHBondContact O-CB 3.34Å; L277-A281 PolarHBondContact O-N 2.99Å; L277-L300 HydrophobicContact CD2-CB 4.25Å; L277-W301 HydrophobicContact CD1-CB 3.59Å; L277-W301 HydrophobicContact CD1-CG 4.39Å; L277-F326 HydrophobicContact CD2-CD2 3.96Å; L277-F326 HydrophobicContact CD2-CE2 3.66Å
278	S	88.9	Confident	87.4	Confident	35 Å²	35	30.4 Å²	30.4	25%	0.245	15%	0.149	C	C	.	.	H	α-helix	trans	-65.5	-46	176.9	52.5	0	0	0	0	112.6	R276 F280 A281 E282	R276-S278 PolarHBondContact O-N 2.9Å; S278-F280 VanDerWaalsContact C-N 3.26Å; S278-F280 PolarHBondContact O-N 3.5Å; S278-A281 PolarHBondContact O-N 2.83Å; S278-E282 PolarHBondContact O-N 3.28Å
279	D	86.4	Confident	86.5	Confident	15 Å²	15	36.9 Å²	36.9	8%	0.08	19%	0.189	C	C	.	.	H	α-helix	trans	-62	-38.1	177.8	-55.6	-60.2	0	0	0	110.7	R276 L283 R391	R276-D279 VanDerWaalsContact CB-OD2 3.31Å; R276-D279 WeakPolarHBondContact CB-OD2 3.36Å; R276-D279 WeakPolarHBondContact CG-OD2 3.45Å; R276-D279 IonicContact CZ-OD1 4Å; R276-D279 IonicContact CZ-OD2 2.95Å; R276-D279 PolarHBondContact N-OD2 3.23Å; R276-D279 VanDerWaalsContact N-OD2 3.14Å; R276-D279 IonicContact NE-OD1 3.91Å; R276-D279 IonicContact NE-OD2 3.81Å; R276-D279 PolarHBondContact NE-OD2 2.9Å; R276-D279 IonicContact NH2-OD1 3.94Å; R276-D279 PolarHBondContact NH2-OD1 3.4Å; R276-D279 IonicContact NH2-OD2 2.98Å; R276-D279 PolarHBondContact O-N 2.77Å; D279-L283 WeakPolarHBondContact O-CG 3.39Å; D279-L283 PolarHBondContact O-N 3.26Å; D279-R391 IonicContact OD1-NH1 3.31Å; D279-R391 PolarHBondContact OD1-NH1 3.09Å
280	F	86.5	Confident	85.6	Confident	2 Å²	2	39.8 Å²	39.8	1%	0.009	21%	0.208	C	C	.	.	H	α-helix	trans	-73.2	-41	176.4	-163.3	-91.6	0	0	0	112.2	F275 R276 L277 S278 E282 L283 W284 L300 V330	F275-F280 HydrophobicContact CD2-CB 4.06Å; F275-F280 HydrophobicContact CD2-CD2 4.33Å; F275-F280 HydrophobicContact CD2-CG 4.5Å; R276-F280 PolarHBondContact O-N 2.75Å; L277-F280 PolarHBondContact O-N 2.64Å; S278-F280 VanDerWaalsContact C-N 3.26Å; S278-F280 PolarHBondContact O-N 3.5Å; F280-E282 VanDerWaalsContact C-N 3.31Å; F280-E282 PolarHBondContact O-N 2.93Å; F280-L283 WeakPolarHBondContact O-CB 3.39Å; F280-L283 PolarHBondContact O-N 3.01Å; F280-W284 AromaticContact CD1-CD1 3.38Å; F280-W284 HydrophobicContact CD1-CG 4.3Å; F280-W284 AromaticContact CD1-NE1 3.78Å; F280-W284 AromaticContact CE1-CD1 3.07Å; F280-W284 HydrophobicContact CE1-CD2 4.37Å; F280-W284 AromaticContact CE1-CE2 3.86Å; F280-W284 AromaticContact CE1-CG 3.93Å; F280-W284 HydrophobicContact CE1-CG 3.93Å; F280-W284 AromaticContact CE1-NE1 3.02Å; F280-W284 AromaticContact CE2-NE1 3.5Å; F280-W284 AromaticContact CG-CD1 3.99Å; F280-W284 AromaticContact CZ-CD1 3.46Å; F280-W284 VanDerWaalsContact CZ-CD1 3.46Å; F280-W284 AromaticContact CZ-CE2 3.74Å; F280-W284 HydrophobicContact CZ-CZ2 4.31Å; F280-W284 AromaticContact CZ-NE1 2.88Å; F280-W284 VanDerWaalsContact O-CD1 3.29Å; F280-W284 PolarHBondContact O-N 2.81Å; F280-L300 HydrophobicContact CD1-CD1 4.15Å; F280-L300 HydrophobicContact CD1-CD2 4.34Å; F280-V330 HydrophobicContact CD1-CG2 3.73Å; F280-V330 HydrophobicContact CD2-CG1 4.39Å; F280-V330 HydrophobicContact CD2-CG2 4.47Å; F280-V330 HydrophobicContact CE1-CB 4.23Å; F280-V330 HydrophobicContact CE1-CG2 3.32Å; F280-V330 HydrophobicContact CE2-CB 4.35Å; F280-V330 HydrophobicContact CE2-CG1 3.99Å; F280-V330 HydrophobicContact CE2-CG2 4.14Å; F280-V330 HydrophobicContact CG-CG2 4.28Å; F280-V330 HydrophobicContact CZ-CB 3.93Å; F280-V330 HydrophobicContact CZ-CG1 4.1Å; F280-V330 HydrophobicContact CZ-CG2 3.53Å
281	A	88	Confident	85.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-59.4	-42.3	175.4	0	0	0	0	0	111	L277 S278 L283 W284 A285 E293 L296 C297 L300	L277-A281 WeakPolarHBondContact O-CB 3.34Å; L277-A281 PolarHBondContact O-N 2.99Å; S278-A281 PolarHBondContact O-N 2.83Å; A281-L283 VanDerWaalsContact C-N 3.34Å; A281-L283 PolarHBondContact O-N 2.9Å; A281-W284 PolarHBondContact O-N 3.46Å; A281-A285 WeakPolarHBondContact O-CB 3.29Å; A281-A285 PolarHBondContact O-N 3.44Å; A281-E293 HydrophobicContact CB-CG 4.29Å; A281-L296 HydrophobicContact CB-CD2 4.4Å; A281-L296 HydrophobicContact CB-CG 4.41Å; A281-C297 HydrophobicContact CB-CB 3.98Å; A281-L300 HydrophobicContact CB-CD1 3.89Å
282	E	85.8	Confident	84.8	Confident	81 Å²	81	40.7 Å²	40.7	38%	0.379	21%	0.214	S	C	.	.	H	α-helix	trans	-60.7	-41.6	176.1	-164.1	-160.2	145.4	0	0	111.8	S278 F280 W284 K286	S278-E282 PolarHBondContact O-N 3.28Å; F280-E282 VanDerWaalsContact C-N 3.31Å; F280-E282 PolarHBondContact O-N 2.93Å; E282-W284 VanDerWaalsContact C-N 3.35Å; E282-W284 PolarHBondContact O-N 3.09Å; E282-K286 WeakPolarHBondContact O-CG 3.44Å; E282-K286 IonicContact OE1-NZ 2.58Å; E282-K286 PolarHBondContact OE1-NZ 2.84Å
283	L	84.5	Confident	84.7	Confident	59 Å²	59	43.2 Å²	43.2	31%	0.309	22%	0.224	S	C	.	.	H	α-helix	trans	-64.2	-38.9	176.9	-72.6	172.1	0	0	0	112.2	D279 F280 A281 I383	D279-L283 WeakPolarHBondContact O-CG 3.39Å; D279-L283 PolarHBondContact O-N 3.26Å; F280-L283 WeakPolarHBondContact O-CB 3.39Å; F280-L283 PolarHBondContact O-N 3.01Å; A281-L283 VanDerWaalsContact C-N 3.34Å; A281-L283 PolarHBondContact O-N 2.9Å; L283-I383 HydrophobicContact CD1-CG2 3.74Å
284	W	82.8	Confident	84.3	Confident	37 Å²	37	50.3 Å²	50.3	14%	0.14	26%	0.258	C	S	.	.	H	α-helix	trans	-88.7	-29.7	-176.4	-78.7	84.7	0	0	0	114.4	F280 A281 E282 K286 R287 L288 L296 M329 N333	F280-W284 AromaticContact CD1-CD1 3.38Å; F280-W284 HydrophobicContact CD1-CG 4.3Å; F280-W284 AromaticContact CD1-NE1 3.78Å; F280-W284 AromaticContact CE1-CD1 3.07Å; F280-W284 HydrophobicContact CE1-CD2 4.37Å; F280-W284 AromaticContact CE1-CE2 3.86Å; F280-W284 AromaticContact CE1-CG 3.93Å; F280-W284 HydrophobicContact CE1-CG 3.93Å; F280-W284 AromaticContact CE1-NE1 3.02Å; F280-W284 AromaticContact CE2-NE1 3.5Å; F280-W284 AromaticContact CG-CD1 3.99Å; F280-W284 AromaticContact CZ-CD1 3.46Å; F280-W284 VanDerWaalsContact CZ-CD1 3.46Å; F280-W284 AromaticContact CZ-CE2 3.74Å; F280-W284 HydrophobicContact CZ-CZ2 4.31Å; F280-W284 AromaticContact CZ-NE1 2.88Å; F280-W284 VanDerWaalsContact O-CD1 3.29Å; F280-W284 PolarHBondContact O-N 2.81Å; A281-W284 PolarHBondContact O-N 3.46Å; E282-W284 VanDerWaalsContact C-N 3.35Å; E282-W284 PolarHBondContact O-N 3.09Å; W284-K286 PolarHBondContact O-N 3.47Å; W284-R287 CarbonylContact O-C 3.55Å; W284-R287 WeakPolarHBondContact O-CA 3.36Å; W284-R287 WeakPolarHBondContact O-CB 3.2Å; W284-R287 PolarHBondContact O-N 3.36Å; W284-L288 HydrophobicContact CE3-CD1 4.2Å; W284-L288 HydrophobicContact CE3-CG 4.42Å; W284-L288 WeakPolarHBondContact O-CB 3.48Å; W284-L288 PolarHBondContact O-N 2.99Å; W284-L296 HydrophobicContact CB-CD2 3.98Å; W284-M329 HydrophobicContact CB-CE 4.4Å; W284-M329 HydrophobicContact CD2-CE 3.62Å; W284-M329 HydrophobicContact CE3-CE 3.34Å; W284-M329 HydrophobicContact CG-CE 4.09Å; W284-M329 HydrophobicContact CZ3-CE 3.82Å; W284-N333 VanDerWaalsContact CZ2-ND2 3.27Å; W284-N333 WeakPolarHBondContact CZ2-ND2 3.4Å
285	A	83.8	Confident	83.9	Confident	22 Å²	22	56.4 Å²	56.4	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-59.6	-35.9	172.9	0	0	0	0	0	111	A281 R287 L288 E293	A281-A285 WeakPolarHBondContact O-CB 3.29Å; A281-A285 PolarHBondContact O-N 3.44Å; A285-R287 PolarHBondContact O-N 3.15Å; A285-L288 CarbonylContact O-C 3.59Å; A285-E293 HydrophobicContact CB-CB 4.3Å
286	K	82.4	Confident	83.5	Confident	142 Å²	142	56.4 Å²	56.4	62%	0.617	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-26.6	172.6	-70	170.9	-171.2	165.1	0	113.3	E282 W284	E282-K286 WeakPolarHBondContact O-CG 3.44Å; E282-K286 IonicContact OE1-NZ 2.58Å; E282-K286 PolarHBondContact OE1-NZ 2.84Å; W284-K286 PolarHBondContact O-N 3.47Å
287	R	79.6	Confident	83.1	Confident	75 Å²	75	56.6 Å²	56.6	28%	0.283	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-41.3	179	-64.6	-175.6	175.3	172.7	6	112.6	W284 A285 T289 L357	W284-R287 CarbonylContact O-C 3.55Å; W284-R287 WeakPolarHBondContact O-CA 3.36Å; W284-R287 WeakPolarHBondContact O-CB 3.2Å; W284-R287 PolarHBondContact O-N 3.36Å; A285-R287 PolarHBondContact O-N 3.15Å; R287-T289 PolarHBondContact O-N 3.47Å; R287-L357 PolarHBondContact NH2-O 2.97Å
288	L	76.7	Confident	82.8	Confident	42 Å²	42	61.3 Å²	61.3	22%	0.22	31%	0.312	C	S	.	.			trans	-96.7	78.4	-179.2	-61.3	175.6	0	0	0	107.9	W284 A285 C290 I291 M329	W284-L288 HydrophobicContact CE3-CD1 4.2Å; W284-L288 HydrophobicContact CE3-CG 4.42Å; W284-L288 WeakPolarHBondContact O-CB 3.48Å; W284-L288 PolarHBondContact O-N 2.99Å; A285-L288 CarbonylContact O-C 3.59Å; L288-C290 PolarHBondContact O-N 2.6Å; L288-I291 HydrophobicContact CB-CD1 4.34Å; L288-I291 HydrophobicContact CD1-CD1 4.12Å; L288-I291 PolarHBondContact O-N 3.34Å; L288-M329 HydrophobicContact CD1-CE 3.67Å
289	T	73.1	Confident	82.7	Confident	137 Å²	137	60 Å²	60	84%	0.84	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-9.6	-176.5	53.2	0	0	0	0	114.9	R287	R287-T289 PolarHBondContact O-N 3.47Å
290	C	70.9	Confident	82.8	Confident	62 Å²	62	59.2 Å²	59.2	42%	0.419	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	1.3	-174.5	60.3	0	0	0	0	115.1	L288 Q312	L288-C290 PolarHBondContact O-N 2.6Å; C290-Q312 PolarHBondContact O-NE2 2.97Å
291	I	76.3	Confident	82.8	Confident	13 Å²	13	61 Å²	61	7%	0.067	31%	0.305	C	S	.	.	S	Bend	trans	-125.1	133	-176.3	-49.9	175.5	0	0	0	109.6	L288 L296 L306 K311	L288-I291 HydrophobicContact CB-CD1 4.34Å; L288-I291 HydrophobicContact CD1-CD1 4.12Å; L288-I291 PolarHBondContact O-N 3.34Å; I291-L296 HydrophobicContact CG2-CB 3.93Å; I291-L306 HydrophobicContact CD1-CD1 3.97Å; I291-K311 WeakPolarHBondContact CD1-O 3.23Å
292	D	83.1	Confident	82.7	Confident	85 Å²	85	62 Å²	62	46%	0.455	32%	0.315	S	S	.	.			trans	-68.7	140	173.4	176.2	45.8	0	0	0	111.5	Q294 K295 L296	D292-Q294 VanDerWaalsContact C-N 3.34Å; D292-Q294 PolarHBondContact O-N 3.43Å; D292-K295 HydrophobicContact CB-CB 4.2Å; D292-K295 HydrophobicContact CB-CD 4.11Å; D292-K295 HydrophobicContact CB-CG 4.1Å; D292-K295 PolarHBondContact O-N 2.97Å; D292-L296 WeakPolarHBondContact O-CB 3.2Å; D292-L296 PolarHBondContact O-N 2.83Å
293	E	84.2	Confident	82.7	Confident	87 Å²	87	59.8 Å²	59.8	41%	0.407	31%	0.307	S	S	.	.	H	α-helix	trans	-59.7	-43.6	-173.8	-175.5	-172.5	148.8	0	0	111.7	A281 A285 L296 C297	A281-E293 HydrophobicContact CB-CG 4.29Å; A285-E293 HydrophobicContact CB-CB 4.3Å; E293-L296 PolarHBondContact O-N 3.12Å; E293-C297 WeakPolarHBondContact O-CB 3.3Å; E293-C297 PolarHBondContact O-N 3.34Å
294	Q	84.5	Confident	82.9	Confident	149 Å²	149	59.7 Å²	59.7	70%	0.696	30%	0.304	S	S	*	.	H	α-helix	trans	-68.8	-42.5	-179.5	-66.2	-175.1	-11.1	0	0	111.6	D292 L296 C297 N298	D292-Q294 VanDerWaalsContact C-N 3.34Å; D292-Q294 PolarHBondContact O-N 3.43Å; Q294-L296 VanDerWaalsContact C-N 3.3Å; Q294-L296 PolarHBondContact O-N 3.14Å; Q294-C297 PolarHBondContact O-N 2.72Å; Q294-N298 PolarHBondContact O-N 3.29Å
295	K	84.4	Confident	83.1	Confident	130 Å²	130	58.4 Å²	58.4	57%	0.565	30%	0.299	S	S	*	.	H	α-helix	trans	-60.7	-41.7	174.4	-68.8	-175.1	-175.5	177.4	0	111.6	D292 A299	D292-K295 HydrophobicContact CB-CB 4.2Å; D292-K295 HydrophobicContact CB-CD 4.11Å; D292-K295 HydrophobicContact CB-CG 4.1Å; D292-K295 PolarHBondContact O-N 2.97Å; K295-A299 VanDerWaalsContact O-CB 3.3Å; K295-A299 WeakPolarHBondContact O-CB 3.35Å; K295-A299 PolarHBondContact O-N 3.11Å
296	L	85.6	Confident	83.2	Confident	1 Å²	1	60.4 Å²	60.4	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-64.7	-47	175.9	-175.1	60.3	0	0	0	110.8	A281 W284 I291 D292 E293 Q294 N298 A299 L300 L325	A281-L296 HydrophobicContact CB-CD2 4.4Å; A281-L296 HydrophobicContact CB-CG 4.41Å; W284-L296 HydrophobicContact CB-CD2 3.98Å; I291-L296 HydrophobicContact CG2-CB 3.93Å; D292-L296 WeakPolarHBondContact O-CB 3.2Å; D292-L296 PolarHBondContact O-N 2.83Å; E293-L296 PolarHBondContact O-N 3.12Å; Q294-L296 VanDerWaalsContact C-N 3.3Å; Q294-L296 PolarHBondContact O-N 3.14Å; L296-N298 VanDerWaalsContact C-N 3.3Å; L296-N298 PolarHBondContact O-N 2.72Å; L296-A299 CarbonylContact O-C 3.55Å; L296-A299 PolarHBondContact O-N 2.81Å; L296-A299 VanDerWaalsContact O-N 3.12Å; L296-L300 HydrophobicContact CD1-CD2 4.27Å; L296-L300 HydrophobicContact CD1-CG 4.14Å; L296-L300 HydrophobicContact CG-CD1 4.19Å; L296-L300 HydrophobicContact CG-CG 4.09Å; L296-L300 WeakPolarHBondContact O-CB 3.3Å; L296-L300 WeakPolarHBondContact O-CG 3.5Å; L296-L300 PolarHBondContact O-N 3.03Å; L296-L325 HydrophobicContact CD1-CD2 3.95Å
297	C	86.7	Confident	83.3	Confident	15 Å²	15	55.5 Å²	55.5	10%	0.101	29%	0.287	C	S	.	.	H	α-helix	trans	-55.6	-44.2	178.7	-171.6	0	0	0	0	112.3	A281 E293 Q294	A281-C297 HydrophobicContact CB-CB 3.98Å; E293-C297 WeakPolarHBondContact O-CB 3.3Å; E293-C297 PolarHBondContact O-N 3.34Å; Q294-C297 PolarHBondContact O-N 2.72Å
298	N	84.6	Confident	83.3	Confident	99 Å²	99	56.2 Å²	56.2	53%	0.529	31%	0.309	S	S	.	.	H	α-helix	trans	-71.2	-32.6	178.4	-69.1	-14.9	0	0	0	112.9	Q294 L296	Q294-N298 PolarHBondContact O-N 3.29Å; L296-N298 VanDerWaalsContact C-N 3.3Å; L296-N298 PolarHBondContact O-N 2.72Å
299	A	86.7	Confident	83.5	Confident	6 Å²	6	63.6 Å²	63.6	5%	0.05	34%	0.339	C	S	.	.	H	α-helix	trans	-86.5	-14.6	179.1	0	0	0	0	0	114.1	K295 L296 W301 F304 P313 L325	K295-A299 VanDerWaalsContact O-CB 3.3Å; K295-A299 WeakPolarHBondContact O-CB 3.35Å; K295-A299 PolarHBondContact O-N 3.11Å; L296-A299 CarbonylContact O-C 3.55Å; L296-A299 PolarHBondContact O-N 2.81Å; L296-A299 VanDerWaalsContact O-N 3.12Å; A299-W301 PolarHBondContact O-N 2.82Å; A299-F304 HydrophobicContact CB-CB 4.31Å; A299-F304 HydrophobicContact CB-CD1 4.28Å; A299-F304 HydrophobicContact CB-CD2 4.38Å; A299-F304 HydrophobicContact CB-CG 4.07Å; A299-F304 WeakPolarHBondContact O-CB 3.43Å; A299-P313 HydrophobicContact CB-CB 3.38Å; A299-P313 HydrophobicContact CB-CG 3.69Å; A299-L325 HydrophobicContact CB-CD2 4.44Å
300	L	88	Confident	83.8	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.318	C	S	.	.	S	Bend	trans	-65.2	-25.4	-179.7	-86.4	172.1	0	0	0	112.4	L277 F280 A281 L296 L325 F326	L277-L300 HydrophobicContact CD2-CB 4.25Å; F280-L300 HydrophobicContact CD1-CD1 4.15Å; F280-L300 HydrophobicContact CD1-CD2 4.34Å; A281-L300 HydrophobicContact CB-CD1 3.89Å; L296-L300 HydrophobicContact CD1-CD2 4.27Å; L296-L300 HydrophobicContact CD1-CG 4.14Å; L296-L300 HydrophobicContact CG-CD1 4.19Å; L296-L300 HydrophobicContact CG-CG 4.09Å; L296-L300 WeakPolarHBondContact O-CB 3.3Å; L296-L300 WeakPolarHBondContact O-CG 3.5Å; L296-L300 PolarHBondContact O-N 3.03Å; L300-L325 HydrophobicContact CD2-CD2 4.03Å; L300-L325 HydrophobicContact CD2-CG 4.19Å; L300-L325 HydrophobicContact CG-CD2 4.49Å; L300-F326 VanDerWaalsContact O-CB 3.23Å; L300-F326 WeakPolarHBondContact O-CB 3.42Å; L300-F326 PolarHBondContact O-N 3.39Å
301	W	88.1	Confident	84.3	Confident	38 Å²	38	63 Å²	63	14%	0.144	33%	0.325	C	S	.	.	S	Bend	trans	-117.8	138.1	178.9	-169.9	-95.4	0	0	0	110.9	Y202 L205 V206 L209 P259 F266 L277 A299 F326	Y202-W301 HydrophobicContact CD2-CZ3 4.3Å; Y202-W301 HydrophobicContact CE2-CD2 4.45Å; Y202-W301 HydrophobicContact CE2-CE3 4.08Å; Y202-W301 HydrophobicContact CE2-CH2 4.25Å; Y202-W301 AromaticContact CE2-CZ3 3.96Å; Y202-W301 HydrophobicContact CE2-CZ3 3.96Å; L205-W301 HydrophobicContact CB-CH2 4.1Å; V206-W301 HydrophobicContact CG2-CH2 4.13Å; V206-W301 HydrophobicContact CG2-CZ2 3.79Å; L209-W301 HydrophobicContact CD2-CZ2 3.77Å; P259-W301 HydrophobicContact CB-CD2 4.03Å; P259-W301 HydrophobicContact CB-CE3 4.39Å; P259-W301 HydrophobicContact CB-CG 4.08Å; P259-W301 HydrophobicContact CG-CD2 3.89Å; P259-W301 HydrophobicContact CG-CE3 4.38Å; P259-W301 HydrophobicContact CG-CG 4.22Å; P259-W301 HydrophobicContact CG-CZ2 4.1Å; F266-W301 AromaticContact CE1-CH2 3.92Å; F266-W301 HydrophobicContact CE1-CH2 3.92Å; F266-W301 AromaticContact CE1-CZ3 3.69Å; F266-W301 HydrophobicContact CE1-CZ3 3.69Å; F266-W301 HydrophobicContact CE2-CZ3 4.29Å; F266-W301 AromaticContact CZ-CE3 3.84Å; F266-W301 HydrophobicContact CZ-CE3 3.84Å; F266-W301 AromaticContact CZ-CH2 3.77Å; F266-W301 HydrophobicContact CZ-CH2 3.77Å; F266-W301 AromaticContact CZ-CZ3 3.29Å; F266-W301 HydrophobicContact CZ-CZ3 3.29Å; L277-W301 HydrophobicContact CD1-CB 3.59Å; L277-W301 HydrophobicContact CD1-CG 4.39Å; A299-W301 PolarHBondContact O-N 2.82Å; W301-F326 HydrophobicContact CE3-CD1 4.49Å; W301-F326 AromaticContact CE3-CD2 3.78Å; W301-F326 HydrophobicContact CE3-CD2 3.78Å; W301-F326 AromaticContact CE3-CE2 3.98Å; W301-F326 HydrophobicContact CE3-CE2 3.98Å; W301-F326 HydrophobicContact CE3-CG 4.05Å; W301-F326 HydrophobicContact CE3-CZ 4.39Å; W301-F326 HydrophobicContact CZ3-CD1 4.1Å; W301-F326 HydrophobicContact CZ3-CD2 4.09Å; W301-F326 AromaticContact CZ3-CE1 3.99Å; W301-F326 HydrophobicContact CZ3-CE1 3.99Å; W301-F326 HydrophobicContact CZ3-CE2 4.02Å; W301-F326 HydrophobicContact CZ3-CG 4.13Å; W301-F326 AromaticContact CZ3-CZ 3.96Å; W301-F326 HydrophobicContact CZ3-CZ 3.96Å
302	G	84.8	Confident	84.5	Confident	21 Å²	21	65.5 Å²	65.5	22%	0.216	34%	0.336	C	S	.	.	S	Bend	trans	101.6	-170.8	-174.1	0	0	0	0	0	113.6	Y202 F304	Y202-G302 WeakPolarHBondContact OH-CA 3.48Å; Y202-G302 PolarHBondContact OH-N 2.83Å; Y202-G302 VanDerWaalsContact OH-N 3.14Å; Y202-G302 PolarHBondContact OH-O 3.09Å; G302-F304 PolarHBondContact O-N 2.61Å
303	D	86.1	Confident	84.5	Confident	36 Å²	36	62.8 Å²	62.8	19%	0.193	32%	0.323	C	S	.	.	S	Bend	trans	-83.1	51.2	-171.5	-166.4	49.3	0	0	0	113.5	H315 G316 A317 S318	D303-H315 CarbonylContact O-C 3.55Å; D303-H315 WeakPolarHBondContact O-CA 3.27Å; D303-G316 PolarHBondContact O-N 2.74Å; D303-G316 VanDerWaalsContact OD2-CA 3.27Å; D303-G316 WeakPolarHBondContact OD2-CA 3.41Å; D303-A317 PolarHBondContact O-N 2.87Å; D303-A317 WeakPolarHBondContact OD1-CB 3.36Å; D303-A317 PolarHBondContact OD1-N 2.8Å; D303-A317 PolarHBondContact OD2-N 3.38Å; D303-A317 VanDerWaalsContact OD2-N 3.07Å; D303-S318 VanDerWaalsContact OD1-CB 3.31Å; D303-S318 WeakPolarHBondContact OD1-CB 3.46Å; D303-S318 PolarHBondContact OD1-N 3.05Å; D303-S318 PolarHBondContact OD1-OG 3.34Å; D303-S318 PolarHBondContact OD2-N 3.32Å
304	F	88.5	Confident	84.6	Confident	57 Å²	57	61.1 Å²	61.1	25%	0.25	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	145	177	-65.1	-86.5	0	0	0	111.2	A299 G302 V314 H315 P324 L325	A299-F304 HydrophobicContact CB-CB 4.31Å; A299-F304 HydrophobicContact CB-CD1 4.28Å; A299-F304 HydrophobicContact CB-CD2 4.38Å; A299-F304 HydrophobicContact CB-CG 4.07Å; A299-F304 WeakPolarHBondContact O-CB 3.43Å; G302-F304 PolarHBondContact O-N 2.61Å; F304-V314 WeakPolarHBondContact CA-O 3.45Å; F304-H315 HydrophobicContact CD1-CB 4.15Å; F304-H315 HydrophobicContact CE1-CB 3.95Å; F304-H315 AromaticContact CE1-CD2 3.96Å; F304-H315 AromaticContact CZ-CD2 3.85Å; F304-P324 CarbonylContact O-C 3.54Å; F304-P324 WeakPolarHBondContact O-CA 3.48Å; F304-L325 PolarHBondContact O-N 2.9Å
305	Y	87.8	Confident	84.7	Confident	9 Å²	9	59.4 Å²	59.4	4%	0.035	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	159.2	168.4	68	-79.8	0	0	0	110	D307 P313 V314 G316 A317 K320 K322	Y305-D307 HydrophobicContact CE2-CB 4.18Å; Y305-D307 PolarHBondContact O-N 2.84Å; Y305-P313 WeakPolarHBondContact O-CA 3.44Å; Y305-V314 VanDerWaalsContact CD1-O 3.27Å; Y305-V314 WeakPolarHBondContact CD1-O 3.49Å; Y305-V314 HydrophobicContact CE1-CB 4.18Å; Y305-V314 HydrophobicContact CE1-CG1 4.4Å; Y305-V314 WeakPolarHBondContact CE1-O 3.49Å; Y305-V314 PolarHBondContact N-O 3.26Å; Y305-V314 PolarHBondContact O-N 3.1Å; Y305-G316 WeakPolarHBondContact CE1-O 3.33Å; Y305-A317 VanDerWaalsContact CD1-CA 3.49Å; Y305-A317 HydrophobicContact CD1-CB 3.84Å; Y305-A317 HydrophobicContact CG-CB 4.29Å; Y305-K320 HydrophobicContact CE1-CD 4.03Å; Y305-K320 WeakPolarHBondContact OH-CD 3.36Å; Y305-K320 WeakPolarHBondContact OH-CE 3.39Å; Y305-K320 PolarHBondContact OH-NZ 3.08Å; Y305-K322 HydrophobicContact CD1-CD 4.32Å; Y305-K322 HydrophobicContact CD2-CD 3.3Å; Y305-K322 HydrophobicContact CE2-CD 3.69Å; Y305-K322 HydrophobicContact CG-CB 4.29Å; Y305-K322 HydrophobicContact CG-CD 3.68Å
306	L	85.1	Confident	84.7	Confident	64 Å²	64	53.3 Å²	53.3	34%	0.335	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	117.4	173.8	-163.6	72.4	0	0	0	109.7	I291 A308 K311 L325	I291-L306 HydrophobicContact CD1-CD1 3.97Å; L306-A308 PolarHBondContact O-N 3.36Å; L306-K311 WeakPolarHBondContact CD1-O 3.33Å; L306-L325 HydrophobicContact CB-CD1 3.99Å
307	D	83.7	Confident	84.5	Confident	39 Å²	39	53.2 Å²	53.2	21%	0.209	28%	0.284	C	S	.	.			trans	-70.3	130.3	173.8	171.7	47.3	0	0	0	110.7	Y305 K309 S310 K311 Q312 V314	Y305-D307 HydrophobicContact CE2-CB 4.18Å; Y305-D307 PolarHBondContact O-N 2.84Å; D307-K309 PolarHBondContact O-N 2.82Å; D307-S310 WeakPolarHBondContact CB-OG 3.25Å; D307-S310 WeakPolarHBondContact OD2-CB 3.26Å; D307-S310 PolarHBondContact OD2-N 2.71Å; D307-S310 PolarHBondContact OD2-OG 2.99Å; D307-K311 WeakPolarHBondContact O-CA 3.32Å; D307-K311 PolarHBondContact O-N 3.33Å; D307-Q312 PolarHBondContact N-O 3.1Å; D307-V314 HydrophobicContact CB-CG2 3.73Å
308	A	79.9	Confident	84.2	Confident	90 Å²	90	56.6 Å²	56.6	74%	0.744	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-26.6	-173.9	0	0	0	0	0	112.7	L306	L306-A308 PolarHBondContact O-N 3.36Å
309	K	82	Confident	84.1	Confident	198 Å²	198	60 Å²	60	86%	0.861	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-53.8	-179.4	-65.4	-177	-179.8	-179.5	0	111.8	D307	D307-K309 PolarHBondContact O-N 2.82Å
310	S	79.4	Confident	84	Confident	56 Å²	56	65.6 Å²	65.6	39%	0.392	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-19.2	-176.6	59.9	0	0	0	0	113.7	D307 Q312	D307-S310 WeakPolarHBondContact CB-OG 3.25Å; D307-S310 WeakPolarHBondContact OD2-CB 3.26Å; D307-S310 PolarHBondContact OD2-N 2.71Å; D307-S310 PolarHBondContact OD2-OG 2.99Å; S310-Q312 PolarHBondContact O-N 3.18Å; S310-Q312 VanDerWaalsContact O-N 3.13Å; S310-Q312 PolarHBondContact OG-N 2.98Å
311	K	79.8	Confident	83.7	Confident	130 Å²	130	69.1 Å²	69.1	57%	0.565	38%	0.38	S	S	*	.			trans	51.4	27.5	-168.7	-59.1	-175.3	178.7	-179	0	112.7	I291 L306 D307	I291-K311 WeakPolarHBondContact CD1-O 3.23Å; L306-K311 WeakPolarHBondContact CD1-O 3.33Å; D307-K311 WeakPolarHBondContact O-CA 3.32Å; D307-K311 PolarHBondContact O-N 3.33Å
312	Q	82.1	Confident	83.6	Confident	65 Å²	65	71.3 Å²	71.3	30%	0.304	39%	0.391	S	S	.	.	S	Bend	trans	-108.3	150.8	175	-64.3	-59.7	-48.1	0	0	109.3	C290 D307 S310 V314	C290-Q312 PolarHBondContact O-NE2 2.97Å; D307-Q312 PolarHBondContact N-O 3.1Å; S310-Q312 PolarHBondContact O-N 3.18Å; S310-Q312 VanDerWaalsContact O-N 3.13Å; S310-Q312 PolarHBondContact OG-N 2.98Å; Q312-V314 PolarHBondContact O-N 3.42Å
313	P	83.1	Confident	83.7	Confident	29 Å²	29	73.3 Å²	73.3	19%	0.188	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	128.8	171.5	26.4	-31.3	0	0	0	110.1	A299 Y305	A299-P313 HydrophobicContact CB-CB 3.38Å; A299-P313 HydrophobicContact CB-CG 3.69Å; Y305-P313 WeakPolarHBondContact O-CA 3.44Å
314	V	85.9	Confident	83.9	Confident	52 Å²	52	71.8 Å²	71.8	32%	0.315	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	140	177	-174.3	0	0	0	0	108.5	F304 Y305 D307 Q312	F304-V314 WeakPolarHBondContact CA-O 3.45Å; Y305-V314 VanDerWaalsContact CD1-O 3.27Å; Y305-V314 WeakPolarHBondContact CD1-O 3.49Å; Y305-V314 HydrophobicContact CE1-CB 4.18Å; Y305-V314 HydrophobicContact CE1-CG1 4.4Å; Y305-V314 WeakPolarHBondContact CE1-O 3.49Å; Y305-V314 PolarHBondContact N-O 3.26Å; Y305-V314 PolarHBondContact O-N 3.1Å; D307-V314 HydrophobicContact CB-CG2 3.73Å; Q312-V314 PolarHBondContact O-N 3.42Å
315	H	87.3	Confident	84	Confident	113 Å²	113	69 Å²	69	52%	0.523	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	156.2	176.2	-165.1	-79.2	0	0	0	111.6	D303 F304	D303-H315 CarbonylContact O-C 3.55Å; D303-H315 WeakPolarHBondContact O-CA 3.27Å; F304-H315 HydrophobicContact CD1-CB 4.15Å; F304-H315 HydrophobicContact CE1-CB 3.95Å; F304-H315 AromaticContact CE1-CD2 3.96Å; F304-H315 AromaticContact CZ-CD2 3.85Å
316	G	83.1	Confident	84.2	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.01	37%	0.373	C	S	.	.			trans	95.6	45.2	175.5	0	0	0	0	0	112.2	D303 Y305 K320	D303-G316 PolarHBondContact O-N 2.74Å; D303-G316 VanDerWaalsContact OD2-CA 3.27Å; D303-G316 WeakPolarHBondContact OD2-CA 3.41Å; Y305-G316 WeakPolarHBondContact CE1-O 3.33Å; G316-K320 WeakPolarHBondContact O-CG 3.21Å; G316-K320 PolarHBondContact O-N 3.47Å
317	A	81	Confident	84.6	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-48.7	174.8	0	0	0	0	0	109.8	D303 Y305 K320 G321 K322	D303-A317 PolarHBondContact O-N 2.87Å; D303-A317 WeakPolarHBondContact OD1-CB 3.36Å; D303-A317 PolarHBondContact OD1-N 2.8Å; D303-A317 PolarHBondContact OD2-N 3.38Å; D303-A317 VanDerWaalsContact OD2-N 3.07Å; Y305-A317 VanDerWaalsContact CD1-CA 3.49Å; Y305-A317 HydrophobicContact CD1-CB 3.84Å; Y305-A317 HydrophobicContact CG-CB 4.29Å; A317-K320 CarbonylContact O-C 3.56Å; A317-K320 PolarHBondContact O-N 3.24Å; A317-G321 PolarHBondContact O-N 3.4Å; A317-G321 VanDerWaalsContact O-N 3.16Å; A317-K322 CarbonylContact C-O 3.43Å; A317-K322 HydrophobicContact CB-CB 4.41Å; A317-K322 PolarHBondContact O-N 3.41Å
318	S	80.2	Confident	84.8	Confident	86 Å²	86	65.4 Å²	65.4	60%	0.601	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-46.6	-180	-61.3	0	0	0	0	112.1	D303 K320 G321	D303-S318 VanDerWaalsContact OD1-CB 3.31Å; D303-S318 WeakPolarHBondContact OD1-CB 3.46Å; D303-S318 PolarHBondContact OD1-N 3.05Å; D303-S318 PolarHBondContact OD1-OG 3.34Å; D303-S318 PolarHBondContact OD2-N 3.32Å; S318-K320 PolarHBondContact O-N 3.01Å; S318-G321 PolarHBondContact O-N 3.48Å; S318-G321 VanDerWaalsContact O-N 3.09Å
319	E	83	Confident	85.2	Confident	169 Å²	169	62.1 Å²	62.1	79%	0.79	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-32.9	177.6	-67.6	-179.4	174.8	0	0	113
320	K	84.1	Confident	85.7	Confident	124 Å²	124	52.7 Å²	52.7	54%	0.539	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	7	-178.7	-64.1	-173.1	-173.5	-171.2	0	113.4	Y305 G316 A317 S318 K322	Y305-K320 HydrophobicContact CE1-CD 4.03Å; Y305-K320 WeakPolarHBondContact OH-CD 3.36Å; Y305-K320 WeakPolarHBondContact OH-CE 3.39Å; Y305-K320 PolarHBondContact OH-NZ 3.08Å; G316-K320 WeakPolarHBondContact O-CG 3.21Å; G316-K320 PolarHBondContact O-N 3.47Å; A317-K320 CarbonylContact O-C 3.56Å; A317-K320 PolarHBondContact O-N 3.24Å; S318-K320 PolarHBondContact O-N 3.01Å; K320-K322 HydrophobicContact CB-CD 4.45Å; K320-K322 HydrophobicContact CB-CG 4.25Å; K320-K322 PolarHBondContact O-N 3.33Å
321	G	81.9	Confident	86.3	Confident	74 Å²	74	50 Å²	50	76%	0.763	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.5	27.7	-176.3	0	0	0	0	0	113.5	A317 S318	A317-G321 PolarHBondContact O-N 3.4Å; A317-G321 VanDerWaalsContact O-N 3.16Å; S318-G321 PolarHBondContact O-N 3.48Å; S318-G321 VanDerWaalsContact O-N 3.09Å
322	K	86.8	Confident	87	Confident	85 Å²	85	49.4 Å²	49.4	37%	0.37	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-100.4	150.7	177.4	-67.9	-174.3	176.2	-174.3	0	110.2	Y305 A317 K320	Y305-K322 HydrophobicContact CD1-CD 4.32Å; Y305-K322 HydrophobicContact CD2-CD 3.3Å; Y305-K322 HydrophobicContact CE2-CD 3.69Å; Y305-K322 HydrophobicContact CG-CB 4.29Å; Y305-K322 HydrophobicContact CG-CD 3.68Å; A317-K322 CarbonylContact C-O 3.43Å; A317-K322 HydrophobicContact CB-CB 4.41Å; A317-K322 PolarHBondContact O-N 3.41Å; K320-K322 HydrophobicContact CB-CD 4.45Å; K320-K322 HydrophobicContact CB-CG 4.25Å; K320-K322 PolarHBondContact O-N 3.33Å
323	E	86.8	Confident	87.5	Confident	62 Å²	62	47.9 Å²	47.9	29%	0.29	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-71.8	141.1	173.9	-69.6	178.4	-168.2	0	0	111.3	A327 R332	E323-A327 HydrophobicContact CB-CB 4.49Å; E323-R332 IonicContact OE1-NH2 2.75Å; E323-R332 PolarHBondContact OE1-NH2 3.25Å; E323-R332 IonicContact OE2-CZ 3.74Å; E323-R332 IonicContact OE2-NE 3.98Å; E323-R332 IonicContact OE2-NH2 3.81Å; E323-R332 PolarHBondContact OE2-NH2 2.92Å
324	P	91.1	Very high	87.9	Confident	4 Å²	4	46.5 Å²	46.5	3%	0.026	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-55.3	154.3	170.2	-27.2	36.3	0	0	0	112.9	L199 Y202 F304 F326 A327 S328	L199-P324 HydrophobicContact CD1-CG 4.34Å; Y202-P324 HydrophobicContact CD1-CB 4.21Å; Y202-P324 HydrophobicContact CD1-CG 3.86Å; Y202-P324 HydrophobicContact CE1-CB 3.88Å; Y202-P324 HydrophobicContact CE1-CG 3.63Å; F304-P324 CarbonylContact O-C 3.54Å; F304-P324 WeakPolarHBondContact O-CA 3.48Å; P324-F326 VanDerWaalsContact C-N 3.28Å; P324-F326 PolarHBondContact O-N 3.25Å; P324-A327 PolarHBondContact O-N 3.15Å; P324-A327 VanDerWaalsContact O-N 3.14Å; P324-S328 PolarHBondContact O-N 3.27Å; P324-S328 PolarHBondContact O-OG 2.89Å
325	L	90.6	Very high	88.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.6	-39.2	-176.8	-160.5	66	0	0	0	111.5	L296 A299 L300 F304 L306 S328 M329	L296-L325 HydrophobicContact CD1-CD2 3.95Å; A299-L325 HydrophobicContact CB-CD2 4.44Å; L300-L325 HydrophobicContact CD2-CD2 4.03Å; L300-L325 HydrophobicContact CD2-CG 4.19Å; L300-L325 HydrophobicContact CG-CD2 4.49Å; F304-L325 PolarHBondContact O-N 2.9Å; L306-L325 HydrophobicContact CB-CD1 3.99Å; L325-S328 WeakPolarHBondContact CA-OG 3.47Å; L325-S328 PolarHBondContact O-OG 2.87Å; L325-M329 HydrophobicContact CD1-CG 3.93Å; L325-M329 HydrophobicContact CD1-SD 3.32Å; L325-M329 WeakPolarHBondContact CD1-SD 3.35Å; L325-M329 HydrophobicContact CD2-SD 4.24Å; L325-M329 HydrophobicContact CG-CG 4.27Å; L325-M329 HydrophobicContact CG-SD 3.65Å; L325-M329 VanDerWaalsContact O-CB 3.29Å; L325-M329 WeakPolarHBondContact O-CB 3.41Å; L325-M329 PolarHBondContact O-N 3.36Å
326	F	92	Very high	88.3	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-59.5	-49.6	174.2	-160.9	-97.4	0	0	0	112.4	Y202 L205 F266 F275 L277 L300 W301 P324 S328 V330 L331	Y202-F326 HydrophobicContact CD2-CB 3.76Å; Y202-F326 AromaticContact CD2-CD1 3.62Å; Y202-F326 HydrophobicContact CD2-CD1 3.62Å; Y202-F326 HydrophobicContact CD2-CG 4Å; Y202-F326 HydrophobicContact CE2-CB 3.73Å; Y202-F326 HydrophobicContact CE2-CD1 4.22Å; Y202-F326 HydrophobicContact CE2-CG 4.17Å; L205-F326 HydrophobicContact CD1-CE1 3.8Å; F266-F326 HydrophobicContact CD1-CZ 4.06Å; F266-F326 HydrophobicContact CD2-CE2 4.27Å; F266-F326 HydrophobicContact CD2-CZ 4.03Å; F266-F326 AromaticContact CE1-CZ 3.95Å; F266-F326 HydrophobicContact CE1-CZ 3.95Å; F266-F326 AromaticContact CE2-CE2 3.95Å; F266-F326 HydrophobicContact CE2-CE2 3.95Å; F266-F326 AromaticContact CE2-CZ 3.93Å; F266-F326 HydrophobicContact CE2-CZ 3.93Å; F266-F326 HydrophobicContact CG-CZ 4.1Å; F266-F326 HydrophobicContact CZ-CE2 4.17Å; F266-F326 AromaticContact CZ-CZ 3.9Å; F266-F326 HydrophobicContact CZ-CZ 3.9Å; F275-F326 HydrophobicContact CE2-CE2 4.12Å; F275-F326 HydrophobicContact CE2-CZ 4.15Å; F275-F326 HydrophobicContact CZ-CZ 4.17Å; L277-F326 HydrophobicContact CD2-CD2 3.96Å; L277-F326 HydrophobicContact CD2-CE2 3.66Å; L300-F326 VanDerWaalsContact O-CB 3.23Å; L300-F326 WeakPolarHBondContact O-CB 3.42Å; L300-F326 PolarHBondContact O-N 3.39Å; W301-F326 HydrophobicContact CE3-CD1 4.49Å; W301-F326 AromaticContact CE3-CD2 3.78Å; W301-F326 HydrophobicContact CE3-CD2 3.78Å; W301-F326 AromaticContact CE3-CE2 3.98Å; W301-F326 HydrophobicContact CE3-CE2 3.98Å; W301-F326 HydrophobicContact CE3-CG 4.05Å; W301-F326 HydrophobicContact CE3-CZ 4.39Å; W301-F326 HydrophobicContact CZ3-CD1 4.1Å; W301-F326 HydrophobicContact CZ3-CD2 4.09Å; W301-F326 AromaticContact CZ3-CE1 3.99Å; W301-F326 HydrophobicContact CZ3-CE1 3.99Å; W301-F326 HydrophobicContact CZ3-CE2 4.02Å; W301-F326 HydrophobicContact CZ3-CG 4.13Å; W301-F326 AromaticContact CZ3-CZ 3.96Å; W301-F326 HydrophobicContact CZ3-CZ 3.96Å; P324-F326 VanDerWaalsContact C-N 3.28Å; P324-F326 PolarHBondContact O-N 3.25Å; F326-S328 PolarHBondContact O-N 2.8Å; F326-V330 HydrophobicContact CD1-CB 4.48Å; F326-V330 HydrophobicContact CD2-CB 4.28Å; F326-V330 HydrophobicContact CD2-CG2 3.81Å; F326-V330 HydrophobicContact CE1-CG1 4.48Å; F326-V330 HydrophobicContact CE2-CB 4.3Å; F326-V330 HydrophobicContact CE2-CG1 4.21Å; F326-V330 HydrophobicContact CE2-CG2 4.02Å; F326-V330 HydrophobicContact CG-CB 4.38Å; F326-V330 HydrophobicContact CG-CG2 4.25Å; F326-V330 HydrophobicContact CZ-CB 4.44Å; F326-V330 HydrophobicContact CZ-CG1 4.12Å; F326-V330 WeakPolarHBondContact O-CA 3.27Å; F326-V330 WeakPolarHBondContact O-CB 3.31Å; F326-V330 PolarHBondContact O-N 3.14Å; F326-L331 HydrophobicContact CD1-CD1 3.74Å; F326-L331 HydrophobicContact CD1-CD2 4.35Å; F326-L331 HydrophobicContact CD1-CG 3.71Å; F326-L331 HydrophobicContact CE1-CD1 3.86Å; F326-L331 HydrophobicContact CE1-CD2 3.75Å; F326-L331 HydrophobicContact CE1-CG 3.64Å; F326-L331 PolarHBondContact O-N 2.62Å; F326-L331 VanDerWaalsContact O-N 3.09Å
327	A	91.9	Very high	88.7	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.23	C	C	.	.	I	π-helix	trans	-62.9	-46.2	-178.8	0	0	0	0	0	111.2	Y202 E323 P324 R332	Y202-A327 HydrophobicContact CG-CB 4.44Å; E323-A327 HydrophobicContact CB-CB 4.49Å; P324-A327 PolarHBondContact O-N 3.15Å; P324-A327 VanDerWaalsContact O-N 3.14Å; A327-R332 WeakPolarHBondContact O-CB 3.44Å; A327-R332 PolarHBondContact O-N 2.92Å
328	S	89.9	Confident	89.2	Confident	36 Å²	36	41.6 Å²	41.6	25%	0.252	23%	0.23	S	C	.	.	I	π-helix	trans	-74.7	-39.2	-175.4	59.4	0	0	0	0	114	P324 L325 F326 R332	P324-S328 PolarHBondContact O-N 3.27Å; P324-S328 PolarHBondContact O-OG 2.89Å; L325-S328 WeakPolarHBondContact CA-OG 3.47Å; L325-S328 PolarHBondContact O-OG 2.87Å; F326-S328 PolarHBondContact O-N 2.8Å; S328-R332 VanDerWaalsContact O-CB 3.31Å; S328-R332 WeakPolarHBondContact O-CB 3.47Å
329	M	87.7	Confident	89.6	Confident	20 Å²	20	39.8 Å²	39.8	10%	0.099	21%	0.213	C	C	.	.	I	π-helix	trans	-98.1	-32.7	-175.8	-65.1	-173.8	62.5	0	0	114.1	W284 L288 L325 N333	W284-M329 HydrophobicContact CB-CE 4.4Å; W284-M329 HydrophobicContact CD2-CE 3.62Å; W284-M329 HydrophobicContact CE3-CE 3.34Å; W284-M329 HydrophobicContact CG-CE 4.09Å; W284-M329 HydrophobicContact CZ3-CE 3.82Å; L288-M329 HydrophobicContact CD1-CE 3.67Å; L325-M329 HydrophobicContact CD1-CG 3.93Å; L325-M329 HydrophobicContact CD1-SD 3.32Å; L325-M329 WeakPolarHBondContact CD1-SD 3.35Å; L325-M329 HydrophobicContact CD2-SD 4.24Å; L325-M329 HydrophobicContact CG-CG 4.27Å; L325-M329 HydrophobicContact CG-SD 3.65Å; L325-M329 VanDerWaalsContact O-CB 3.29Å; L325-M329 WeakPolarHBondContact O-CB 3.41Å; L325-M329 PolarHBondContact O-N 3.36Å; M329-N333 PolarHBondContact O-ND2 2.96Å
330	V	91.7	Very high	89.8	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.176	C	C	.	.	I	π-helix	trans	-97.6	-68.2	-175.6	-173.9	0	0	0	0	109.7	F275 F280 F326 R332 N333 L334	F275-V330 HydrophobicContact CE1-CG1 4.02Å; F275-V330 HydrophobicContact CE2-CG1 3.69Å; F275-V330 HydrophobicContact CZ-CG1 3.25Å; F280-V330 HydrophobicContact CD1-CG2 3.73Å; F280-V330 HydrophobicContact CD2-CG1 4.39Å; F280-V330 HydrophobicContact CD2-CG2 4.47Å; F280-V330 HydrophobicContact CE1-CB 4.23Å; F280-V330 HydrophobicContact CE1-CG2 3.32Å; F280-V330 HydrophobicContact CE2-CB 4.35Å; F280-V330 HydrophobicContact CE2-CG1 3.99Å; F280-V330 HydrophobicContact CE2-CG2 4.14Å; F280-V330 HydrophobicContact CG-CG2 4.28Å; F280-V330 HydrophobicContact CZ-CB 3.93Å; F280-V330 HydrophobicContact CZ-CG1 4.1Å; F280-V330 HydrophobicContact CZ-CG2 3.53Å; F326-V330 HydrophobicContact CD1-CB 4.48Å; F326-V330 HydrophobicContact CD2-CB 4.28Å; F326-V330 HydrophobicContact CD2-CG2 3.81Å; F326-V330 HydrophobicContact CE1-CG1 4.48Å; F326-V330 HydrophobicContact CE2-CB 4.3Å; F326-V330 HydrophobicContact CE2-CG1 4.21Å; F326-V330 HydrophobicContact CE2-CG2 4.02Å; F326-V330 HydrophobicContact CG-CB 4.38Å; F326-V330 HydrophobicContact CG-CG2 4.25Å; F326-V330 HydrophobicContact CZ-CB 4.44Å; F326-V330 HydrophobicContact CZ-CG1 4.12Å; F326-V330 WeakPolarHBondContact O-CA 3.27Å; F326-V330 WeakPolarHBondContact O-CB 3.31Å; F326-V330 PolarHBondContact O-N 3.14Å; V330-R332 PolarHBondContact O-N 2.73Å; V330-N333 PolarHBondContact O-N 3.38Å; V330-N333 VanDerWaalsContact O-N 3.14Å; V330-L334 HydrophobicContact CG1-CD1 4.26Å; V330-L334 PolarHBondContact O-N 2.87Å; V330-L334 VanDerWaalsContact O-N 3.15Å
331	L	93.4	Very high	89.8	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.005	16%	0.155	C	C	.	.	I	π-helix	trans	-65.7	-37.2	-170.2	-64.2	177.2	0	0	0	112.3	F191 P198 A201 L205 F326 N333 L334 A335	F191-L331 HydrophobicContact CZ-CB 4.15Å; F191-L331 HydrophobicContact CZ-CD2 3.95Å; P198-L331 HydrophobicContact CB-CB 3.97Å; P198-L331 VanDerWaalsContact O-CD1 3.25Å; P198-L331 WeakPolarHBondContact O-CD1 3.01Å; A201-L331 HydrophobicContact CB-CD1 4.08Å; L205-L331 HydrophobicContact CD1-CD1 4.23Å; L205-L331 HydrophobicContact CD1-CD2 4.1Å; F326-L331 HydrophobicContact CD1-CD1 3.74Å; F326-L331 HydrophobicContact CD1-CD2 4.35Å; F326-L331 HydrophobicContact CD1-CG 3.71Å; F326-L331 HydrophobicContact CE1-CD1 3.86Å; F326-L331 HydrophobicContact CE1-CD2 3.75Å; F326-L331 HydrophobicContact CE1-CG 3.64Å; F326-L331 PolarHBondContact O-N 2.62Å; F326-L331 VanDerWaalsContact O-N 3.09Å; L331-N333 VanDerWaalsContact C-N 3.31Å; L331-N333 PolarHBondContact O-N 2.9Å; L331-L334 HydrophobicContact CD2-CD1 4.3Å; L331-L334 PolarHBondContact O-N 2.91Å; L331-A335 VanDerWaalsContact O-CB 3.3Å; L331-A335 WeakPolarHBondContact O-CB 3.39Å; L331-A335 PolarHBondContact O-N 3.31Å
332	R	93.4	Very high	90	Very high	116 Å²	116	27 Å²	27	44%	0.438	14%	0.137	S	C	.	.	H	α-helix	trans	-59	-40.2	175.1	-174.5	179.2	-70	-124.1	-2	112.7	P198 E323 A327 S328 V330 S336	P198-R332 HydrophobicContact CB-CB 4.5Å; P198-R332 HydrophobicContact CG-CB 4.31Å; E323-R332 IonicContact OE1-NH2 2.75Å; E323-R332 PolarHBondContact OE1-NH2 3.25Å; E323-R332 IonicContact OE2-CZ 3.74Å; E323-R332 IonicContact OE2-NE 3.98Å; E323-R332 IonicContact OE2-NH2 3.81Å; E323-R332 PolarHBondContact OE2-NH2 2.92Å; A327-R332 WeakPolarHBondContact O-CB 3.44Å; A327-R332 PolarHBondContact O-N 2.92Å; S328-R332 VanDerWaalsContact O-CB 3.31Å; S328-R332 WeakPolarHBondContact O-CB 3.47Å; V330-R332 PolarHBondContact O-N 2.73Å; R332-S336 WeakPolarHBondContact O-CB 3.24Å; R332-S336 PolarHBondContact O-N 3.45Å; R332-S336 PolarHBondContact O-OG 3.46Å
333	N	91.6	Very high	89.7	Confident	33 Å²	33	27.8 Å²	27.8	18%	0.176	14%	0.144	C	C	.	.	H	α-helix	trans	-70.6	-41.5	178	-76.1	-38.6	0	0	0	111.3	W284 M329 V330 L331 S336 V337 W382	W284-N333 VanDerWaalsContact CZ2-ND2 3.27Å; W284-N333 WeakPolarHBondContact CZ2-ND2 3.4Å; M329-N333 PolarHBondContact O-ND2 2.96Å; V330-N333 PolarHBondContact O-N 3.38Å; V330-N333 VanDerWaalsContact O-N 3.14Å; L331-N333 VanDerWaalsContact C-N 3.31Å; L331-N333 PolarHBondContact O-N 2.9Å; N333-S336 PolarHBondContact O-N 2.63Å; N333-V337 WeakPolarHBondContact O-CG2 3.25Å; N333-V337 PolarHBondContact O-N 3.34Å; N333-V337 VanDerWaalsContact O-N 3.1Å; N333-W382 HydrophobicContact CB-CH2 4.24Å
334	L	92.3	Very high	89.5	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-60.7	-49.9	174	-64.2	174.4	0	0	0	111.5	F191 W273 F275 V330 L331 S336 V337 Y338 F379 W382 I383	F191-L334 HydrophobicContact CE2-CB 4.05Å; F191-L334 HydrophobicContact CZ-CB 4.44Å; W273-L334 HydrophobicContact CH2-CD1 3.72Å; W273-L334 HydrophobicContact CZ2-CD1 4.22Å; W273-L334 HydrophobicContact CZ3-CD1 4.11Å; F275-L334 HydrophobicContact CE1-CD1 3.98Å; F275-L334 HydrophobicContact CZ-CD1 4.39Å; V330-L334 HydrophobicContact CG1-CD1 4.26Å; V330-L334 PolarHBondContact O-N 2.87Å; V330-L334 VanDerWaalsContact O-N 3.15Å; L331-L334 HydrophobicContact CD2-CD1 4.3Å; L331-L334 PolarHBondContact O-N 2.91Å; L334-S336 VanDerWaalsContact C-N 3.28Å; L334-S336 PolarHBondContact O-N 3.41Å; L334-V337 PolarHBondContact O-N 2.85Å; L334-V337 VanDerWaalsContact O-N 3.1Å; L334-Y338 WeakPolarHBondContact O-CD2 3.46Å; L334-Y338 PolarHBondContact O-N 2.85Å; L334-F379 HydrophobicContact CD2-CE1 3.69Å; L334-F379 HydrophobicContact CD2-CZ 4.18Å; L334-W382 HydrophobicContact CD2-CH2 4.43Å; L334-W382 HydrophobicContact CD2-CZ3 4.03Å; L334-I383 HydrophobicContact CD2-CD1 4.22Å
335	A	92.1	Very high	88.9	Confident	22 Å²	22	30.1 Å²	30.1	18%	0.182	18%	0.176	C	C	.	.	H	α-helix	trans	-58.2	-40.1	177.9	0	0	0	0	0	111.8	F191 P198 L331 V337 Y338 D339	F191-A335 HydrophobicContact CD1-CB 3.8Å; F191-A335 HydrophobicContact CE1-CB 3.79Å; F191-A335 HydrophobicContact CG-CB 4.34Å; F191-A335 HydrophobicContact CZ-CB 4.3Å; P198-A335 HydrophobicContact CG-CB 4.37Å; L331-A335 VanDerWaalsContact O-CB 3.3Å; L331-A335 WeakPolarHBondContact O-CB 3.39Å; L331-A335 PolarHBondContact O-N 3.31Å; A335-V337 VanDerWaalsContact C-N 3.34Å; A335-V337 PolarHBondContact O-N 3.23Å; A335-Y338 PolarHBondContact O-N 2.83Å; A335-D339 VanDerWaalsContact O-CB 3.3Å; A335-D339 WeakPolarHBondContact O-CB 3.44Å; A335-D339 PolarHBondContact O-N 3.25Å
336	S	90.7	Very high	88.5	Confident	41 Å²	41	33.5 Å²	33.5	29%	0.287	19%	0.194	S	C	.	.	H	α-helix	trans	-65.2	-36.2	177.1	-59.5	0	0	0	0	112.6	R332 N333 L334 A340	R332-S336 WeakPolarHBondContact O-CB 3.24Å; R332-S336 PolarHBondContact O-N 3.45Å; R332-S336 PolarHBondContact O-OG 3.46Å; N333-S336 PolarHBondContact O-N 2.63Å; L334-S336 VanDerWaalsContact C-N 3.28Å; L334-S336 PolarHBondContact O-N 3.41Å; S336-A340 WeakPolarHBondContact O-CB 3.17Å; S336-A340 PolarHBondContact O-N 2.64Å
337	V	90.2	Very high	87.9	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-68.3	-46.6	174.7	174	0	0	0	0	110.4	N333 L334 A335 D339 A340 F341 I353 L357 F379 W382	N333-V337 WeakPolarHBondContact O-CG2 3.25Å; N333-V337 PolarHBondContact O-N 3.34Å; N333-V337 VanDerWaalsContact O-N 3.1Å; L334-V337 PolarHBondContact O-N 2.85Å; L334-V337 VanDerWaalsContact O-N 3.1Å; A335-V337 VanDerWaalsContact C-N 3.34Å; A335-V337 PolarHBondContact O-N 3.23Å; V337-D339 VanDerWaalsContact C-N 3.31Å; V337-D339 PolarHBondContact O-N 3.1Å; V337-A340 PolarHBondContact O-N 2.89Å; V337-F341 HydrophobicContact CG1-CD2 3.86Å; V337-F341 HydrophobicContact CG1-CE2 4.21Å; V337-F341 WeakPolarHBondContact O-CD2 3.37Å; V337-F341 PolarHBondContact O-N 2.87Å; V337-I353 HydrophobicContact CG2-CG2 3.93Å; V337-L357 HydrophobicContact CG2-CD1 3.91Å; V337-F379 HydrophobicContact CB-CZ 4.04Å; V337-F379 HydrophobicContact CG1-CE1 4.29Å; V337-F379 HydrophobicContact CG1-CE2 3.86Å; V337-F379 HydrophobicContact CG1-CZ 3.59Å; V337-W382 HydrophobicContact CG2-CZ3 4.42Å
338	Y	91	Very high	87.4	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-59.9	-42.6	174.9	-77.6	-68.6	0	0	0	112.2	D188 F191 T192 D271 W273 L334 A335 L342 I343 L375 F379	D188-Y338 HydrophobicContact CB-CE1 3.89Å; D188-Y338 HydrophobicContact CB-CE2 4.39Å; D188-Y338 VanDerWaalsContact CB-OH 3.25Å; D188-Y338 WeakPolarHBondContact CB-OH 3.23Å; F191-Y338 HydrophobicContact CB-CD2 4.35Å; F191-Y338 AromaticContact CD2-CD2 3.7Å; F191-Y338 HydrophobicContact CD2-CD2 3.7Å; F191-Y338 AromaticContact CD2-CE2 3.91Å; F191-Y338 HydrophobicContact CD2-CE2 3.91Å; F191-Y338 HydrophobicContact CE2-CD2 4.43Å; F191-Y338 HydrophobicContact CE2-CE2 4.45Å; F191-Y338 HydrophobicContact CG-CD2 4.35Å; T192-Y338 HydrophobicContact CG2-CD1 3.95Å; T192-Y338 HydrophobicContact CG2-CE1 4.48Å; T192-Y338 HydrophobicContact CG2-CG 4.42Å; D271-Y338 PolarHBondContact OD2-OH 3.45Å; W273-Y338 AromaticContact NE1-CZ 3.96Å; W273-Y338 PolarHBondContact NE1-OH 3.15Å; L334-Y338 WeakPolarHBondContact O-CD2 3.46Å; L334-Y338 PolarHBondContact O-N 2.85Å; A335-Y338 PolarHBondContact O-N 2.83Å; Y338-L342 WeakPolarHBondContact O-CA 3.29Å; Y338-L342 WeakPolarHBondContact O-CB 3.15Å; Y338-L342 PolarHBondContact O-N 3.45Å; Y338-I343 PolarHBondContact O-N 3.4Å; Y338-L375 HydrophobicContact CD1-CD1 3.64Å; Y338-L375 HydrophobicContact CE1-CD1 3.75Å; Y338-L375 HydrophobicContact CE1-CD2 3.98Å; Y338-L375 HydrophobicContact CE1-CG 4.48Å; Y338-F379 HydrophobicContact CE1-CE2 4.26Å; Y338-F379 HydrophobicContact CE2-CE2 4.3Å; Y338-F379 HydrophobicContact CE2-CZ 4.16Å; Y338-F379 AromaticContact CZ-CE2 3.94Å
339	D	89.8	Confident	87.2	Confident	47 Å²	47	44.4 Å²	44.4	25%	0.251	26%	0.256	S	S	.	.	I	π-helix	trans	-62.4	-45.8	177.6	-179.4	46.4	0	0	0	111.6	A335 V337 I343 S344 K349	A335-D339 VanDerWaalsContact O-CB 3.3Å; A335-D339 WeakPolarHBondContact O-CB 3.44Å; A335-D339 PolarHBondContact O-N 3.25Å; V337-D339 VanDerWaalsContact C-N 3.31Å; V337-D339 PolarHBondContact O-N 3.1Å; D339-I343 HydrophobicContact CB-CD1 4.47Å; D339-I343 PolarHBondContact O-N 3.45Å; D339-S344 WeakPolarHBondContact O-CB 3.44Å; D339-S344 PolarHBondContact O-N 2.8Å; D339-S344 PolarHBondContact O-OG 3.23Å; D339-K349 IonicContact OD2-NZ 3.64Å; D339-K349 PolarHBondContact OD2-NZ 3.13Å
340	A	86.6	Confident	86.9	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.008	25%	0.253	C	S	.	.	I	π-helix	trans	-67.6	-42	-179.2	0	0	0	0	0	113.6	S336 V337 S344 G345 D346 K349 A350 I353	S336-A340 WeakPolarHBondContact O-CB 3.17Å; S336-A340 PolarHBondContact O-N 2.64Å; V337-A340 PolarHBondContact O-N 2.89Å; A340-S344 WeakPolarHBondContact CA-OG 3.36Å; A340-G345 CarbonylContact O-C 3.5Å; A340-G345 WeakPolarHBondContact O-CA 3.33Å; A340-G345 PolarHBondContact O-N 2.92Å; A340-D346 PolarHBondContact O-N 3.14Å; A340-K349 HydrophobicContact CB-CG 4.41Å; A340-A350 HydrophobicContact CB-CB 4.06Å; A340-I353 HydrophobicContact CB-CD1 3.74Å
341	F	85	Confident	86.5	Confident	26 Å²	26	47.9 Å²	47.9	11%	0.114	27%	0.273	C	S	.	.	I	π-helix	trans	-90.9	-32.5	-173.2	-78.4	-89.9	0	0	0	114.5	V337 A350 L354 K374 L375 V378	V337-F341 HydrophobicContact CG1-CD2 3.86Å; V337-F341 HydrophobicContact CG1-CE2 4.21Å; V337-F341 WeakPolarHBondContact O-CD2 3.37Å; V337-F341 PolarHBondContact O-N 2.87Å; F341-A350 HydrophobicContact CD2-CB 4.23Å; F341-A350 HydrophobicContact CE1-CB 4.23Å; F341-A350 HydrophobicContact CE2-CB 3.8Å; F341-A350 HydrophobicContact CZ-CB 3.8Å; F341-L354 HydrophobicContact CE2-CD2 4.35Å; F341-L354 HydrophobicContact CE2-CG 4.45Å; F341-L354 HydrophobicContact CZ-CD1 3.99Å; F341-L354 HydrophobicContact CZ-CD2 4.2Å; F341-L354 HydrophobicContact CZ-CG 4.16Å; F341-K374 HydrophobicContact CD1-CB 4.34Å; F341-L375 HydrophobicContact CB-CD1 4.12Å; F341-V378 HydrophobicContact CE1-CG2 3.84Å; F341-V378 HydrophobicContact CE2-CG2 4.21Å; F341-V378 HydrophobicContact CZ-CG2 3.62Å
342	L	84.6	Confident	86.1	Confident	72 Å²	72	55.2 Å²	55.2	38%	0.377	31%	0.305	S	S	.	.	I	π-helix	trans	-113	-44.8	-171.7	-166	71.6	0	0	0	113.1	T192 Y338 P371	T192-L342 HydrophobicContact CG2-CD2 3.59Å; Y338-L342 WeakPolarHBondContact O-CA 3.29Å; Y338-L342 WeakPolarHBondContact O-CB 3.15Å; Y338-L342 PolarHBondContact O-N 3.45Å; L342-P371 HydrophobicContact CD1-CB 4.43Å; L342-P371 HydrophobicContact CD1-CG 4.39Å
343	I	81.5	Confident	85.8	Confident	102 Å²	102	50.8 Å²	50.8	52%	0.523	29%	0.29	S	S	.	.	I	π-helix	trans	-84.5	-56.2	-172.1	-53.8	176.8	0	0	0	111.4	Y338 D339	Y338-I343 PolarHBondContact O-N 3.4Å; D339-I343 HydrophobicContact CB-CD1 4.47Å; D339-I343 PolarHBondContact O-N 3.45Å
344	S	83.1	Confident	85.4	Confident	59 Å²	59	49.7 Å²	49.7	41%	0.413	28%	0.284	S	S	.	.	S	Bend	trans	-86.2	-31.3	-179.1	65.4	0	0	0	0	113.2	D339 A340 D346	D339-S344 WeakPolarHBondContact O-CB 3.44Å; D339-S344 PolarHBondContact O-N 2.8Å; D339-S344 PolarHBondContact O-OG 3.23Å; A340-S344 WeakPolarHBondContact CA-OG 3.36Å; S344-D346 PolarHBondContact O-N 3.42Å
345	G	78.5	Confident	85.1	Confident	55 Å²	55	57.3 Å²	57.3	57%	0.567	32%	0.317	S	S	*	.			trans	63.9	18.8	-176.5	0	0	0	0	0	114.3	A340 A347	A340-G345 CarbonylContact O-C 3.5Å; A340-G345 WeakPolarHBondContact O-CA 3.33Å; A340-G345 PolarHBondContact O-N 2.92Å; G345-A347 PolarHBondContact O-N 3.3Å
346	D	82.1	Confident	84.7	Confident	72 Å²	72	59.9 Å²	59.9	39%	0.385	33%	0.334	S	S	.	.			trans	-81.1	106.2	-176.7	-178.9	-10.9	0	0	0	110.9	A340 S344 D348 K349 A350	A340-D346 PolarHBondContact O-N 3.14Å; S344-D346 PolarHBondContact O-N 3.42Å; D346-D348 VanDerWaalsContact C-N 3.32Å; D346-D348 PolarHBondContact O-N 3.12Å; D346-D348 WeakPolarHBondContact OD1-CB 3.44Å; D346-D348 PolarHBondContact OD1-N 3.44Å; D346-K349 HydrophobicContact CB-CB 3.83Å; D346-K349 PolarHBondContact O-N 3.02Å; D346-K349 PolarHBondContact OD1-N 3.06Å; D346-K349 VanDerWaalsContact OD1-N 3.09Å; D346-K349 WeakPolarHBondContact OD2-CB 3.2Å; D346-A350 WeakPolarHBondContact O-CB 3.49Å; D346-A350 PolarHBondContact O-N 3.32Å
347	A	77.8	Confident	84.2	Confident	69 Å²	69	58.1 Å²	58.1	57%	0.57	32%	0.321	S	S	*	.	H	α-helix	trans	-62.9	-34.5	179.8	0	0	0	0	0	113.1	G345 A350 M351	G345-A347 PolarHBondContact O-N 3.3Å; A347-A350 PolarHBondContact O-N 3.29Å; A347-M351 WeakPolarHBondContact O-CB 3.46Å; A347-M351 VanDerWaalsContact O-CG 3.23Å; A347-M351 WeakPolarHBondContact O-CG 3.22Å; A347-M351 PolarHBondContact O-N 2.81Å
348	D	82.3	Confident	83.7	Confident	117 Å²	117	65.3 Å²	65.3	63%	0.626	36%	0.355	S	S	*	.	H	α-helix	trans	-73.2	-41.9	-179.3	-73	-32.4	0	0	0	110.7	D346 M351 K352	D346-D348 VanDerWaalsContact C-N 3.32Å; D346-D348 PolarHBondContact O-N 3.12Å; D346-D348 WeakPolarHBondContact OD1-CB 3.44Å; D346-D348 PolarHBondContact OD1-N 3.44Å; D348-M351 PolarHBondContact O-N 2.85Å; D348-K352 VanDerWaalsContact O-CG 3.32Å; D348-K352 WeakPolarHBondContact O-CG 3.18Å; D348-K352 PolarHBondContact O-N 3.18Å
349	K	85.2	Confident	83.2	Confident	79 Å²	79	66.3 Å²	66.3	34%	0.343	36%	0.36	S	S	.	.	H	α-helix	trans	-61.6	-45.1	172.2	-171.5	-179.9	-176.5	-179	0	110.9	D339 A340 D346 M351 K352 I353	D339-K349 IonicContact OD2-NZ 3.64Å; D339-K349 PolarHBondContact OD2-NZ 3.13Å; A340-K349 HydrophobicContact CB-CG 4.41Å; D346-K349 HydrophobicContact CB-CB 3.83Å; D346-K349 PolarHBondContact O-N 3.02Å; D346-K349 PolarHBondContact OD1-N 3.06Å; D346-K349 VanDerWaalsContact OD1-N 3.09Å; D346-K349 WeakPolarHBondContact OD2-CB 3.2Å; K349-M351 PolarHBondContact O-N 3.06Å; K349-K352 PolarHBondContact O-N 3.32Å; K349-I353 HydrophobicContact CG-CD1 4.03Å; K349-I353 WeakPolarHBondContact O-CG1 3.32Å; K349-I353 PolarHBondContact O-N 3.23Å
350	A	82.3	Confident	82.3	Confident	5 Å²	5	69 Å²	69	4%	0.041	38%	0.383	C	S	.	.	H	α-helix	trans	-58	-48.2	176.2	0	0	0	0	0	111.6	A340 F341 D346 A347 K352 I353 L354	A340-A350 HydrophobicContact CB-CB 4.06Å; F341-A350 HydrophobicContact CD2-CB 4.23Å; F341-A350 HydrophobicContact CE1-CB 4.23Å; F341-A350 HydrophobicContact CE2-CB 3.8Å; F341-A350 HydrophobicContact CZ-CB 3.8Å; D346-A350 WeakPolarHBondContact O-CB 3.49Å; D346-A350 PolarHBondContact O-N 3.32Å; A347-A350 PolarHBondContact O-N 3.29Å; A350-K352 VanDerWaalsContact C-N 3.34Å; A350-K352 PolarHBondContact O-N 3.42Å; A350-I353 PolarHBondContact O-N 2.9Å; A350-L354 WeakPolarHBondContact O-CG 3.1Å; A350-L354 PolarHBondContact O-N 2.83Å
351	M	82.6	Confident	81.4	Confident	87 Å²	87	70.8 Å²	70.8	43%	0.429	39%	0.392	S	S	.	.	H	α-helix	trans	-64.5	-35.7	178.7	-72.3	-63.3	-73	0	0	112.8	A347 D348 K349 L354 K355	A347-M351 WeakPolarHBondContact O-CB 3.46Å; A347-M351 VanDerWaalsContact O-CG 3.23Å; A347-M351 WeakPolarHBondContact O-CG 3.22Å; A347-M351 PolarHBondContact O-N 2.81Å; D348-M351 PolarHBondContact O-N 2.85Å; K349-M351 PolarHBondContact O-N 3.06Å; M351-L354 HydrophobicContact SD-CD1 4.1Å; M351-K355 WeakPolarHBondContact O-CB 3.41Å; M351-K355 VanDerWaalsContact O-CG 3.28Å; M351-K355 WeakPolarHBondContact O-CG 3.19Å; M351-K355 PolarHBondContact O-N 3.19Å
352	K	86.4	Confident	80.5	Confident	155 Å²	155	76.5 Å²	76.5	67%	0.674	42%	0.419	S	S	*	.	H	α-helix	trans	-63.8	-42.1	173	-74	171	-175.4	171.1	0	111.6	D348 K349 A350 K355 S356	D348-K352 VanDerWaalsContact O-CG 3.32Å; D348-K352 WeakPolarHBondContact O-CG 3.18Å; D348-K352 PolarHBondContact O-N 3.18Å; K349-K352 PolarHBondContact O-N 3.32Å; A350-K352 VanDerWaalsContact C-N 3.34Å; A350-K352 PolarHBondContact O-N 3.42Å; K352-K355 PolarHBondContact O-N 3.13Å; K352-S356 PolarHBondContact O-N 2.86Å
353	I	85.3	Confident	79.3	Confident	23 Å²	23	76 Å²	76	12%	0.118	43%	0.431	C	S	.	.	H	α-helix	trans	-68.6	-42.6	177.6	-66.8	164.5	0	0	0	111.1	V337 A340 K349 A350 K355 S356 L357	V337-I353 HydrophobicContact CG2-CG2 3.93Å; A340-I353 HydrophobicContact CB-CD1 3.74Å; K349-I353 HydrophobicContact CG-CD1 4.03Å; K349-I353 WeakPolarHBondContact O-CG1 3.32Å; K349-I353 PolarHBondContact O-N 3.23Å; A350-I353 PolarHBondContact O-N 2.9Å; I353-K355 VanDerWaalsContact C-N 3.28Å; I353-K355 PolarHBondContact O-N 3.23Å; I353-S356 PolarHBondContact O-N 3.2Å; I353-S356 PolarHBondContact O-OG 2.79Å; I353-L357 HydrophobicContact CG2-CD1 3.77Å; I353-L357 HydrophobicContact CG2-CG 4.26Å; I353-L357 WeakPolarHBondContact O-CB 3.42Å; I353-L357 WeakPolarHBondContact O-CG 3.28Å; I353-L357 PolarHBondContact O-N 3.12Å
354	L	84.3	Confident	78.2	Confident	11 Å²	11	74.5 Å²	74.5	6%	0.058	43%	0.434	C	S	.	.	H	α-helix	trans	-60.9	-39.2	175.8	-70.1	179.6	0	0	0	111.9	F341 A350 M351 L357 Q358 I359 I361 V378	F341-L354 HydrophobicContact CE2-CD2 4.35Å; F341-L354 HydrophobicContact CE2-CG 4.45Å; F341-L354 HydrophobicContact CZ-CD1 3.99Å; F341-L354 HydrophobicContact CZ-CD2 4.2Å; F341-L354 HydrophobicContact CZ-CG 4.16Å; A350-L354 WeakPolarHBondContact O-CG 3.1Å; A350-L354 PolarHBondContact O-N 2.83Å; M351-L354 HydrophobicContact SD-CD1 4.1Å; L354-L357 CarbonylContact O-C 3.59Å; L354-L357 PolarHBondContact O-N 3.2Å; L354-Q358 PolarHBondContact O-N 3.43Å; L354-I359 HydrophobicContact CD2-CB 4.16Å; L354-I359 HydrophobicContact CD2-CD1 4Å; L354-I359 HydrophobicContact CD2-CG2 4.43Å; L354-I359 PolarHBondContact O-N 3.16Å; L354-I361 HydrophobicContact CD1-CD1 3.76Å; L354-I361 HydrophobicContact CD2-CD1 3.87Å; L354-I361 HydrophobicContact CG-CD1 4.47Å; L354-V378 HydrophobicContact CD2-CG1 3.62Å; L354-V378 HydrophobicContact CD2-CG2 4.32Å
355	K	85.1	Confident	77.2	Confident	160 Å²	160	74.4 Å²	74.4	70%	0.696	43%	0.427	S	S	*	.	H	α-helix	trans	-65.4	-43.2	174.3	-75.6	176.4	-177.7	-178.8	0	112	M351 K352 I353 L357 Q358	M351-K355 WeakPolarHBondContact O-CB 3.41Å; M351-K355 VanDerWaalsContact O-CG 3.28Å; M351-K355 WeakPolarHBondContact O-CG 3.19Å; M351-K355 PolarHBondContact O-N 3.19Å; K352-K355 PolarHBondContact O-N 3.13Å; I353-K355 VanDerWaalsContact C-N 3.28Å; I353-K355 PolarHBondContact O-N 3.23Å; K355-L357 VanDerWaalsContact C-N 3.31Å; K355-L357 PolarHBondContact O-N 3.02Å; K355-Q358 PolarHBondContact O-N 3.44Å
356	S	83.4	Confident	76.4	Confident	76 Å²	76	74.4 Å²	74.4	53%	0.531	42%	0.416	S	S	.	.	H	α-helix	trans	-67.4	-34.4	178	70.5	0	0	0	0	112.2	K352 I353 Q358	K352-S356 PolarHBondContact O-N 2.86Å; I353-S356 PolarHBondContact O-N 3.2Å; I353-S356 PolarHBondContact O-OG 2.79Å; S356-Q358 VanDerWaalsContact C-N 3.29Å
357	L	81.6	Confident	75.4	Confident	4 Å²	4	75.4 Å²	75.4	2%	0.021	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	1.5	174.4	-63.3	177.7	0	0	0	113.5	R287 V337 I353 L354 K355 I359 W382	R287-L357 PolarHBondContact NH2-O 2.97Å; V337-L357 HydrophobicContact CG2-CD1 3.91Å; I353-L357 HydrophobicContact CG2-CD1 3.77Å; I353-L357 HydrophobicContact CG2-CG 4.26Å; I353-L357 WeakPolarHBondContact O-CB 3.42Å; I353-L357 WeakPolarHBondContact O-CG 3.28Å; I353-L357 PolarHBondContact O-N 3.12Å; L354-L357 CarbonylContact O-C 3.59Å; L354-L357 PolarHBondContact O-N 3.2Å; K355-L357 VanDerWaalsContact C-N 3.31Å; K355-L357 PolarHBondContact O-N 3.02Å; L357-I359 HydrophobicContact CB-CD1 3.68Å; L357-I359 HydrophobicContact CB-CG1 3.82Å; L357-I359 HydrophobicContact CD1-CD1 4Å; L357-I359 PolarHBondContact O-N 3.07Å; L357-W382 HydrophobicContact CD1-CE3 4.39Å; L357-W382 HydrophobicContact CD1-CH2 3.83Å; L357-W382 HydrophobicContact CD1-CZ2 4.13Å; L357-W382 HydrophobicContact CD1-CZ3 3.96Å; L357-W382 HydrophobicContact CD2-CH2 4.2Å; L357-W382 HydrophobicContact CD2-CZ2 3.93Å
358	Q	80	Confident	74.9	Confident	151 Å²	151	74.4 Å²	74.4	71%	0.706	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	35.8	179.2	-60.2	176.8	-40.9	0	0	114	L354 K355 S356	L354-Q358 PolarHBondContact O-N 3.43Å; K355-Q358 PolarHBondContact O-N 3.44Å; S356-Q358 VanDerWaalsContact C-N 3.29Å
359	I	79	Confident	74.1	Confident	21 Å²	21	74.7 Å²	74.7	11%	0.108	42%	0.421	C	S	.	.			trans	-89.4	119	-179.2	-56.2	167.5	0	0	0	108.6	L354 L357 I361 V378 W382	L354-I359 HydrophobicContact CD2-CB 4.16Å; L354-I359 HydrophobicContact CD2-CD1 4Å; L354-I359 HydrophobicContact CD2-CG2 4.43Å; L354-I359 PolarHBondContact O-N 3.16Å; L357-I359 HydrophobicContact CB-CD1 3.68Å; L357-I359 HydrophobicContact CB-CG1 3.82Å; L357-I359 HydrophobicContact CD1-CD1 4Å; L357-I359 PolarHBondContact O-N 3.07Å; I359-I361 HydrophobicContact CG2-CD1 4.24Å; I359-I361 HydrophobicContact CG2-CG1 3.84Å; I359-V378 HydrophobicContact CD1-CG1 4.21Å; I359-W382 HydrophobicContact CD1-CB 3.8Å; I359-W382 HydrophobicContact CD1-CD2 3.77Å; I359-W382 HydrophobicContact CD1-CE3 4.05Å; I359-W382 HydrophobicContact CD1-CG 3.65Å; I359-W382 HydrophobicContact CG1-CB 4.12Å; I359-W382 HydrophobicContact CG1-CG 4Å
360	S	70.8	Confident	73.9	Confident	105 Å²	105	73.5 Å²	73.5	73%	0.734	42%	0.418	S	S	*	.			trans	-92.8	106.8	175.6	55.8	0	0	0	0	111.5
361	I	69.1	Low	73.9	Confident	37 Å²	37	76 Å²	76	19%	0.19	43%	0.434	C	S	.	.			trans	-105.6	138.8	177.9	-52.6	179.8	0	0	0	109.6	L354 I359 E365 V366 V378	L354-I361 HydrophobicContact CD1-CD1 3.76Å; L354-I361 HydrophobicContact CD2-CD1 3.87Å; L354-I361 HydrophobicContact CG-CD1 4.47Å; I359-I361 HydrophobicContact CG2-CD1 4.24Å; I359-I361 HydrophobicContact CG2-CG1 3.84Å; I361-E365 HydrophobicContact CG2-CB 3.88Å; I361-V366 HydrophobicContact CB-CG2 4.17Å; I361-V366 HydrophobicContact CG2-CG2 3.74Å; I361-V378 HydrophobicContact CD1-CB 3.96Å; I361-V378 HydrophobicContact CD1-CG1 4.24Å; I361-V378 HydrophobicContact CD1-CG2 3.35Å
362	Q	65.7	Low	73.9	Confident	146 Å²	146	75.4 Å²	75.4	68%	0.682	43%	0.427	S	S	*	.			trans	-69.1	136.1	174.1	-62.6	-174.8	8.6	0	0	110.4	A364 E365	Q362-A364 PolarHBondContact O-N 3.26Å; Q362-E365 HydrophobicContact CB-CG 4.39Å; Q362-E365 PolarHBondContact O-N 3.13Å
363	G	59.2	Low	73.7	Confident	61 Å²	61	71 Å²	71	63%	0.629	41%	0.409	S	S	*	.	H	α-helix	trans	-56.1	-28.6	-173.2	0	0	0	0	0	115.2	E365 V366 S367	G363-E365 VanDerWaalsContact C-N 3.27Å; G363-E365 PolarHBondContact O-N 3.4Å; G363-V366 PolarHBondContact O-N 3.48Å; G363-S367 PolarHBondContact O-N 2.86Å
364	A	59.3	Low	73.6	Confident	72 Å²	72	72.7 Å²	72.7	60%	0.595	42%	0.415	S	S	*	.	H	α-helix	trans	-69.9	-19.2	177	0	0	0	0	0	114.2	Q362 S367	Q362-A364 PolarHBondContact O-N 3.26Å; A364-S367 PolarHBondContact O-OG 3.07Å; A364-S367 VanDerWaalsContact O-OG 3.09Å
365	E	62	Low	73.6	Confident	56 Å²	56	72.3 Å²	72.3	26%	0.262	41%	0.413	S	S	.	.	H	α-helix	trans	-87.3	-31	179.4	-56.3	-167.6	134.2	0	0	111.6	I361 Q362 G363 S367 R368	I361-E365 HydrophobicContact CG2-CB 3.88Å; Q362-E365 HydrophobicContact CB-CG 4.39Å; Q362-E365 PolarHBondContact O-N 3.13Å; G363-E365 VanDerWaalsContact C-N 3.27Å; G363-E365 PolarHBondContact O-N 3.4Å; E365-S367 VanDerWaalsContact C-N 3.28Å; E365-S367 PolarHBondContact O-N 3.32Å; E365-R368 IonicContact OE1-NH2 2.62Å
366	V	61.3	Low	73.6	Confident	56 Å²	56	66.2 Å²	66.2	34%	0.339	39%	0.387	S	S	.	.	H	α-helix	trans	-69.6	-28	175.6	-173.8	0	0	0	0	111.5	I361 G363 R368 K374	I361-V366 HydrophobicContact CB-CG2 4.17Å; I361-V366 HydrophobicContact CG2-CG2 3.74Å; G363-V366 PolarHBondContact O-N 3.48Å; V366-R368 VanDerWaalsContact C-N 3.33Å; V366-R368 PolarHBondContact O-N 3Å; V366-K374 WeakPolarHBondContact O-CE 3.41Å; V366-K374 PolarHBondContact O-NZ 3.41Å
367	S	60.7	Low	73.5	Confident	93 Å²	93	63.4 Å²	63.4	65%	0.65	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	0.8	-178.4	67.8	0	0	0	0	115	G363 A364 E365	G363-S367 PolarHBondContact O-N 2.86Å; A364-S367 PolarHBondContact O-OG 3.07Å; A364-S367 VanDerWaalsContact O-OG 3.09Å; E365-S367 VanDerWaalsContact C-N 3.28Å; E365-S367 PolarHBondContact O-N 3.32Å
368	R	66.6	Low	73.8	Confident	48 Å²	48	63.3 Å²	63.3	18%	0.181	37%	0.368	C	S	.	.			trans	-60.7	150.9	177.3	-68.6	-174	-175.6	150.1	12.8	110.8	E365 V366 K374 S377	E365-R368 IonicContact OE1-NH2 2.62Å; V366-R368 VanDerWaalsContact C-N 3.33Å; V366-R368 PolarHBondContact O-N 3Å; R368-K374 HydrophobicContact CB-CG 4.23Å; R368-K374 WeakPolarHBondContact O-CE 3.3Å; R368-K374 PolarHBondContact O-NZ 3.08Å; R368-K374 VanDerWaalsContact O-NZ 3.15Å; R368-S377 PolarHBondContact NH1-OG 3Å
369	S	66.4	Low	74.2	Confident	122 Å²	122	56.1 Å²	56.1	85%	0.853	33%	0.334	S	S	*	.	S	Bend	trans	-78.7	-33.8	179.5	59	0	0	0	0	112.6
370	D	80.6	Confident	74.3	Confident	54 Å²	54	56.2 Å²	56.2	29%	0.289	34%	0.34	S	S	.	.			trans	-82.7	117.5	-174.5	-179.1	-1.1	0	0	0	111.1	R372 Q373 K374	D370-R372 PolarHBondContact O-N 2.87Å; D370-R372 PolarHBondContact OD1-N 2.97Å; D370-R372 VanDerWaalsContact OD1-N 3.08Å; D370-Q373 HydrophobicContact CB-CB 4.17Å; D370-Q373 HydrophobicContact CB-CG 4.1Å; D370-Q373 PolarHBondContact O-N 3.28Å; D370-Q373 WeakPolarHBondContact OD2-CG 3.4Å; D370-Q373 PolarHBondContact OD2-NE2 3.18Å; D370-K374 PolarHBondContact O-N 3.18Å
371	P	82.3	Confident	75	Confident	57 Å²	57	54.2 Å²	54.2	37%	0.37	33%	0.326	S	S	.	.	H	α-helix	trans	-60.7	-34	-178.3	24.8	-34.2	0	0	0	112.4	L342 K374 L375	L342-P371 HydrophobicContact CD1-CB 4.43Å; L342-P371 HydrophobicContact CD1-CG 4.39Å; P371-K374 WeakPolarHBondContact O-CB 3.49Å; P371-K374 PolarHBondContact O-N 3.13Å; P371-L375 WeakPolarHBondContact O-CB 3.38Å; P371-L375 PolarHBondContact O-N 3.47Å
372	R	83.4	Confident	75.8	Confident	75 Å²	75	53.7 Å²	53.7	28%	0.283	32%	0.322	S	S	.	.	H	α-helix	trans	-71.6	-36.9	-177.8	-162.8	160.4	-147.8	172.7	11.2	111.9	D188 D271 D370 K374 L375 Q376	D188-R372 IonicContact OD2-NH2 2.94Å; D188-R372 PolarHBondContact OD2-NH2 2.9Å; D188-R372 VanDerWaalsContact OD2-NH2 3.15Å; D271-R372 WeakPolarHBondContact OD1-CG 3.38Å; D271-R372 IonicContact OD1-CZ 3.47Å; D271-R372 IonicContact OD1-NE 3.33Å; D271-R372 PolarHBondContact OD1-NE 3.42Å; D271-R372 IonicContact OD1-NH2 3.8Å; D271-R372 PolarHBondContact OD1-NH2 3.13Å; D271-R372 IonicContact OD2-CZ 3.74Å; D271-R372 IonicContact OD2-NE 3.64Å; D271-R372 IonicContact OD2-NH2 3.78Å; D271-R372 PolarHBondContact OD2-NH2 3.31Å; D370-R372 PolarHBondContact O-N 2.87Å; D370-R372 PolarHBondContact OD1-N 2.97Å; D370-R372 VanDerWaalsContact OD1-N 3.08Å; R372-K374 VanDerWaalsContact C-N 3.34Å; R372-K374 PolarHBondContact O-N 2.74Å; R372-L375 PolarHBondContact O-N 3.35Å; R372-Q376 WeakPolarHBondContact O-CG 3.4Å; R372-Q376 PolarHBondContact O-N 3.18Å
373	Q	81	Confident	76.9	Confident	63 Å²	63	47.2 Å²	47.2	29%	0.294	29%	0.291	S	S	.	.	H	α-helix	trans	-67.1	-33.6	173.6	-72.5	176.1	45.6	0	0	113	D370 S377	D370-Q373 HydrophobicContact CB-CB 4.17Å; D370-Q373 HydrophobicContact CB-CG 4.1Å; D370-Q373 PolarHBondContact O-N 3.28Å; D370-Q373 WeakPolarHBondContact OD2-CG 3.4Å; D370-Q373 PolarHBondContact OD2-NE2 3.18Å; Q373-S377 PolarHBondContact O-N 3.4Å; Q373-S377 PolarHBondContact O-OG 3.15Å
374	K	82.9	Confident	78.3	Confident	58 Å²	58	47 Å²	47	25%	0.252	28%	0.279	S	S	.	.	H	α-helix	trans	-62.5	-49.8	171.2	-65.1	-174.9	-170.1	-167.5	0	110	F341 V366 R368 D370 P371 R372 Q376 S377 V378	F341-K374 HydrophobicContact CD1-CB 4.34Å; V366-K374 WeakPolarHBondContact O-CE 3.41Å; V366-K374 PolarHBondContact O-NZ 3.41Å; R368-K374 HydrophobicContact CB-CG 4.23Å; R368-K374 WeakPolarHBondContact O-CE 3.3Å; R368-K374 PolarHBondContact O-NZ 3.08Å; R368-K374 VanDerWaalsContact O-NZ 3.15Å; D370-K374 PolarHBondContact O-N 3.18Å; P371-K374 WeakPolarHBondContact O-CB 3.49Å; P371-K374 PolarHBondContact O-N 3.13Å; R372-K374 VanDerWaalsContact C-N 3.34Å; R372-K374 PolarHBondContact O-N 2.74Å; K374-Q376 VanDerWaalsContact C-N 3.34Å; K374-Q376 PolarHBondContact O-N 2.93Å; K374-S377 WeakPolarHBondContact O-CB 3.47Å; K374-S377 PolarHBondContact O-N 3.39Å; K374-V378 VanDerWaalsContact O-CG2 3.27Å; K374-V378 WeakPolarHBondContact O-CG2 3.26Å; K374-V378 PolarHBondContact O-N 2.93Å
375	L	85.5	Confident	79.7	Confident	3 Å²	3	43.6 Å²	43.6	2%	0.016	25%	0.251	C	S	.	.	H	α-helix	trans	-58.5	-44.3	-179.4	-175.9	142.3	0	0	0	111.6	D271 Y338 F341 P371 R372 S377 V378 F379	D271-L375 HydrophobicContact CB-CD2 3.46Å; D271-L375 VanDerWaalsContact CB-CD2 3.46Å; D271-L375 WeakPolarHBondContact OD1-CD2 3.41Å; Y338-L375 HydrophobicContact CD1-CD1 3.64Å; Y338-L375 HydrophobicContact CE1-CD1 3.75Å; Y338-L375 HydrophobicContact CE1-CD2 3.98Å; Y338-L375 HydrophobicContact CE1-CG 4.48Å; F341-L375 HydrophobicContact CB-CD1 4.12Å; P371-L375 WeakPolarHBondContact O-CB 3.38Å; P371-L375 PolarHBondContact O-N 3.47Å; R372-L375 PolarHBondContact O-N 3.35Å; L375-S377 VanDerWaalsContact C-N 3.28Å; L375-S377 PolarHBondContact O-N 2.91Å; L375-V378 WeakPolarHBondContact O-CB 3.15Å; L375-V378 PolarHBondContact O-N 2.95Å; L375-F379 HydrophobicContact CD1-CE2 4.01Å; L375-F379 HydrophobicContact CD2-CD2 3.41Å; L375-F379 VanDerWaalsContact CD2-CD2 3.41Å; L375-F379 HydrophobicContact CD2-CE2 3.56Å; L375-F379 HydrophobicContact CG-CD2 3.61Å; L375-F379 HydrophobicContact CG-CE2 3.56Å; L375-F379 WeakPolarHBondContact O-CB 3.49Å; L375-F379 WeakPolarHBondContact O-CD2 3.27Å; L375-F379 PolarHBondContact O-N 2.71Å
376	Q	84.7	Confident	81	Confident	32 Å²	32	41.1 Å²	41.1	15%	0.15	24%	0.24	C	C	.	.	H	α-helix	trans	-58.4	-36	172.7	-75.1	175.1	-22	0	0	113.4	L270 R372 K374 G380	L270-Q376 PolarHBondContact O-NE2 2.82Å; R372-Q376 WeakPolarHBondContact O-CG 3.4Å; R372-Q376 PolarHBondContact O-N 3.18Å; K374-Q376 VanDerWaalsContact C-N 3.34Å; K374-Q376 PolarHBondContact O-N 2.93Å; Q376-G380 WeakPolarHBondContact O-CA 3.31Å; Q376-G380 PolarHBondContact O-N 3.25Å
377	S	82.4	Confident	82.3	Confident	17 Å²	17	39.5 Å²	39.5	12%	0.119	23%	0.231	C	C	.	.	H	α-helix	trans	-74.5	-40.2	179	-48.9	0	0	0	0	111.2	R368 Q373 K374 L375 S381	R368-S377 PolarHBondContact NH1-OG 3Å; Q373-S377 PolarHBondContact O-N 3.4Å; Q373-S377 PolarHBondContact O-OG 3.15Å; K374-S377 WeakPolarHBondContact O-CB 3.47Å; K374-S377 PolarHBondContact O-N 3.39Å; L375-S377 VanDerWaalsContact C-N 3.28Å; L375-S377 PolarHBondContact O-N 2.91Å; S377-S381 PolarHBondContact O-N 2.96Å; S377-S381 VanDerWaalsContact O-N 3.13Å
378	V	86.8	Confident	83.8	Confident	3 Å²	3	35.2 Å²	35.2	2%	0.018	20%	0.201	C	C	.	.	H	α-helix	trans	-58.3	-53.4	173.5	175.5	0	0	0	0	110.1	F341 L354 I359 I361 K374 L375 S381 W382	F341-V378 HydrophobicContact CE1-CG2 3.84Å; F341-V378 HydrophobicContact CE2-CG2 4.21Å; F341-V378 HydrophobicContact CZ-CG2 3.62Å; L354-V378 HydrophobicContact CD2-CG1 3.62Å; L354-V378 HydrophobicContact CD2-CG2 4.32Å; I359-V378 HydrophobicContact CD1-CG1 4.21Å; I361-V378 HydrophobicContact CD1-CB 3.96Å; I361-V378 HydrophobicContact CD1-CG1 4.24Å; I361-V378 HydrophobicContact CD1-CG2 3.35Å; K374-V378 VanDerWaalsContact O-CG2 3.27Å; K374-V378 WeakPolarHBondContact O-CG2 3.26Å; K374-V378 PolarHBondContact O-N 2.93Å; L375-V378 WeakPolarHBondContact O-CB 3.15Å; L375-V378 PolarHBondContact O-N 2.95Å; V378-S381 PolarHBondContact O-N 2.97Å; V378-W382 WeakPolarHBondContact O-CB 3.46Å; V378-W382 PolarHBondContact O-N 3.43Å; V378-W382 VanDerWaalsContact O-N 3.12Å
379	F	88.5	Confident	85.1	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-69.2	-40.3	-177	-86.5	-52	0	0	0	112.9	W273 L334 V337 Y338 L375 S381 W382 I383	W273-F379 HydrophobicContact CB-CB 3.9Å; W273-F379 HydrophobicContact CB-CD1 3.96Å; W273-F379 HydrophobicContact CB-CG 4.07Å; W273-F379 AromaticContact CD1-CD1 3.63Å; W273-F379 AromaticContact CD1-CD2 3.59Å; W273-F379 AromaticContact CD1-CE2 3.99Å; W273-F379 AromaticContact CD1-CG 3.41Å; W273-F379 VanDerWaalsContact CD1-CG 3.41Å; W273-F379 HydrophobicContact CG-CB 4.21Å; W273-F379 AromaticContact CG-CD1 3.77Å; W273-F379 HydrophobicContact CG-CD1 3.77Å; W273-F379 HydrophobicContact CG-CD2 4.48Å; W273-F379 HydrophobicContact CG-CE1 4.28Å; W273-F379 AromaticContact CG-CG 3.91Å; W273-F379 HydrophobicContact CG-CG 3.91Å; L334-F379 HydrophobicContact CD2-CE1 3.69Å; L334-F379 HydrophobicContact CD2-CZ 4.18Å; V337-F379 HydrophobicContact CB-CZ 4.04Å; V337-F379 HydrophobicContact CG1-CE1 4.29Å; V337-F379 HydrophobicContact CG1-CE2 3.86Å; V337-F379 HydrophobicContact CG1-CZ 3.59Å; Y338-F379 HydrophobicContact CE1-CE2 4.26Å; Y338-F379 HydrophobicContact CE2-CE2 4.3Å; Y338-F379 HydrophobicContact CE2-CZ 4.16Å; Y338-F379 AromaticContact CZ-CE2 3.94Å; L375-F379 HydrophobicContact CD1-CE2 4.01Å; L375-F379 HydrophobicContact CD2-CD2 3.41Å; L375-F379 VanDerWaalsContact CD2-CD2 3.41Å; L375-F379 HydrophobicContact CD2-CE2 3.56Å; L375-F379 HydrophobicContact CG-CD2 3.61Å; L375-F379 HydrophobicContact CG-CE2 3.56Å; L375-F379 WeakPolarHBondContact O-CB 3.49Å; L375-F379 WeakPolarHBondContact O-CD2 3.27Å; L375-F379 PolarHBondContact O-N 2.71Å; F379-S381 PolarHBondContact O-N 2.83Å; F379-W382 AromaticContact CD1-CE3 3.99Å; F379-W382 HydrophobicContact CD1-CE3 3.99Å; F379-W382 HydrophobicContact CD1-CZ3 4.45Å; F379-W382 AromaticContact CE1-CE3 3.89Å; F379-W382 HydrophobicContact CE1-CE3 3.89Å; F379-W382 AromaticContact CE1-CZ3 3.9Å; F379-W382 HydrophobicContact CE1-CZ3 3.9Å; F379-W382 PolarHBondContact O-N 3.05Å; F379-W382 VanDerWaalsContact O-N 3.08Å; F379-I383 HydrophobicContact CD1-CD1 4.25Å; F379-I383 HydrophobicContact CD1-CG1 4.22Å; F379-I383 CarbonylContact O-C 2.98Å; F379-I383 PolarHBondContact O-N 3.26Å
380	G	82	Confident	86.4	Confident	22 Å²	22	27.1 Å²	27.1	23%	0.227	15%	0.152	C	C	.	.	H	α-helix	trans	-61.5	-29.8	174.9	0	0	0	0	0	113.3	Q376 P384	Q376-G380 WeakPolarHBondContact O-CA 3.31Å; Q376-G380 PolarHBondContact O-N 3.25Å; G380-P384 VanDerWaalsContact O-CG 3.31Å; G380-P384 WeakPolarHBondContact O-CG 3.34Å
381	S	83.9	Confident	87	Confident	64 Å²	64	28.4 Å²	28.4	45%	0.448	15%	0.153	S	C	.	.	H	α-helix	trans	-81.9	-27.3	173.1	-176	0	0	0	0	113.5	S377 V378 F379	S377-S381 PolarHBondContact O-N 2.96Å; S377-S381 VanDerWaalsContact O-N 3.13Å; V378-S381 PolarHBondContact O-N 2.97Å; F379-S381 PolarHBondContact O-N 2.83Å
382	W	86.6	Confident	87.6	Confident	25 Å²	25	25.7 Å²	25.7	10%	0.095	14%	0.135	C	C	.	.	H	α-helix	trans	-89.8	-54.1	-173.4	-176.9	25.3	0	0	0	112.7	N333 L334 V337 L357 I359 V378 F379	N333-W382 HydrophobicContact CB-CH2 4.24Å; L334-W382 HydrophobicContact CD2-CH2 4.43Å; L334-W382 HydrophobicContact CD2-CZ3 4.03Å; V337-W382 HydrophobicContact CG2-CZ3 4.42Å; L357-W382 HydrophobicContact CD1-CE3 4.39Å; L357-W382 HydrophobicContact CD1-CH2 3.83Å; L357-W382 HydrophobicContact CD1-CZ2 4.13Å; L357-W382 HydrophobicContact CD1-CZ3 3.96Å; L357-W382 HydrophobicContact CD2-CH2 4.2Å; L357-W382 HydrophobicContact CD2-CZ2 3.93Å; I359-W382 HydrophobicContact CD1-CB 3.8Å; I359-W382 HydrophobicContact CD1-CD2 3.77Å; I359-W382 HydrophobicContact CD1-CE3 4.05Å; I359-W382 HydrophobicContact CD1-CG 3.65Å; I359-W382 HydrophobicContact CG1-CB 4.12Å; I359-W382 HydrophobicContact CG1-CG 4Å; V378-W382 WeakPolarHBondContact O-CB 3.46Å; V378-W382 PolarHBondContact O-N 3.43Å; V378-W382 VanDerWaalsContact O-N 3.12Å; F379-W382 AromaticContact CD1-CE3 3.99Å; F379-W382 HydrophobicContact CD1-CE3 3.99Å; F379-W382 HydrophobicContact CD1-CZ3 4.45Å; F379-W382 AromaticContact CE1-CE3 3.89Å; F379-W382 HydrophobicContact CE1-CE3 3.89Å; F379-W382 AromaticContact CE1-CZ3 3.9Å; F379-W382 HydrophobicContact CE1-CZ3 3.9Å; F379-W382 PolarHBondContact O-N 3.05Å; F379-W382 VanDerWaalsContact O-N 3.08Å
383	I	89	Confident	88	Confident	10 Å²	10	22.1 Å²	22.1	5%	0.051	12%	0.122	C	C	.	.	S	Bend	trans	-142.5	72.1	-174.5	41.7	164	0	0	0	109.9	W273 A274 F275 L283 L334 F379 A385	W273-I383 WeakPolarHBondContact CA-O 3.4Å; W273-I383 HydrophobicContact CB-CD1 3.74Å; W273-I383 HydrophobicContact CB-CG1 3.75Å; W273-I383 VanDerWaalsContact CB-O 3.3Å; W273-I383 WeakPolarHBondContact CB-O 3.48Å; W273-I383 HydrophobicContact CD2-CD1 4.05Å; W273-I383 HydrophobicContact CE3-CD1 3.78Å; W273-I383 HydrophobicContact CG-CD1 4.08Å; A274-I383 PolarHBondContact N-O 3.34Å; F275-I383 HydrophobicContact CD1-CD1 3.86Å; F275-I383 HydrophobicContact CE1-CD1 4.49Å; L283-I383 HydrophobicContact CD1-CG2 3.74Å; L334-I383 HydrophobicContact CD2-CD1 4.22Å; F379-I383 HydrophobicContact CD1-CD1 4.25Å; F379-I383 HydrophobicContact CD1-CG1 4.22Å; F379-I383 CarbonylContact O-C 2.98Å; F379-I383 PolarHBondContact O-N 3.26Å; I383-A385 PolarHBondContact O-N 3.18Å
384	P	88.4	Confident	88.6	Confident	58 Å²	58	19.5 Å²	19.5	38%	0.377	11%	0.111	S	C	.	.	B	Isolated β-bridge	trans	-61	125	-173.2	-2.2	4.4	0	0	0	112.4	G380 A386 S387 A388	G380-P384 VanDerWaalsContact O-CG 3.31Å; G380-P384 WeakPolarHBondContact O-CG 3.34Å; P384-A386 PolarHBondContact O-N 3.14Å; P384-S387 PolarHBondContact O-N 3.03Å; P384-A388 PolarHBondContact O-N 2.57Å
385	A	88.9	Confident	89	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-55.4	-50.2	-173.1	0	0	0	0	0	113.9	L77 W273 A274 I383 S387 A388 V389	L77-A385 HydrophobicContact CD1-CB 3.9Å; W273-A385 VanDerWaalsContact C-CB 3.46Å; A274-A385 HydrophobicContact CB-CB 3.95Å; A274-A385 VanDerWaalsContact N-CA 3.29Å; I383-A385 PolarHBondContact O-N 3.18Å; A385-S387 VanDerWaalsContact C-N 3.29Å; A385-S387 PolarHBondContact O-N 3.04Å; A385-A388 PolarHBondContact O-N 2.96Å; A385-V389 PolarHBondContact O-N 2.72Å
386	A	88.4	Confident	89.2	Confident	4 Å²	4	23 Å²	23	3%	0.033	13%	0.13	C	C	.	.	H	α-helix	trans	-63.9	-36.8	-174.8	0	0	0	0	0	112.4	L78 T81 P384 A388 V389 L390	L78-A386 HydrophobicContact CD2-CB 3.89Å; T81-A386 WeakPolarHBondContact OG1-CB 3.45Å; P384-A386 PolarHBondContact O-N 3.14Å; A386-A388 PolarHBondContact O-N 3.07Å; A386-V389 PolarHBondContact O-N 3.18Å; A386-L390 WeakPolarHBondContact O-CB 3.49Å; A386-L390 WeakPolarHBondContact O-CG 3.42Å; A386-L390 PolarHBondContact O-N 2.97Å
387	S	90.1	Very high	89.4	Confident	21 Å²	21	21.8 Å²	21.8	15%	0.147	12%	0.124	C	C	.	.	H	α-helix	trans	-64.8	-40.5	179.1	-173.5	0	0	0	0	112	P384 A385 R391	P384-S387 PolarHBondContact O-N 3.03Å; A385-S387 VanDerWaalsContact C-N 3.29Å; A385-S387 PolarHBondContact O-N 3.04Å; S387-R391 WeakPolarHBondContact O-CB 3.36Å; S387-R391 WeakPolarHBondContact O-CG 3.35Å; S387-R391 PolarHBondContact O-N 3.48Å; S387-R391 VanDerWaalsContact O-N 3.1Å; S387-R391 PolarHBondContact OG-NE 3.16Å; S387-R391 PolarHBondContact OG-NH2 3.36Å
388	A	92.2	Very high	89.8	Confident	3 Å²	3	22.2 Å²	22.2	3%	0.025	13%	0.127	C	C	.	.	H	α-helix	trans	-67.2	-45.1	179.5	0	0	0	0	0	111.4	A274 P384 A385 A386 R391 M392	A274-A388 HydrophobicContact CB-CB 4.14Å; A274-A388 VanDerWaalsContact O-CB 3.32Å; A274-A388 WeakPolarHBondContact O-CB 3.31Å; P384-A388 PolarHBondContact O-N 2.57Å; A385-A388 PolarHBondContact O-N 2.96Å; A386-A388 PolarHBondContact O-N 3.07Å; A388-R391 PolarHBondContact O-N 3.47Å; A388-M392 PolarHBondContact O-N 3Å
389	V	94	Very high	90	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-68.4	-42.7	-179.3	176.8	0	0	0	0	111.8	L74 L78 I153 V183 A274 A385 A386 R391 M392 V393	L74-V389 HydrophobicContact CD1-CG2 4.33Å; L78-V389 HydrophobicContact CD1-CG1 4.47Å; L78-V389 HydrophobicContact CD2-CB 4.11Å; L78-V389 HydrophobicContact CD2-CG1 4.11Å; I153-V389 HydrophobicContact CD1-CG1 4.04Å; V183-V389 HydrophobicContact CG2-CG2 4.37Å; A274-V389 HydrophobicContact CB-CG2 4.32Å; A385-V389 PolarHBondContact O-N 2.72Å; A386-V389 PolarHBondContact O-N 3.18Å; V389-R391 PolarHBondContact O-N 2.99Å; V389-M392 HydrophobicContact CG1-CE 4.43Å; V389-M392 VanDerWaalsContact O-CB 3.31Å; V389-M392 WeakPolarHBondContact O-CB 3.37Å; V389-M392 PolarHBondContact O-N 2.67Å; V389-V393 WeakPolarHBondContact O-CG2 3.44Å; V389-V393 PolarHBondContact O-N 2.86Å
390	L	92.9	Very high	90	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	13%	0.133	C	C	.	.	H	α-helix	trans	-68	-34.6	177.5	-65.4	-179.4	0	0	0	112.4	L78 F118 I127 A386 V393 C394	L78-L390 HydrophobicContact CD2-CD2 3.86Å; L78-L390 HydrophobicContact CD2-CG 3.87Å; F118-L390 HydrophobicContact CB-CD1 4.14Å; F118-L390 HydrophobicContact CD1-CB 3.7Å; F118-L390 HydrophobicContact CD2-CB 3.93Å; F118-L390 HydrophobicContact CD2-CD1 3.5Å; F118-L390 VanDerWaalsContact CD2-CD1 3.5Å; F118-L390 HydrophobicContact CD2-CG 4.37Å; F118-L390 HydrophobicContact CE1-CB 3.75Å; F118-L390 HydrophobicContact CE2-CB 3.99Å; F118-L390 HydrophobicContact CE2-CD1 4.02Å; F118-L390 HydrophobicContact CG-CB 3.79Å; F118-L390 HydrophobicContact CG-CD1 3.84Å; F118-L390 HydrophobicContact CG-CG 4.44Å; F118-L390 HydrophobicContact CZ-CB 3.91Å; I127-L390 HydrophobicContact CD1-CB 4.28Å; I127-L390 HydrophobicContact CD1-CD2 3.76Å; I127-L390 HydrophobicContact CD1-CG 4.47Å; A386-L390 WeakPolarHBondContact O-CB 3.49Å; A386-L390 WeakPolarHBondContact O-CG 3.42Å; A386-L390 PolarHBondContact O-N 2.97Å; L390-V393 PolarHBondContact O-N 3.01Å; L390-C394 PolarHBondContact O-N 2.79Å; L390-C394 PolarHBondContact O-SG 3.34Å; L390-C394 VanDerWaalsContact O-SG 3.32Å
391	R	93.5	Very high	90	Very high	80 Å²	80	22.6 Å²	22.6	30%	0.302	13%	0.127	S	C	.	.	H	α-helix	trans	-64.7	-42.8	170.8	-73.6	177.4	-165.1	143.7	2.4	111.8	F118 D279 S387 A388 V389 V393 C394 D395	F118-R391 HydrophobicContact CE1-CG 3.74Å; F118-R391 HydrophobicContact CZ-CG 3.86Å; D279-R391 IonicContact OD1-NH1 3.31Å; D279-R391 PolarHBondContact OD1-NH1 3.09Å; S387-R391 WeakPolarHBondContact O-CB 3.36Å; S387-R391 WeakPolarHBondContact O-CG 3.35Å; S387-R391 PolarHBondContact O-N 3.48Å; S387-R391 VanDerWaalsContact O-N 3.1Å; S387-R391 PolarHBondContact OG-NE 3.16Å; S387-R391 PolarHBondContact OG-NH2 3.36Å; A388-R391 PolarHBondContact O-N 3.47Å; V389-R391 PolarHBondContact O-N 2.99Å; R391-V393 VanDerWaalsContact C-N 3.31Å; R391-V393 PolarHBondContact O-N 3.38Å; R391-C394 PolarHBondContact O-N 3.18Å; R391-D395 WeakPolarHBondContact O-CB 3.46Å; R391-D395 PolarHBondContact O-N 2.99Å
392	M	93.7	Very high	90	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-54.1	-49.3	173.9	-170.2	174.3	59.7	0	0	111.1	C181 V183 G262 A265 A388 V389 C394 D395 Q396	C181-M392 HydrophobicContact CB-CE 3.59Å; C181-M392 HydrophobicContact CB-CG 4.24Å; C181-M392 HydrophobicContact CB-SD 3.94Å; V183-M392 HydrophobicContact CG2-CE 3.73Å; G262-M392 WeakPolarHBondContact O-CG 3.39Å; A265-M392 HydrophobicContact CB-CE 4.12Å; A265-M392 HydrophobicContact CB-SD 3.84Å; A388-M392 PolarHBondContact O-N 3Å; V389-M392 HydrophobicContact CG1-CE 4.43Å; V389-M392 VanDerWaalsContact O-CB 3.31Å; V389-M392 WeakPolarHBondContact O-CB 3.37Å; V389-M392 PolarHBondContact O-N 2.67Å; M392-C394 PolarHBondContact O-N 3.11Å; M392-D395 PolarHBondContact O-N 3.4Å; M392-Q396 HydrophobicContact CG-CG 4.2Å; M392-Q396 WeakPolarHBondContact O-CB 3.36Å; M392-Q396 WeakPolarHBondContact O-CG 3.48Å; M392-Q396 PolarHBondContact O-N 3.46Å
393	V	93.4	Very high	89.7	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-57.3	-47.6	177	161.6	0	0	0	0	111.9	R59 V61 I127 I153 V389 L390 R391 D395 L397	R59-V393 HydrophobicContact CB-CG1 4.08Å; R59-V393 HydrophobicContact CG-CG1 4.24Å; V61-V393 HydrophobicContact CG1-CG2 4.48Å; V61-V393 HydrophobicContact CG2-CG1 3.76Å; I127-V393 HydrophobicContact CD1-CG1 4.08Å; I127-V393 HydrophobicContact CG1-CG1 4.4Å; I127-V393 HydrophobicContact CG2-CG1 4.16Å; I153-V393 HydrophobicContact CD1-CG2 3.78Å; I153-V393 HydrophobicContact CG1-CG2 4.04Å; V389-V393 WeakPolarHBondContact O-CG2 3.44Å; V389-V393 PolarHBondContact O-N 2.86Å; L390-V393 PolarHBondContact O-N 3.01Å; R391-V393 VanDerWaalsContact C-N 3.31Å; R391-V393 PolarHBondContact O-N 3.38Å; V393-D395 PolarHBondContact O-N 3.31Å; V393-L397 HydrophobicContact CB-CD1 4.39Å; V393-L397 HydrophobicContact CG1-CD1 4.11Å; V393-L397 HydrophobicContact CG2-CD1 4.16Å; V393-L397 VanDerWaalsContact O-CB 3.26Å; V393-L397 WeakPolarHBondContact O-CB 3.49Å; V393-L397 PolarHBondContact O-N 2.94Å; V393-L397 VanDerWaalsContact O-N 3.07Å
394	C	92.8	Very high	89.3	Confident	8 Å²	8	27 Å²	27	5%	0.054	14%	0.144	C	C	.	.	H	α-helix	trans	-66.5	-37.5	-179.3	-70.2	0	0	0	0	113.2	F125 L390 R391 M392	F125-C394 HydrophobicContact CD2-CB 4.48Å; F125-C394 HydrophobicContact CE2-CB 4.49Å; L390-C394 PolarHBondContact O-N 2.79Å; L390-C394 PolarHBondContact O-SG 3.34Å; L390-C394 VanDerWaalsContact O-SG 3.32Å; R391-C394 PolarHBondContact O-N 3.18Å; M392-C394 PolarHBondContact O-N 3.11Å
395	D	90.8	Very high	89	Confident	66 Å²	66	29.4 Å²	29.4	35%	0.353	15%	0.15	S	C	.	.	H	α-helix	trans	-80.5	-38.7	-174.6	-66.6	-18.5	0	0	0	112	N120 R276 R391 M392 V393	N120-D395 PolarHBondContact ND2-OD1 3.17Å; N120-D395 VanDerWaalsContact ND2-OD1 3.12Å; R276-D395 IonicContact CZ-OD2 3.7Å; R276-D395 IonicContact NH1-OD2 3.01Å; R276-D395 PolarHBondContact NH1-OD2 2.91Å; R276-D395 IonicContact NH2-OD2 2.75Å; R391-D395 WeakPolarHBondContact O-CB 3.46Å; R391-D395 PolarHBondContact O-N 2.99Å; M392-D395 PolarHBondContact O-N 3.4Å; V393-D395 PolarHBondContact O-N 3.31Å
396	Q	89.7	Confident	88.5	Confident	68 Å²	68	35.9 Å²	35.9	32%	0.318	18%	0.175	S	C	.	.	H	α-helix	trans	-99.2	-37.2	-172.1	-58.9	-63.4	-29.1	0	0	113.9	S261 G262 N263 M392	S261-Q396 PolarHBondContact O-NE2 3.16Å; G262-Q396 PolarHBondContact O-NE2 3.49Å; N263-Q396 HydrophobicContact CB-CG 4.27Å; M392-Q396 HydrophobicContact CG-CG 4.2Å; M392-Q396 WeakPolarHBondContact O-CB 3.36Å; M392-Q396 WeakPolarHBondContact O-CG 3.48Å; M392-Q396 PolarHBondContact O-N 3.46Å
397	L	90.6	Very high	88.3	Confident	6 Å²	6	35.8 Å²	35.8	3%	0.031	17%	0.174	C	C	.	.	S	Bend	trans	-82.3	142.9	-174.4	-59.5	-174.5	0	0	0	111.6	R59 V61 Q179 C181 V393	R59-L397 PolarHBondContact NE-O 2.95Å; V61-L397 HydrophobicContact CB-CD1 4.27Å; V61-L397 HydrophobicContact CG1-CD1 3.84Å; V61-L397 HydrophobicContact CG2-CD1 3.47Å; V61-L397 VanDerWaalsContact CG2-CD1 3.47Å; Q179-L397 HydrophobicContact CB-CD2 3.76Å; Q179-L397 WeakPolarHBondContact O-CD2 3.32Å; C181-L397 VanDerWaalsContact SG-CD2 3.54Å; V393-L397 HydrophobicContact CB-CD1 4.39Å; V393-L397 HydrophobicContact CG1-CD1 4.11Å; V393-L397 HydrophobicContact CG2-CD1 4.16Å; V393-L397 VanDerWaalsContact O-CB 3.26Å; V393-L397 WeakPolarHBondContact O-CB 3.49Å; V393-L397 PolarHBondContact O-N 2.94Å; V393-L397 VanDerWaalsContact O-N 3.07Å
398	P	88.9	Confident	88	Confident	27 Å²	27	34.8 Å²	34.8	18%	0.175	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-70.4	147.7	-177.6	28.4	-32.7	0	0	0	110.2	R59 D150 Q179	R59-P398 WeakPolarHBondContact CD-O 3.41Å; R59-P398 PolarHBondContact NE-O 2.98Å; D150-P398 HydrophobicContact CB-CG 4.44Å; Q179-P398 HydrophobicContact CB-CG 4.37Å; Q179-P398 HydrophobicContact CG-CG 3.89Å
399	P	91.3	Very high	87.5	Confident	21 Å²	21	37.5 Å²	37.5	14%	0.136	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-63.2	153.3	167.8	28.8	-33.7	0	0	0	110.7	E56 R59 G401 K402	E56-P399 WeakPolarHBondContact O-CB 3.39Å; R59-P399 VanDerWaalsContact NH1-CA 3.26Å; R59-P399 VanDerWaalsContact NH1-CB 3.33Å; P399-G401 PolarHBondContact O-N 2.81Å; P399-K402 HydrophobicContact CG-CB 3.71Å; P399-K402 HydrophobicContact CG-CD 3.83Å; P399-K402 HydrophobicContact CG-CG 3.7Å; P399-K402 PolarHBondContact O-N 3.5Å
400	A	88.1	Confident	86.7	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-31.1	179.4	0	0	0	0	0	112.9	P55 I58 C437	P55-A400 PolarHBondContact O-N 3.41Å; I58-A400 HydrophobicContact CB-CB 4.13Å; I58-A400 HydrophobicContact CG2-CB 4.24Å; I58-A400 PolarHBondContact O-N 3.3Å; A400-C437 PolarHBondContact O-SG 2.88Å
401	G	81.9	Confident	86.2	Confident	11 Å²	11	40.6 Å²	40.6	11%	0.113	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	19.2	176.4	0	0	0	0	0	116.2	P399 M435	P399-G401 PolarHBondContact O-N 2.81Å; G401-M435 CarbonylContact C-O 3.39Å
402	K	83.9	Confident	85.5	Confident	144 Å²	144	36.8 Å²	36.8	63%	0.626	18%	0.176	S	C	*	.			trans	-137.7	58.7	169	-63.3	-174.7	177.5	-176.8	0	110.9	P399	P399-K402 HydrophobicContact CG-CB 3.71Å; P399-K402 HydrophobicContact CG-CD 3.83Å; P399-K402 HydrophobicContact CG-CG 3.7Å; P399-K402 PolarHBondContact O-N 3.5Å
403	L	82	Confident	84.2	Confident	6 Å²	6	37.5 Å²	37.5	3%	0.031	18%	0.181	C	C	.	.			trans	-67.4	147.6	172.3	-72.2	176.3	0	0	0	111	D150 I408 F494	D150-L403 WeakPolarHBondContact OD1-CD2 3.38Å; L403-I408 HydrophobicContact CB-CD1 4.02Å; L403-I408 HydrophobicContact CB-CG1 3.91Å; L403-I408 HydrophobicContact CD1-CG1 4.47Å; L403-F494 HydrophobicContact CD1-CD1 4.46Å; L403-F494 HydrophobicContact CD1-CE1 4.21Å
404	S	80	Confident	82.5	Confident	43 Å²	43	37.8 Å²	37.8	30%	0.301	19%	0.185	S	C	.	.			trans	-62.5	143.8	172.6	64.5	0	0	0	0	110	D177 R406 R407 I408	D177-S404 WeakPolarHBondContact OD2-CB 3.4Å; D177-S404 PolarHBondContact OD2-OG 3.32Å; S404-R406 PolarHBondContact O-N 2.96Å; S404-R407 PolarHBondContact O-N 3.14Å; S404-R407 WeakPolarHBondContact OG-CB 3.13Å; S404-R407 PolarHBondContact OG-N 3.22Å; S404-I408 WeakPolarHBondContact O-CG1 2.91Å; S404-I408 PolarHBondContact O-N 3.31Å
405	Q	82.4	Confident	80.6	Confident	107 Å²	107	40.4 Å²	40.4	50%	0.5	21%	0.212	S	C	.	.	H	α-helix	trans	-59.2	-40.6	178	-65.8	-173.3	3.7	0	0	111.3	R407 I408 E409 M435	Q405-R407 VanDerWaalsContact C-N 3.32Å; Q405-R407 PolarHBondContact O-N 2.97Å; Q405-I408 PolarHBondContact O-N 3.24Å; Q405-E409 WeakPolarHBondContact O-CG 3.11Å; Q405-E409 PolarHBondContact O-N 3.3Å; Q405-M435 HydrophobicContact CG-CE 4.35Å; Q405-M435 HydrophobicContact CG-SD 4.39Å
406	R	78.7	Confident	78.6	Confident	136 Å²	136	39.8 Å²	39.8	51%	0.513	21%	0.213	S	C	.	.	H	α-helix	trans	-55.4	-45.1	176.3	-75.5	165.9	163.8	-166.2	1.8	112	R223 S404 R410	R223-R406 VanDerWaalsContact NH2-CD 3.31Å; S404-R406 PolarHBondContact O-N 2.96Å; R406-R410 WeakPolarHBondContact O-CB 3.32Å; R406-R410 PolarHBondContact O-N 2.86Å
407	R	84.1	Confident	76.7	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-64.4	-43.4	177.6	-176.1	169.8	176.6	166.7	7.1	112.6	V147 C149 D150 D177 S404 Q405 R410 L411	V147-R407 PolarHBondContact O-NH2 3.12Å; C149-R407 PolarHBondContact O-NH1 3.36Å; C149-R407 PolarHBondContact O-NH2 3.44Å; D150-R407 VanDerWaalsContact CA-NH1 3.31Å; D150-R407 PolarHBondContact O-NH1 3.03Å; D150-R407 IonicContact OD1-NH1 3.71Å; D177-R407 HydrophobicContact CB-CB 4.09Å; S404-R407 PolarHBondContact O-N 3.14Å; S404-R407 WeakPolarHBondContact OG-CB 3.13Å; S404-R407 PolarHBondContact OG-N 3.22Å; Q405-R407 VanDerWaalsContact C-N 3.32Å; Q405-R407 PolarHBondContact O-N 2.97Å; R407-R410 PolarHBondContact O-N 3.31Å; R407-L411 HydrophobicContact CG-CD1 4.08Å; R407-L411 HydrophobicContact CG-CG 4.35Å; R407-L411 WeakPolarHBondContact O-CB 3.4Å; R407-L411 VanDerWaalsContact O-CG 3.3Å; R407-L411 WeakPolarHBondContact O-CG 3.3Å; R407-L411 PolarHBondContact O-N 2.85Å
408	I	83.6	Confident	75	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.9	-45.8	-179.9	-61.6	167.5	0	0	0	110.4	L403 S404 Q405 R410 L411 L412 K431 I434 M435	L403-I408 HydrophobicContact CB-CD1 4.02Å; L403-I408 HydrophobicContact CB-CG1 3.91Å; L403-I408 HydrophobicContact CD1-CG1 4.47Å; S404-I408 WeakPolarHBondContact O-CG1 2.91Å; S404-I408 PolarHBondContact O-N 3.31Å; Q405-I408 PolarHBondContact O-N 3.24Å; I408-R410 VanDerWaalsContact C-N 3.3Å; I408-R410 PolarHBondContact O-N 2.75Å; I408-L411 PolarHBondContact O-N 3.27Å; I408-L412 HydrophobicContact CG2-CD1 3.8Å; I408-L412 HydrophobicContact CG2-CG 4.34Å; I408-L412 WeakPolarHBondContact O-CB 3.37Å; I408-L412 WeakPolarHBondContact O-CG 3.38Å; I408-L412 PolarHBondContact O-N 3.04Å; I408-K431 HydrophobicContact CG2-CB 4.47Å; I408-K431 HydrophobicContact CG2-CG 4.06Å; I408-I434 HydrophobicContact CD1-CG2 4.46Å; I408-I434 HydrophobicContact CG1-CG2 4.11Å; I408-I434 HydrophobicContact CG2-CB 4.2Å; I408-I434 HydrophobicContact CG2-CG2 4.05Å; I408-M435 VanDerWaalsContact CD1-CA 3.49Å; I408-M435 HydrophobicContact CD1-CB 3.54Å; I408-M435 HydrophobicContact CD1-CG 3.91Å
409	E	80.9	Confident	73.7	Confident	60 Å²	60	41.4 Å²	41.4	28%	0.28	23%	0.234	S	C	.	.	H	α-helix	trans	-57.8	-45.6	176.5	-71.4	179.4	-176.8	0	0	110.9	Q405 L412 C413 F420 K431	Q405-E409 WeakPolarHBondContact O-CG 3.11Å; Q405-E409 PolarHBondContact O-N 3.3Å; E409-L412 PolarHBondContact O-N 2.61Å; E409-C413 VanDerWaalsContact O-CB 3.29Å; E409-C413 WeakPolarHBondContact O-CB 3.14Å; E409-C413 PolarHBondContact O-N 3.04Å; E409-C413 PolarHBondContact O-SG 2.88Å; E409-F420 HydrophobicContact CB-CB 3.99Å; E409-F420 HydrophobicContact CB-CD2 4.24Å; E409-F420 HydrophobicContact CB-CG 4.28Å; E409-F420 HydrophobicContact CG-CB 3.78Å; E409-F420 HydrophobicContact CG-CD1 4.25Å; E409-F420 HydrophobicContact CG-CD2 3.75Å; E409-F420 HydrophobicContact CG-CE2 4.43Å; E409-F420 HydrophobicContact CG-CG 3.66Å; E409-K431 IonicContact OE1-NZ 3.93Å; E409-K431 PolarHBondContact OE1-NZ 2.8Å
410	R	78.2	Confident	72.6	Confident	63 Å²	63	41.7 Å²	41.7	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-64.3	-41.3	177	-169.1	-173.9	66.7	83.5	11.1	113.2	K175 E176 R406 R407 I408	K175-R410 WeakPolarHBondContact O-CD 3.41Å; K175-R410 VanDerWaalsContact O-CZ 3.32Å; K175-R410 PolarHBondContact O-NE 2.87Å; K175-R410 PolarHBondContact O-NH1 3.46Å; E176-R410 VanDerWaalsContact CA-CZ 3.43Å; E176-R410 VanDerWaalsContact CA-NH2 3.26Å; E176-R410 VanDerWaalsContact CD-NH2 3.29Å; E176-R410 PolarHBondContact O-NH2 3.46Å; E176-R410 IonicContact OE1-CZ 2.76Å; E176-R410 IonicContact OE1-NH1 3.65Å; E176-R410 PolarHBondContact OE1-NH1 3.25Å; E176-R410 IonicContact OE1-NH2 2.58Å; E176-R410 IonicContact OE2-CZ 2.7Å; E176-R410 IonicContact OE2-NH1 3.85Å; E176-R410 PolarHBondContact OE2-NH1 3.43Å; E176-R410 IonicContact OE2-NH2 3.77Å; E176-R410 PolarHBondContact OE2-NH2 3.2Å; R406-R410 WeakPolarHBondContact O-CB 3.32Å; R406-R410 PolarHBondContact O-N 2.86Å; R407-R410 PolarHBondContact O-N 3.31Å; I408-R410 VanDerWaalsContact C-N 3.3Å; I408-R410 PolarHBondContact O-N 2.75Å
411	L	81.6	Confident	71.5	Confident	3 Å²	3	52 Å²	52	2%	0.016	27%	0.272	C	S	.	.	H	α-helix	trans	-62.5	-44.2	176.3	-74.6	172.6	0	0	0	111.1	V147 R407 I408 F494 L573 C574	V147-L411 HydrophobicContact CG1-CD2 4.26Å; R407-L411 HydrophobicContact CG-CD1 4.08Å; R407-L411 HydrophobicContact CG-CG 4.35Å; R407-L411 WeakPolarHBondContact O-CB 3.4Å; R407-L411 VanDerWaalsContact O-CG 3.3Å; R407-L411 WeakPolarHBondContact O-CG 3.3Å; R407-L411 PolarHBondContact O-N 2.85Å; I408-L411 PolarHBondContact O-N 3.27Å; L411-F494 HydrophobicContact CD1-CE1 3.81Å; L411-F494 HydrophobicContact CD1-CZ 3.89Å; L411-L573 HydrophobicContact CB-CD2 4.48Å; L411-L573 WeakPolarHBondContact O-CA 3.11Å; L411-C574 HydrophobicContact CD2-CB 4.22Å; L411-C574 PolarHBondContact O-N 2.87Å; L411-C574 VanDerWaalsContact O-N 3.16Å
412	L	79.2	Confident	70.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-72.1	-33.9	179.9	-74.1	172.8	0	0	0	113.6	I408 E409 G414 F420 L423 K431 I434 P571 L573	I408-L412 HydrophobicContact CG2-CD1 3.8Å; I408-L412 HydrophobicContact CG2-CG 4.34Å; I408-L412 WeakPolarHBondContact O-CB 3.37Å; I408-L412 WeakPolarHBondContact O-CG 3.38Å; I408-L412 PolarHBondContact O-N 3.04Å; E409-L412 PolarHBondContact O-N 2.61Å; L412-G414 PolarHBondContact O-N 2.77Å; L412-F420 HydrophobicContact CD1-CD2 4.34Å; L412-F420 HydrophobicContact CD1-CE2 3.79Å; L412-L423 HydrophobicContact CB-CD1 3.8Å; L412-K431 HydrophobicContact CD1-CB 4.36Å; L412-I434 HydrophobicContact CD1-CD1 4.26Å; L412-I434 HydrophobicContact CD2-CD1 3.66Å; L412-I434 HydrophobicContact CG-CD1 4.07Å; L412-P571 HydrophobicContact CB-CG 4.42Å; L412-P571 HydrophobicContact CD2-CG 3.74Å; L412-L573 HydrophobicContact CD2-CD2 4Å
413	C	67	Low	69.9	Low	14 Å²	14	46.1 Å²	46.1	10%	0.095	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-8	179.9	-67.5	0	0	0	0	113.7	E409 G415 S416 A417 S419 F420	E409-C413 VanDerWaalsContact O-CB 3.29Å; E409-C413 WeakPolarHBondContact O-CB 3.14Å; E409-C413 PolarHBondContact O-N 3.04Å; E409-C413 PolarHBondContact O-SG 2.88Å; C413-G415 PolarHBondContact O-N 2.98Å; C413-S416 PolarHBondContact O-N 2.86Å; C413-A417 HydrophobicContact CB-CB 4.16Å; C413-A417 WeakPolarHBondContact CB-O 3.46Å; C413-A417 PolarHBondContact O-N 2.83Å; C413-S419 VanDerWaalsContact SG-C 3.54Å; C413-F420 WeakPolarHBondContact SG-CA 3.34Å; C413-F420 PolarHBondContact SG-N 3.24Å
414	G	57.5	Low	69.4	Low	8 Å²	8	46.6 Å²	46.6	8%	0.082	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.9	49.5	157.4	0	0	0	0	0	116.5	L412 S416 S572	L412-G414 PolarHBondContact O-N 2.77Å; G414-S416 WeakPolarHBondContact O-CB 3.4Å; G414-S416 PolarHBondContact O-N 3.07Å; G414-S572 WeakPolarHBondContact CA-O 3.48Å
415	G	52.7	Low	69.3	Low	62 Å²	62	49.8 Å²	49.8	64%	0.639	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.9	-12.4	174.9	0	0	0	0	0	117.7	C413	C413-G415 PolarHBondContact O-N 2.98Å
416	S	47.9	Very low	69	Low	53 Å²	53	46.7 Å²	46.7	37%	0.371	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-36.1	-168.1	-82	0	0	0	0	112.1	C413 G414 P736	C413-S416 PolarHBondContact O-N 2.86Å; G414-S416 WeakPolarHBondContact O-CB 3.4Å; G414-S416 PolarHBondContact O-N 3.07Å; S416-P736 VanDerWaalsContact CB-CG 3.47Å
417	A	49.7	Very low	68.9	Low	12 Å²	12	40.2 Å²	40.2	10%	0.099	24%	0.237	C	C	.	.			trans	-95	129.7	171.8	0	0	0	0	0	109.8	C413 S419 L423	C413-A417 HydrophobicContact CB-CB 4.16Å; C413-A417 WeakPolarHBondContact CB-O 3.46Å; C413-A417 PolarHBondContact O-N 2.83Å; A417-S419 VanDerWaalsContact C-N 3.29Å; A417-L423 HydrophobicContact CB-CD2 4.27Å
418	S	55.4	Low	68.8	Low	79 Å²	79	43.3 Å²	43.3	55%	0.552	25%	0.251	S	S	*	.	S	Bend	trans	-74.6	-20.2	174.7	41.7	0	0	0	0	112.7	Q744	S418-Q744 PolarHBondContact OG-OE1 2.98Å
419	S	61.7	Low	68.8	Low	44 Å²	44	45.7 Å²	45.7	31%	0.308	27%	0.271	S	S	.	.			trans	-148.1	140.1	-173.6	-170.5	0	0	0	0	112.8	C413 A417 R421 L422	C413-S419 VanDerWaalsContact SG-C 3.54Å; A417-S419 VanDerWaalsContact C-N 3.29Å; S419-R421 PolarHBondContact O-N 2.94Å; S419-L422 WeakPolarHBondContact O-CB 3.38Å; S419-L422 PolarHBondContact O-N 3.07Å; S419-L422 VanDerWaalsContact O-N 3.14Å
420	F	67.3	Low	69	Low	28 Å²	28	43.4 Å²	43.4	12%	0.123	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-58.5	-30.6	176.6	175.6	-99.4	0	0	0	113.1	E409 L412 C413 L422 L423 Q428 K431	E409-F420 HydrophobicContact CB-CB 3.99Å; E409-F420 HydrophobicContact CB-CD2 4.24Å; E409-F420 HydrophobicContact CB-CG 4.28Å; E409-F420 HydrophobicContact CG-CB 3.78Å; E409-F420 HydrophobicContact CG-CD1 4.25Å; E409-F420 HydrophobicContact CG-CD2 3.75Å; E409-F420 HydrophobicContact CG-CE2 4.43Å; E409-F420 HydrophobicContact CG-CG 3.66Å; L412-F420 HydrophobicContact CD1-CD2 4.34Å; L412-F420 HydrophobicContact CD1-CE2 3.79Å; C413-F420 WeakPolarHBondContact SG-CA 3.34Å; C413-F420 PolarHBondContact SG-N 3.24Å; F420-L422 PolarHBondContact O-N 3.44Å; F420-L423 HydrophobicContact CD2-CD1 3.7Å; F420-L423 HydrophobicContact CE2-CD1 4.12Å; F420-L423 WeakPolarHBondContact O-CB 3.31Å; F420-L423 PolarHBondContact O-N 2.72Å; F420-L423 VanDerWaalsContact O-N 3.14Å; F420-Q428 HydrophobicContact CE1-CB 4.26Å; F420-Q428 HydrophobicContact CE1-CG 4.02Å; F420-Q428 HydrophobicContact CE2-CG 4.39Å; F420-Q428 HydrophobicContact CZ-CB 3.84Å; F420-Q428 HydrophobicContact CZ-CG 3.87Å; F420-K431 HydrophobicContact CE1-CD 3.92Å; F420-K431 HydrophobicContact CE2-CB 4.07Å; F420-K431 HydrophobicContact CE2-CD 3.97Å; F420-K431 HydrophobicContact CE2-CG 4.48Å; F420-K431 HydrophobicContact CZ-CB 3.84Å; F420-K431 HydrophobicContact CZ-CD 3.48Å; F420-K431 VanDerWaalsContact CZ-CD 3.48Å; F420-K431 HydrophobicContact CZ-CG 4.24Å
421	R	66.2	Low	69.3	Low	216 Å²	216	42.1 Å²	42.1	82%	0.815	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-64.8	-20.1	-179.7	-63	-175.6	-177.2	176.7	1.8	113.4	S419 Q428	S419-R421 PolarHBondContact O-N 2.94Å; R421-Q428 PolarHBondContact O-NE2 3.37Å
422	L	64.8	Low	69.5	Low	27 Å²	27	45.1 Å²	45.1	14%	0.141	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-82.1	-15.1	177.8	-75.6	176.2	0	0	0	114.1	S419 F420 D741 Q744	S419-L422 WeakPolarHBondContact O-CB 3.38Å; S419-L422 PolarHBondContact O-N 3.07Å; S419-L422 VanDerWaalsContact O-N 3.14Å; F420-L422 PolarHBondContact O-N 3.44Å; L422-D741 HydrophobicContact CD2-CB 3.73Å; L422-Q744 HydrophobicContact CD1-CG 4.48Å; L422-Q744 HydrophobicContact CD2-CG 4.27Å; L422-Q744 VanDerWaalsContact CG-NE2 3.28Å
423	L	67.8	Low	69.9	Low	5 Å²	5	48.2 Å²	48.2	3%	0.026	29%	0.29	C	S	.	.	S	Bend	trans	-67.5	152.8	-179.4	-64	176.5	0	0	0	110	L412 A417 F420 A427 Q428 P571	L412-L423 HydrophobicContact CB-CD1 3.8Å; A417-L423 HydrophobicContact CB-CD2 4.27Å; F420-L423 HydrophobicContact CD2-CD1 3.7Å; F420-L423 HydrophobicContact CE2-CD1 4.12Å; F420-L423 WeakPolarHBondContact O-CB 3.31Å; F420-L423 PolarHBondContact O-N 2.72Å; F420-L423 VanDerWaalsContact O-N 3.14Å; L423-A427 HydrophobicContact CB-CB 3.98Å; L423-Q428 HydrophobicContact CB-CG 4.05Å; L423-Q428 PolarHBondContact O-NE2 3.24Å; L423-P571 HydrophobicContact CD2-CB 4.4Å
424	S	71.1	Confident	70.8	Confident	15 Å²	15	47.7 Å²	47.7	11%	0.105	29%	0.286	C	S	.	.			trans	-56.2	150.7	175.5	74.9	0	0	0	0	110.9	A426 A427 Q428 G513	S424-A426 PolarHBondContact O-N 2.95Å; S424-A426 VanDerWaalsContact O-N 3.13Å; S424-A427 WeakPolarHBondContact O-CA 3.11Å; S424-A427 WeakPolarHBondContact O-CB 3.1Å; S424-A427 PolarHBondContact O-N 2.88Å; S424-A427 WeakPolarHBondContact OG-CB 3.28Å; S424-A427 PolarHBondContact OG-N 3.16Å; S424-Q428 WeakPolarHBondContact O-CG 3.3Å; S424-Q428 PolarHBondContact O-N 2.99Å; S424-G513 WeakPolarHBondContact CB-O 3.46Å; S424-G513 PolarHBondContact OG-O 3.11Å
425	P	76.6	Confident	72.1	Confident	111 Å²	111	50.1 Å²	50.1	72%	0.721	30%	0.296	S	S	*	.	H	α-helix	trans	-53.9	-34.6	176.2	-27.9	35.4	0	0	0	113	Q428 A429	P425-Q428 PolarHBondContact O-N 3.02Å; P425-A429 PolarHBondContact O-N 3Å
426	A	77	Confident	73.5	Confident	42 Å²	42	51.8 Å²	51.8	35%	0.347	29%	0.29	S	S	.	.	H	α-helix	trans	-65.5	-44.6	174.2	0	0	0	0	0	112.2	S424 A429 D569	S424-A426 PolarHBondContact O-N 2.95Å; S424-A426 VanDerWaalsContact O-N 3.13Å; A426-A429 WeakPolarHBondContact O-CB 3.47Å; A426-A429 PolarHBondContact O-N 3.01Å; A426-D569 HydrophobicContact CB-CB 3.95Å
427	A	77.5	Confident	75.3	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-65.3	-37.7	174.8	0	0	0	0	0	112.4	L423 S424 A429 L430 P571	L423-A427 HydrophobicContact CB-CB 3.98Å; S424-A427 WeakPolarHBondContact O-CA 3.11Å; S424-A427 WeakPolarHBondContact O-CB 3.1Å; S424-A427 PolarHBondContact O-N 2.88Å; S424-A427 WeakPolarHBondContact OG-CB 3.28Å; S424-A427 PolarHBondContact OG-N 3.16Å; A427-A429 VanDerWaalsContact C-N 3.28Å; A427-A429 PolarHBondContact O-N 3.23Å; A427-L430 VanDerWaalsContact O-CB 3.31Å; A427-L430 WeakPolarHBondContact O-CB 3.48Å; A427-L430 PolarHBondContact O-N 3.34Å; A427-L430 VanDerWaalsContact O-N 3.12Å; A427-P571 HydrophobicContact CB-CG 4.14Å
428	Q	80.3	Confident	76.9	Confident	67 Å²	67	50.7 Å²	50.7	31%	0.313	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-35	174.4	-66.7	-177.2	29.3	0	0	111.8	F420 R421 L423 S424 P425 L430 K431	F420-Q428 HydrophobicContact CE1-CB 4.26Å; F420-Q428 HydrophobicContact CE1-CG 4.02Å; F420-Q428 HydrophobicContact CE2-CG 4.39Å; F420-Q428 HydrophobicContact CZ-CB 3.84Å; F420-Q428 HydrophobicContact CZ-CG 3.87Å; R421-Q428 PolarHBondContact O-NE2 3.37Å; L423-Q428 HydrophobicContact CB-CG 4.05Å; L423-Q428 PolarHBondContact O-NE2 3.24Å; S424-Q428 WeakPolarHBondContact O-CG 3.3Å; S424-Q428 PolarHBondContact O-N 2.99Å; P425-Q428 PolarHBondContact O-N 3.02Å; Q428-L430 PolarHBondContact O-N 2.87Å; Q428-K431 VanDerWaalsContact O-CB 3.31Å; Q428-K431 WeakPolarHBondContact O-CB 3.25Å; Q428-K431 PolarHBondContact O-N 3.36Å; Q428-K431 VanDerWaalsContact O-N 3.16Å
429	A	84.9	Confident	78.1	Confident	50 Å²	50	49.4 Å²	49.4	41%	0.413	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.6	175.2	0	0	0	0	0	113.6	P425 A426 A427 K431 P432 F433	P425-A429 PolarHBondContact O-N 3Å; A426-A429 WeakPolarHBondContact O-CB 3.47Å; A426-A429 PolarHBondContact O-N 3.01Å; A427-A429 VanDerWaalsContact C-N 3.28Å; A427-A429 PolarHBondContact O-N 3.23Å; A429-K431 VanDerWaalsContact C-N 3.35Å; A429-P432 VanDerWaalsContact O-CD 3.27Å; A429-P432 WeakPolarHBondContact O-CD 3.44Å; A429-P432 WeakPolarHBondContact O-CG 3.42Å; A429-F433 WeakPolarHBondContact O-CD2 3.37Å; A429-F433 WeakPolarHBondContact O-CE2 3.38Å
430	L	84.8	Confident	79.1	Confident	11 Å²	11	50.5 Å²	50.5	6%	0.058	28%	0.281	C	S	.	.	H	α-helix	trans	-73.8	-24.1	173.7	-60.2	177.1	0	0	0	113.6	A427 Q428 F433 I434 P443 I445 C570	A427-L430 VanDerWaalsContact O-CB 3.31Å; A427-L430 WeakPolarHBondContact O-CB 3.48Å; A427-L430 PolarHBondContact O-N 3.34Å; A427-L430 VanDerWaalsContact O-N 3.12Å; Q428-L430 PolarHBondContact O-N 2.87Å; L430-F433 HydrophobicContact CD2-CD2 4.42Å; L430-F433 PolarHBondContact O-N 2.92Å; L430-F433 VanDerWaalsContact O-N 3.13Å; L430-I434 HydrophobicContact CB-CD1 4.41Å; L430-I434 WeakPolarHBondContact O-CG1 3.48Å; L430-I434 PolarHBondContact O-N 2.88Å; L430-P443 HydrophobicContact CD2-CG 3.51Å; L430-I445 HydrophobicContact CD1-CD1 4.04Å; L430-I445 HydrophobicContact CD2-CD1 4.21Å; L430-C570 HydrophobicContact CD1-CB 4.09Å
431	K	85	Confident	79.8	Confident	36 Å²	36	57 Å²	57	16%	0.157	32%	0.317	C	S	.	.	H	α-helix	trans	-51.6	-52.9	-179.2	-179.1	174.6	174.6	-179.5	0	113.4	I408 E409 L412 F420 Q428 A429 F433 I434 M435	I408-K431 HydrophobicContact CG2-CB 4.47Å; I408-K431 HydrophobicContact CG2-CG 4.06Å; E409-K431 IonicContact OE1-NZ 3.93Å; E409-K431 PolarHBondContact OE1-NZ 2.8Å; L412-K431 HydrophobicContact CD1-CB 4.36Å; F420-K431 HydrophobicContact CE1-CD 3.92Å; F420-K431 HydrophobicContact CE2-CB 4.07Å; F420-K431 HydrophobicContact CE2-CD 3.97Å; F420-K431 HydrophobicContact CE2-CG 4.48Å; F420-K431 HydrophobicContact CZ-CB 3.84Å; F420-K431 HydrophobicContact CZ-CD 3.48Å; F420-K431 VanDerWaalsContact CZ-CD 3.48Å; F420-K431 HydrophobicContact CZ-CG 4.24Å; Q428-K431 VanDerWaalsContact O-CB 3.31Å; Q428-K431 WeakPolarHBondContact O-CB 3.25Å; Q428-K431 PolarHBondContact O-N 3.36Å; Q428-K431 VanDerWaalsContact O-N 3.16Å; A429-K431 VanDerWaalsContact C-N 3.35Å; K431-F433 VanDerWaalsContact C-N 3.32Å; K431-F433 PolarHBondContact O-N 3.24Å; K431-I434 PolarHBondContact O-N 3.41Å; K431-M435 VanDerWaalsContact O-CB 3.32Å; K431-M435 WeakPolarHBondContact O-CB 3.49Å; K431-M435 PolarHBondContact O-N 3.03Å
432	P	85.4	Confident	80.7	Confident	66 Å²	66	47.5 Å²	47.5	43%	0.429	28%	0.284	S	S	.	.	H	α-helix	trans	-64	-34.6	178.7	24.5	-35.7	0	0	0	113.3	A429 M435 N436	A429-P432 VanDerWaalsContact O-CD 3.27Å; A429-P432 WeakPolarHBondContact O-CD 3.44Å; A429-P432 WeakPolarHBondContact O-CG 3.42Å; P432-M435 PolarHBondContact O-N 3.03Å; P432-N436 PolarHBondContact O-N 2.96Å; P432-N436 VanDerWaalsContact O-N 3.13Å; P432-N436 PolarHBondContact O-ND2 3.19Å
433	F	86.6	Confident	81.9	Confident	66 Å²	66	47.4 Å²	47.4	29%	0.289	29%	0.285	S	S	.	.	H	α-helix	trans	-66.4	-45.1	178.4	-64	-62.3	0	0	0	111.6	A429 L430 K431 C437 T438 A442 T495	A429-F433 WeakPolarHBondContact O-CD2 3.37Å; A429-F433 WeakPolarHBondContact O-CE2 3.38Å; L430-F433 HydrophobicContact CD2-CD2 4.42Å; L430-F433 PolarHBondContact O-N 2.92Å; L430-F433 VanDerWaalsContact O-N 3.13Å; K431-F433 VanDerWaalsContact C-N 3.32Å; K431-F433 PolarHBondContact O-N 3.24Å; F433-C437 WeakPolarHBondContact O-CA 3.38Å; F433-C437 PolarHBondContact O-N 3.39Å; F433-T438 HydrophobicContact CD1-CG2 4Å; F433-T438 PolarHBondContact O-N 2.54Å; F433-A442 HydrophobicContact CB-CB 4.33Å; F433-A442 HydrophobicContact CD1-CB 3.74Å; F433-A442 HydrophobicContact CE1-CB 4.26Å; F433-A442 HydrophobicContact CG-CB 4.12Å; F433-T495 VanDerWaalsContact C-CG2 3.47Å; F433-T495 HydrophobicContact CB-CG2 4.01Å; F433-T495 WeakPolarHBondContact O-CG2 3.47Å
434	I	85.6	Confident	83.1	Confident	3 Å²	3	47.6 Å²	47.6	2%	0.015	29%	0.287	C	S	.	.	H	α-helix	trans	-65.8	-42.5	176.3	-64.4	170.7	0	0	0	110.3	I408 L412 L430 K431 N436 C437 I445 F494 T495	I408-I434 HydrophobicContact CD1-CG2 4.46Å; I408-I434 HydrophobicContact CG1-CG2 4.11Å; I408-I434 HydrophobicContact CG2-CB 4.2Å; I408-I434 HydrophobicContact CG2-CG2 4.05Å; L412-I434 HydrophobicContact CD1-CD1 4.26Å; L412-I434 HydrophobicContact CD2-CD1 3.66Å; L412-I434 HydrophobicContact CG-CD1 4.07Å; L430-I434 HydrophobicContact CB-CD1 4.41Å; L430-I434 WeakPolarHBondContact O-CG1 3.48Å; L430-I434 PolarHBondContact O-N 2.88Å; K431-I434 PolarHBondContact O-N 3.41Å; I434-N436 VanDerWaalsContact C-N 3.29Å; I434-N436 PolarHBondContact O-N 3.33Å; I434-C437 PolarHBondContact O-N 3.21Å; I434-I445 HydrophobicContact CD1-CD1 4.45Å; I434-F494 HydrophobicContact CG2-CD1 4.14Å; I434-T495 HydrophobicContact CB-CG2 4.25Å; I434-T495 HydrophobicContact CG1-CG2 3.69Å
435	M	84.9	Confident	84.1	Confident	59 Å²	59	46.9 Å²	46.9	29%	0.291	28%	0.282	S	S	.	.	H	α-helix	trans	-57.2	-44	-179.3	-171.6	171.8	178.8	0	0	112	G401 Q405 I408 K431 P432	G401-M435 CarbonylContact C-O 3.39Å; Q405-M435 HydrophobicContact CG-CE 4.35Å; Q405-M435 HydrophobicContact CG-SD 4.39Å; I408-M435 VanDerWaalsContact CD1-CA 3.49Å; I408-M435 HydrophobicContact CD1-CB 3.54Å; I408-M435 HydrophobicContact CD1-CG 3.91Å; K431-M435 VanDerWaalsContact O-CB 3.32Å; K431-M435 WeakPolarHBondContact O-CB 3.49Å; K431-M435 PolarHBondContact O-N 3.03Å; P432-M435 PolarHBondContact O-N 3.03Å
436	N	83.5	Confident	84.9	Confident	98 Å²	98	41.6 Å²	41.6	52%	0.524	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	1.7	-176.9	-65.9	-31	0	0	0	113.7	P432 I434 T438	P432-N436 PolarHBondContact O-N 2.96Å; P432-N436 VanDerWaalsContact O-N 3.13Å; P432-N436 PolarHBondContact O-ND2 3.19Å; I434-N436 VanDerWaalsContact C-N 3.29Å; I434-N436 PolarHBondContact O-N 3.33Å; N436-T438 PolarHBondContact O-N 2.69Å
437	C	84.7	Confident	85.6	Confident	2 Å²	2	39.7 Å²	39.7	1%	0.014	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	48.2	-170.5	-75.5	0	0	0	0	111.8	P55 A400 F433 I434 V439 A545	P55-C437 HydrophobicContact CB-CB 3.84Å; P55-C437 HydrophobicContact CG-CB 4.03Å; A400-C437 PolarHBondContact O-SG 2.88Å; F433-C437 WeakPolarHBondContact O-CA 3.38Å; F433-C437 PolarHBondContact O-N 3.39Å; I434-C437 PolarHBondContact O-N 3.21Å; C437-V439 PolarHBondContact O-N 3Å; C437-A545 HydrophobicContact CB-CB 3.91Å
438	T	84	Confident	86.3	Confident	39 Å²	39	39.7 Å²	39.7	24%	0.239	23%	0.231	C	C	.	.			trans	-62.8	129	-174.6	-54.6	0	0	0	0	110.7	F433 N436 A440 A442 G496	F433-T438 HydrophobicContact CD1-CG2 4Å; F433-T438 PolarHBondContact O-N 2.54Å; N436-T438 PolarHBondContact O-N 2.69Å; T438-A440 VanDerWaalsContact CG2-O 3.23Å; T438-A440 WeakPolarHBondContact CG2-O 3.23Å; T438-A442 HydrophobicContact CG2-CB 3.94Å; T438-G496 PolarHBondContact O-N 3.43Å
439	V	81.4	Confident	86.8	Confident	52 Å²	52	36.5 Å²	36.5	32%	0.315	22%	0.216	S	C	.	.			trans	-97.6	-46.5	-177.1	-177.9	0	0	0	0	112.1	C437 K497 C544 A545	C437-V439 PolarHBondContact O-N 3Å; V439-K497 HydrophobicContact CG1-CB 3.99Å; V439-C544 HydrophobicContact CG2-CB 4.42Å; V439-A545 HydrophobicContact CG2-CB 4.2Å
440	A	82.1	Confident	87	Confident	68 Å²	68	34.4 Å²	34.4	56%	0.562	20%	0.198	S	C	*	.	S	Bend	trans	-88	145.1	179.3	0	0	0	0	0	111	T438 A442	T438-A440 VanDerWaalsContact CG2-O 3.23Å; T438-A440 WeakPolarHBondContact CG2-O 3.23Å; A440-A442 PolarHBondContact O-N 3.11Å
441	D	81.4	Confident	87.2	Confident	165 Å²	165	33.9 Å²	33.9	88%	0.882	20%	0.195	S	C	*	.	S	Bend	trans	56.7	18.6	176.9	-51	-37.3	0	0	0	115.6
442	A	85.4	Confident	87.3	Confident	16 Å²	16	32.2 Å²	32.2	13%	0.132	19%	0.188	C	C	.	.	S	Bend	trans	-116.1	146.3	177.6	0	0	0	0	0	110.9	F433 T438 A440	F433-A442 HydrophobicContact CB-CB 4.33Å; F433-A442 HydrophobicContact CD1-CB 3.74Å; F433-A442 HydrophobicContact CE1-CB 4.26Å; F433-A442 HydrophobicContact CG-CB 4.12Å; T438-A442 HydrophobicContact CG2-CB 3.94Å; A440-A442 PolarHBondContact O-N 3.11Å
443	P	89.4	Confident	87.4	Confident	24 Å²	24	29.5 Å²	29.5	16%	0.156	17%	0.17	C	C	.	.			trans	-61.6	140.5	171.2	26.2	-32.4	0	0	0	109.9	L430 I445 T495 T566	L430-P443 HydrophobicContact CD2-CG 3.51Å; P443-I445 HydrophobicContact CG-CD1 4.46Å; P443-I445 PolarHBondContact O-N 3.41Å; P443-T495 VanDerWaalsContact O-CB 3.31Å; P443-T495 WeakPolarHBondContact O-CB 3.46Å; P443-T495 PolarHBondContact O-OG1 2.87Å; P443-T566 VanDerWaalsContact CA-OG1 3.26Å; P443-T566 WeakPolarHBondContact CA-OG1 3.33Å; P443-T566 WeakPolarHBondContact CB-OG1 3.39Å
444	T	92.9	Very high	87.3	Confident	9 Å²	9	26.5 Å²	26.5	6%	0.055	16%	0.157	C	C	.	.			trans	-80.5	113.9	176.1	-58.1	0	0	0	0	108.5	V446 V493 T495 K497 L498 S565 T566	T444-V446 HydrophobicContact CG2-CG2 4.16Å; T444-V493 HydrophobicContact CG2-CG1 4.47Å; T444-T495 VanDerWaalsContact CA-O 3.3Å; T444-T495 WeakPolarHBondContact CA-O 3.42Å; T444-K497 PolarHBondContact OG1-N 3.03Å; T444-L498 HydrophobicContact CG2-CB 4.5Å; T444-L498 HydrophobicContact CG2-CD1 4.46Å; T444-S565 VanDerWaalsContact O-CA 3.24Å; T444-S565 WeakPolarHBondContact O-CA 3.4Å; T444-T566 PolarHBondContact N-OG1 3.17Å; T444-T566 PolarHBondContact O-N 3.43Å; T444-T566 VanDerWaalsContact O-N 3.11Å
445	I	92.9	Very high	87.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.2	180	-58.6	169.2	0	0	0	108.5	L430 I434 P443 F494 T495 T563 L564 L573	L430-I445 HydrophobicContact CD1-CD1 4.04Å; L430-I445 HydrophobicContact CD2-CD1 4.21Å; I434-I445 HydrophobicContact CD1-CD1 4.45Å; P443-I445 HydrophobicContact CG-CD1 4.46Å; P443-I445 PolarHBondContact O-N 3.41Å; I445-F494 PolarHBondContact O-N 2.65Å; I445-T495 VanDerWaalsContact CB-OG1 3.3Å; I445-T495 WeakPolarHBondContact CB-OG1 3.29Å; I445-T495 VanDerWaalsContact CG1-OG1 3.3Å; I445-T495 WeakPolarHBondContact CG1-OG1 3.07Å; I445-T495 PolarHBondContact N-O 2.78Å; I445-T495 PolarHBondContact N-OG1 2.88Å; I445-T495 PolarHBondContact O-N 2.82Å; I445-T563 HydrophobicContact CG2-CG2 4.24Å; I445-L564 WeakPolarHBondContact CA-O 3.44Å; I445-L573 HydrophobicContact CG2-CD1 3.75Å
446	V	93.4	Very high	86.8	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.006	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.2	-179.7	-177.2	0	0	0	0	108.9	T444 A491 R492 V493 L498 L504 L564	T444-V446 HydrophobicContact CG2-CG2 4.16Å; V446-A491 HydrophobicContact CG1-CB 3.69Å; V446-R492 WeakPolarHBondContact CA-O 3.3Å; V446-V493 HydrophobicContact CG2-CG1 4.36Å; V446-V493 HydrophobicContact CG2-CG2 4.2Å; V446-L498 HydrophobicContact CG2-CD1 4.12Å; V446-L498 HydrophobicContact CG2-CD2 4.24Å; V446-L504 HydrophobicContact CG2-CD1 4.38Å; V446-L564 HydrophobicContact CB-CB 4.24Å; V446-L564 PolarHBondContact N-O 2.97Å; V446-L564 PolarHBondContact O-N 3.19Å
447	F	92.5	Very high	86.5	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.009	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.9	173.6	-175.2	-112.3	0	0	0	110.5	V147 L148 A491 R492 F494 L573 C574	V147-F447 HydrophobicContact CB-CE1 4.28Å; V147-F447 HydrophobicContact CG1-CD1 3.87Å; V147-F447 HydrophobicContact CG1-CE1 3.41Å; V147-F447 VanDerWaalsContact CG1-CE1 3.41Å; V147-F447 HydrophobicContact CG1-CZ 4.25Å; L148-F447 HydrophobicContact CD2-CD1 3.97Å; F447-A491 CarbonylContact O-C 3.54Å; F447-A491 WeakPolarHBondContact O-CA 3.33Å; F447-A491 VanDerWaalsContact O-CB 3.23Å; F447-A491 WeakPolarHBondContact O-CB 3.3Å; F447-R492 PolarHBondContact N-O 3.23Å; F447-R492 PolarHBondContact O-N 3.14Å; F447-F494 HydrophobicContact CB-CD2 4.06Å; F447-F494 HydrophobicContact CB-CE2 3.64Å; F447-L573 HydrophobicContact CB-CD1 3.93Å; F447-L573 HydrophobicContact CD2-CB 3.68Å; F447-L573 HydrophobicContact CD2-CD1 4.28Å; F447-L573 HydrophobicContact CE2-CB 4.04Å; F447-L573 HydrophobicContact CG-CB 4.39Å; F447-L573 HydrophobicContact CG-CD1 4.4Å; F447-C574 HydrophobicContact CZ-CB 4.26Å; F447-C574 WeakPolarHBondContact CZ-O 3.34Å
448	V	91.8	Very high	85.9	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	118.5	173.9	178.2	0	0	0	0	108.6	M451 A489 A491 I558 S561 A562 L564	V448-M451 HydrophobicContact CG1-SD 4.29Å; V448-A489 HydrophobicContact CB-CB 4.48Å; V448-A489 HydrophobicContact CG1-CB 3.64Å; V448-A489 HydrophobicContact CG2-CB 4Å; V448-A491 HydrophobicContact CB-CB 4.5Å; V448-A491 HydrophobicContact CG2-CB 3.97Å; V448-I558 HydrophobicContact CB-CD1 4.26Å; V448-I558 HydrophobicContact CG1-CD1 4.25Å; V448-I558 HydrophobicContact CG1-CG2 4.34Å; V448-I558 HydrophobicContact CG2-CD1 3.83Å; V448-S561 WeakPolarHBondContact O-CA 3.37Å; V448-S561 WeakPolarHBondContact O-CB 3.5Å; V448-A562 PolarHBondContact N-O 3.21Å; V448-A562 PolarHBondContact O-N 3.14Å; V448-A562 VanDerWaalsContact O-N 3.15Å; V448-L564 HydrophobicContact CG2-CD1 4.06Å; V448-L564 HydrophobicContact CG2-CG 4.35Å
449	S	89.7	Confident	85.3	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	-38.5	179.9	65.5	0	0	0	0	113.1	A144 L148 F490 L576	A144-S449 WeakPolarHBondContact O-CB 3.47Å; L148-S449 WeakPolarHBondContact CD1-OG 3.4Å; S449-F490 PolarHBondContact N-O 3.4Å; S449-F490 PolarHBondContact OG-O 3.42Å; S449-L576 WeakPolarHBondContact O-CD1 3.22Å
450	K	88.9	Confident	84.5	Confident	5 Å²	5	33.8 Å²	33.8	2%	0.022	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	160.3	-178.1	68.6	174.3	-168.6	170.4	0	111.4	S111 E141 A144 V452 F490	S111-K450 PolarHBondContact O-NZ 3.19Å; E141-K450 VanDerWaalsContact CD-NZ 3.26Å; E141-K450 IonicContact OE1-NZ 3.38Å; E141-K450 PolarHBondContact OE1-NZ 3.4Å; E141-K450 VanDerWaalsContact OE1-NZ 3.08Å; E141-K450 WeakPolarHBondContact OE2-CD 3.46Å; E141-K450 IonicContact OE2-NZ 2.78Å; E141-K450 PolarHBondContact OE2-NZ 2.75Å; A144-K450 HydrophobicContact CB-CB 4.39Å; A144-K450 HydrophobicContact CB-CD 4.41Å; K450-V452 HydrophobicContact CD-CG2 4.48Å; K450-V452 HydrophobicContact CG-CG2 4.28Å; K450-F490 HydrophobicContact CG-CB 4.11Å; K450-F490 HydrophobicContact CG-CD1 4.46Å; K450-F490 PolarHBondContact O-N 3Å
451	M	89.7	Confident	83.2	Confident	1 Å²	1	33 Å²	33	1%	0.005	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	140.1	167.5	-53.8	-65.5	-66.3	0	0	110.2	V448 F487 A489 V554 E555 I558 L608	V448-M451 HydrophobicContact CG1-SD 4.29Å; M451-F487 HydrophobicContact CB-CD1 3.96Å; M451-F487 HydrophobicContact CE-CB 3.99Å; M451-A489 HydrophobicContact CE-CB 4.15Å; M451-A489 HydrophobicContact SD-CB 3.62Å; M451-V554 HydrophobicContact CE-CG2 4.27Å; M451-E555 HydrophobicContact CE-CB 3.71Å; M451-I558 HydrophobicContact SD-CB 4.39Å; M451-I558 HydrophobicContact SD-CG2 4.19Å; M451-L608 WeakPolarHBondContact CB-O 3.32Å
452	V	88.3	Confident	81.2	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	116.7	-176.4	-178.6	0	0	0	0	107.9	K450 V454 V488 F490 M532	K450-V452 HydrophobicContact CD-CG2 4.48Å; K450-V452 HydrophobicContact CG-CG2 4.28Å; V452-V454 HydrophobicContact CG1-CG2 3.94Å; V452-V454 PolarHBondContact O-N 3.33Å; V452-V488 WeakPolarHBondContact CB-O 3.47Å; V452-V488 PolarHBondContact N-O 3.25Å; V452-V488 PolarHBondContact O-N 3.01Å; V452-F490 HydrophobicContact CG2-CB 3.83Å; V452-M532 HydrophobicContact CG1-CE 4.45Å; V452-M532 HydrophobicContact CG2-CE 4.39Å
453	P	87.6	Confident	79.2	Confident	8 Å²	8	32.3 Å²	32.3	5%	0.052	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	124.4	170.6	29.8	-34.6	0	0	0	108.8	K110 Y485 F487 A609 F644	K110-P453 PolarHBondContact NZ-O 2.93Å; P453-Y485 HydrophobicContact CB-CD1 4.24Å; P453-F487 HydrophobicContact CB-CE1 4.21Å; P453-F487 HydrophobicContact CB-CZ 4.13Å; P453-A609 HydrophobicContact CG-CB 4.09Å; P453-F644 HydrophobicContact CB-CE1 3.9Å; P453-F644 HydrophobicContact CB-CZ 4.02Å; P453-F644 HydrophobicContact CG-CE1 4.42Å; P453-F644 HydrophobicContact CG-CZ 4.02Å
454	V	83.6	Confident	77	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.018	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.5	179.4	-173.2	0	0	0	0	108.7	V452 S456 L458 L459 Y485 V486 V488 Y537	V452-V454 HydrophobicContact CG1-CG2 3.94Å; V452-V454 PolarHBondContact O-N 3.33Å; V454-S456 PolarHBondContact O-N 3.43Å; V454-L458 HydrophobicContact CG1-CB 3.99Å; V454-L458 HydrophobicContact CG1-CD1 4.34Å; V454-L459 HydrophobicContact CB-CD1 4.48Å; V454-L459 HydrophobicContact CB-CD2 4.48Å; V454-L459 HydrophobicContact CG1-CD1 4.41Å; V454-L459 HydrophobicContact CG1-CD2 3.85Å; V454-L459 HydrophobicContact CG1-CG 3.92Å; V454-Y485 CarbonylContact O-C 3.57Å; V454-Y485 WeakPolarHBondContact O-CA 3.34Å; V454-V486 PolarHBondContact N-O 3.1Å; V454-V486 PolarHBondContact O-N 3.39Å; V454-V488 HydrophobicContact CB-CG2 4.35Å; V454-V488 HydrophobicContact CG2-CB 4.3Å; V454-V488 HydrophobicContact CG2-CG2 3.91Å; V454-Y537 HydrophobicContact CB-CE2 4.48Å; V454-Y537 HydrophobicContact CG1-CD2 3.93Å; V454-Y537 HydrophobicContact CG1-CE2 3.59Å; V454-Y537 HydrophobicContact CG2-CE1 3.95Å; V454-Y537 HydrophobicContact CG2-CE2 3.99Å; V454-Y537 WeakPolarHBondContact CG2-OH 3.46Å
455	E	81.3	Confident	74.3	Confident	44 Å²	44	42.2 Å²	42.2	21%	0.206	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	132.3	174.6	-64.2	174.1	179.3	0	0	109.7	R457 L458 Y485	E455-R457 HydrophobicContact CB-CG 4.02Å; E455-R457 PolarHBondContact O-N 3.21Å; E455-R457 IonicContact OE1-NH2 3.56Å; E455-R457 IonicContact OE2-CZ 2.76Å; E455-R457 IonicContact OE2-NE 3.97Å; E455-R457 PolarHBondContact OE2-NE 3.46Å; E455-R457 IonicContact OE2-NH2 2.73Å; E455-R457 PolarHBondContact OE2-NH2 2.75Å; E455-L458 HydrophobicContact CB-CD1 4.35Å; E455-L458 HydrophobicContact CB-CG 4.36Å; E455-L458 WeakPolarHBondContact O-CB 3.19Å; E455-L458 PolarHBondContact O-N 2.81Å; E455-Y485 HydrophobicContact CB-CE1 4.39Å; E455-Y485 HydrophobicContact CG-CD1 3.9Å; E455-Y485 HydrophobicContact CG-CE1 3.27Å; E455-Y485 PolarHBondContact OE1-OH 3.16Å
456	S	78.8	Confident	71.4	Confident	36 Å²	36	49.5 Å²	49.5	25%	0.252	25%	0.25	S	C	.	.	H	α-helix	trans	-51.1	-37.3	-175.5	-61	0	0	0	0	113	V454 L458 L459 D460 N484 V486	V454-S456 PolarHBondContact O-N 3.43Å; S456-L458 PolarHBondContact O-N 3.12Å; S456-L458 VanDerWaalsContact O-N 3.12Å; S456-L459 PolarHBondContact O-N 2.97Å; S456-D460 PolarHBondContact O-N 2.95Å; S456-N484 WeakPolarHBondContact CB-O 3.29Å; S456-N484 PolarHBondContact N-O 3.11Å; S456-N484 PolarHBondContact OG-O 3.48Å; S456-V486 WeakPolarHBondContact OG-CG2 3.32Å
457	R	76.2	Confident	68.6	Low	161 Å²	161	52.3 Å²	52.3	61%	0.608	27%	0.273	S	S	*	.	H	α-helix	trans	-57.2	-27.3	177.8	66.5	178.4	177.7	169.4	-3.5	114.4	E455	E455-R457 HydrophobicContact CB-CG 4.02Å; E455-R457 PolarHBondContact O-N 3.21Å; E455-R457 IonicContact OE1-NH2 3.56Å; E455-R457 IonicContact OE2-CZ 2.76Å; E455-R457 IonicContact OE2-NE 3.97Å; E455-R457 PolarHBondContact OE2-NE 3.46Å; E455-R457 IonicContact OE2-NH2 2.73Å; E455-R457 PolarHBondContact OE2-NH2 2.75Å
458	L	72.5	Confident	66	Low	65 Å²	65	57.6 Å²	57.6	34%	0.34	31%	0.305	S	S	.	.	H	α-helix	trans	-81.2	-18.2	179.9	-62.5	177.2	0	0	0	112	V454 E455 S456 R464	V454-L458 HydrophobicContact CG1-CB 3.99Å; V454-L458 HydrophobicContact CG1-CD1 4.34Å; E455-L458 HydrophobicContact CB-CD1 4.35Å; E455-L458 HydrophobicContact CB-CG 4.36Å; E455-L458 WeakPolarHBondContact O-CB 3.19Å; E455-L458 PolarHBondContact O-N 2.81Å; S456-L458 PolarHBondContact O-N 3.12Å; S456-L458 VanDerWaalsContact O-N 3.12Å; L458-R464 PolarHBondContact O-NH2 3.2Å
459	L	72.5	Confident	63	Low	22 Å²	22	65.7 Å²	65.7	12%	0.115	34%	0.344	C	S	.	.	H	α-helix	trans	-90.8	-28	-180	-60.8	176.7	0	0	0	112.3	V454 S456 A461 V486 V488 F530 Y537	V454-L459 HydrophobicContact CB-CD1 4.48Å; V454-L459 HydrophobicContact CB-CD2 4.48Å; V454-L459 HydrophobicContact CG1-CD1 4.41Å; V454-L459 HydrophobicContact CG1-CD2 3.85Å; V454-L459 HydrophobicContact CG1-CG 3.92Å; S456-L459 PolarHBondContact O-N 2.97Å; L459-A461 PolarHBondContact O-N 3.01Å; L459-A461 VanDerWaalsContact O-N 3.17Å; L459-V486 HydrophobicContact CD1-CB 3.72Å; L459-V486 HydrophobicContact CD1-CG1 3.87Å; L459-V486 HydrophobicContact CD1-CG2 4.2Å; L459-V488 HydrophobicContact CD1-CG2 4.19Å; L459-V488 HydrophobicContact CD2-CG2 4.45Å; L459-F530 HydrophobicContact CB-CE1 4.49Å; L459-F530 HydrophobicContact CB-CZ 4.34Å; L459-F530 HydrophobicContact CD2-CD1 4.32Å; L459-F530 HydrophobicContact CD2-CD2 4.41Å; L459-F530 HydrophobicContact CD2-CE1 4.05Å; L459-F530 HydrophobicContact CD2-CE2 4.15Å; L459-F530 HydrophobicContact CD2-CG 4.5Å; L459-F530 HydrophobicContact CD2-CZ 3.96Å; L459-Y537 HydrophobicContact CD2-CD1 4.47Å; L459-Y537 HydrophobicContact CD2-CD2 4.36Å; L459-Y537 HydrophobicContact CD2-CG 4.03Å
460	D	63.4	Low	60.1	Low	78 Å²	78	72 Å²	72	42%	0.417	37%	0.374	S	S	.	.			trans	-72.8	106.6	-177.2	-80.4	-30.1	0	0	0	113.2	S456 S462 I463 R464	S456-D460 PolarHBondContact O-N 2.95Å; D460-S462 PolarHBondContact O-N 3.37Å; D460-I463 HydrophobicContact CB-CB 4.14Å; D460-I463 HydrophobicContact CB-CD1 3.74Å; D460-I463 HydrophobicContact CB-CG1 3.79Å; D460-I463 PolarHBondContact O-N 3.19Å; D460-R464 PolarHBondContact O-N 2.9Å
461	A	54.4	Low	57.5	Low	53 Å²	53	79.9 Å²	79.9	44%	0.438	41%	0.411	S	S	.	.	H	α-helix	trans	-59.1	-28.9	173.1	0	0	0	0	0	113	L459 R464	L459-A461 PolarHBondContact O-N 3.01Å; L459-A461 VanDerWaalsContact O-N 3.17Å; A461-R464 PolarHBondContact O-N 3.38Å
462	S	40.3	Very low	54.6	Low	95 Å²	95	89 Å²	89	66%	0.664	45%	0.447	S	S	*	.	H	α-helix	trans	-64.2	-41.5	178	-38.7	0	0	0	0	112.1	D460 R464	D460-S462 PolarHBondContact O-N 3.37Å; S462-R464 VanDerWaalsContact C-N 3.35Å
463	I	44.4	Very low	51.8	Low	70 Å²	70	96.5 Å²	96.5	36%	0.359	48%	0.479	S	S	.	.	H	α-helix	trans	-73.7	-31.3	-179.1	-60.2	178.9	0	0	0	110	D460 K465 Q466 A467	D460-I463 HydrophobicContact CB-CB 4.14Å; D460-I463 HydrophobicContact CB-CD1 3.74Å; D460-I463 HydrophobicContact CB-CG1 3.79Å; D460-I463 PolarHBondContact O-N 3.19Å; I463-K465 VanDerWaalsContact C-N 3.27Å; I463-K465 PolarHBondContact O-N 3.46Å; I463-Q466 PolarHBondContact O-N 3.17Å; I463-A467 PolarHBondContact O-N 3.25Å
464	R	42.6	Very low	49.2	Very low	65 Å²	65	102.7 Å²	102.7	25%	0.245	51%	0.511	C	S	.	.	H	α-helix	trans	-59.4	-32.1	178	-70.1	-175.3	-177.3	170.4	4.7	114.4	L458 D460 A461 S462 Q466 A467 T468 Y537	L458-R464 PolarHBondContact O-NH2 3.2Å; D460-R464 PolarHBondContact O-N 2.9Å; A461-R464 PolarHBondContact O-N 3.38Å; S462-R464 VanDerWaalsContact C-N 3.35Å; R464-Q466 PolarHBondContact O-N 3.42Å; R464-A467 PolarHBondContact O-N 3.23Å; R464-T468 PolarHBondContact O-N 2.96Å; R464-T468 PolarHBondContact O-OG1 3.34Å; R464-Y537 PolarHBondContact NH1-O 3.32Å; R464-Y537 VanDerWaalsContact NH2-C 3.34Å; R464-Y537 VanDerWaalsContact NH2-N 3.14Å; R464-Y537 PolarHBondContact NH2-O 2.9Å
465	K	35.4	Very low	46.7	Very low	176 Å²	176	106.9 Å²	106.9	77%	0.765	54%	0.538	S	S	*	.	H	α-helix	trans	-68.1	-23.6	175.7	-75.8	-173.4	178	179.1	0	113.2	I463	I463-K465 VanDerWaalsContact C-N 3.27Å; I463-K465 PolarHBondContact O-N 3.46Å
466	Q	31.4	Very low	44.1	Very low	154 Å²	154	110.3 Å²	110.3	72%	0.72	56%	0.558	S	S	*	*	H	α-helix	trans	-92.9	-32.2	175.3	-69.5	177.3	-12.6	0	0	111.8	I463 R464	I463-Q466 PolarHBondContact O-N 3.17Å; R464-Q466 PolarHBondContact O-N 3.42Å
467	A	36.3	Very low	42	Very low	60 Å²	60	118.4 Å²	118.4	50%	0.496	59%	0.592	S	S	.	*	H	α-helix	trans	-75.7	-20.7	-179.4	0	0	0	0	0	114.3	I463 R464 E469 M470	I463-A467 PolarHBondContact O-N 3.25Å; R464-A467 PolarHBondContact O-N 3.23Å; A467-E469 PolarHBondContact O-N 2.8Å; A467-E469 VanDerWaalsContact O-N 3.13Å; A467-M470 PolarHBondContact O-N 3.15Å
468	T	36.2	Very low	39.9	Very low	112 Å²	112	115.4 Å²	115.4	69%	0.687	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	-10.3	179.9	10.9	0	0	0	0	113.9	R464	R464-T468 PolarHBondContact O-N 2.96Å; R464-T468 PolarHBondContact O-OG1 3.34Å
469	E	30.2	Very low	37.7	Very low	171 Å²	171	117 Å²	117	80%	0.799	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-6.8	179	-69.5	-174.1	159.8	0	0	114.5	A467	A467-E469 PolarHBondContact O-N 2.8Å; A467-E469 VanDerWaalsContact O-N 3.13Å
470	M	29.1	Very low	35.7	Very low	131 Å²	131	122.2 Å²	122.2	65%	0.645	64%	0.643	S	S	*	*			trans	-126.7	95.2	-179.4	-64.8	-147.2	-174.9	0	0	112.8	A467 F473	A467-M470 PolarHBondContact O-N 3.15Å; M470-F473 HydrophobicContact CB-CD2 4.36Å; M470-F473 HydrophobicContact CB-CE2 4.24Å; M470-F473 HydrophobicContact SD-CE2 3.6Å; M470-F473 VanDerWaalsContact SD-CE2 3.6Å; M470-F473 HydrophobicContact SD-CZ 4.3Å
471	H	32.6	Very low	34.2	Very low	172 Å²	172	123.2 Å²	123.2	80%	0.796	66%	0.655	S	S	*	*			trans	-71.2	132.7	165.5	-79.7	-73.9	0	0	0	110.4
472	Y	30.5	Very low	33.6	Very low	192 Å²	192	125.5 Å²	125.5	75%	0.753	67%	0.668	S	S	*	*			trans	67.2	79.5	177.7	-68.4	-89	0	0	0	116.3
473	F	29.2	Very low	34.2	Very low	158 Å²	158	122.8 Å²	122.8	69%	0.693	65%	0.651	S	S	*	*			trans	-90.3	108.4	150	-99.6	-85.9	0	0	0	109.4	M470	M470-F473 HydrophobicContact CB-CD2 4.36Å; M470-F473 HydrophobicContact CB-CE2 4.24Å; M470-F473 HydrophobicContact SD-CE2 3.6Å; M470-F473 VanDerWaalsContact SD-CE2 3.6Å; M470-F473 HydrophobicContact SD-CZ 4.3Å
474	I	31.7	Very low	35.4	Very low	139 Å²	139	125.4 Å²	125.4	71%	0.713	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-62.6	132.8	150.7	-60.4	168.7	0	0	0	105	D476	I474-D476 PolarHBondContact O-N 2.88Å
475	P	32	Very low	37	Very low	90 Å²	90	124.7 Å²	124.7	58%	0.584	66%	0.664	S	S	*	*	P	Polyproline II helix	trans	-61.5	117.9	174.9	6.2	2.1	0	0	0	107.6	E477	P475-E477 PolarHBondContact O-N 3.15Å
476	D	27.1	Very low	39.3	Very low	117 Å²	117	118.5 Å²	118.5	63%	0.626	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-59.6	121.8	162.2	-100.3	-28.2	0	0	0	107	I474 S478	I474-D476 PolarHBondContact O-N 2.88Å; D476-S478 PolarHBondContact O-N 2.82Å
477	E	34.2	Very low	42	Very low	206 Å²	206	111.7 Å²	111.7	96%	0.963	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	5.8	-180	-70.4	-175.8	148.9	0	0	113.8	P475	P475-E477 PolarHBondContact O-N 3.15Å
478	S	31.9	Very low	44.5	Very low	97 Å²	97	108.9 Å²	108.9	68%	0.678	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	-1.3	-166.6	61.7	0	0	0	0	116.2	D476	D476-S478 PolarHBondContact O-N 2.82Å
479	T	27	Very low	47.2	Very low	99 Å²	99	103.5 Å²	103.5	61%	0.607	55%	0.552	S	S	*	*			trans	-108.2	113.5	171.3	31	0	0	0	0	111.8	C481	T479-C481 PolarHBondContact O-N 3.3Å
480	P	29.3	Very low	50.1	Low	132 Å²	132	95.6 Å²	95.6	86%	0.857	52%	0.515	S	S	*	.			trans	-72.9	82.8	168.5	30.1	-29.4	0	0	0	108	S482	P480-S482 PolarHBondContact O-N 3.16Å; P480-S482 VanDerWaalsContact O-N 3.17Å
481	C	32.1	Very low	53.2	Low	98 Å²	98	89.3 Å²	89.3	66%	0.662	48%	0.484	S	S	*	.			trans	-73.6	105.7	172.4	-80.6	0	0	0	0	107.9	T479 A483	T479-C481 PolarHBondContact O-N 3.3Å; C481-A483 PolarHBondContact O-N 2.79Å
482	S	42.8	Very low	56.2	Low	102 Å²	102	81.1 Å²	81.1	71%	0.713	45%	0.446	S	S	*	.			trans	-61.7	76.5	152	58.8	0	0	0	0	107.5	P480 N484	P480-S482 PolarHBondContact O-N 3.16Å; P480-S482 VanDerWaalsContact O-N 3.17Å; S482-N484 PolarHBondContact O-N 3.1Å
483	A	52.6	Low	59.2	Low	38 Å²	38	72 Å²	72	31%	0.314	41%	0.41	S	S	.	.			trans	-66.7	108.3	-179	0	0	0	0	0	107.3	C481 Y485	C481-A483 PolarHBondContact O-N 2.79Å; A483-Y485 HydrophobicContact CB-CE2 3.94Å; A483-Y485 WeakPolarHBondContact O-CD2 3.32Å; A483-Y485 PolarHBondContact O-N 3.44Å
484	N	69	Low	62.2	Low	124 Å²	124	64.5 Å²	64.5	66%	0.663	38%	0.378	S	S	*	.			trans	-64.6	112.2	172.5	-75.6	-20.4	0	0	0	107.9	S456 S482	S456-N484 WeakPolarHBondContact CB-O 3.29Å; S456-N484 PolarHBondContact N-O 3.11Å; S456-N484 PolarHBondContact OG-O 3.48Å; S482-N484 PolarHBondContact O-N 3.1Å
485	Y	76.8	Confident	65.1	Low	51 Å²	51	57.9 Å²	57.9	20%	0.2	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	131.6	173.1	-73.1	-86.7	0	0	0	109.6	P453 V454 E455 A483 R643	P453-Y485 HydrophobicContact CB-CD1 4.24Å; V454-Y485 CarbonylContact O-C 3.57Å; V454-Y485 WeakPolarHBondContact O-CA 3.34Å; E455-Y485 HydrophobicContact CB-CE1 4.39Å; E455-Y485 HydrophobicContact CG-CD1 3.9Å; E455-Y485 HydrophobicContact CG-CE1 3.27Å; E455-Y485 PolarHBondContact OE1-OH 3.16Å; A483-Y485 HydrophobicContact CB-CE2 3.94Å; A483-Y485 WeakPolarHBondContact O-CD2 3.32Å; A483-Y485 PolarHBondContact O-N 3.44Å; Y485-R643 HydrophobicContact CD2-CB 4.21Å; Y485-R643 HydrophobicContact CE2-CB 3.62Å; Y485-R643 HydrophobicContact CE2-CG 4.07Å
486	V	83.7	Confident	67.9	Low	46 Å²	46	53.6 Å²	53.6	28%	0.279	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	133.3	169.5	179.1	0	0	0	0	107.8	V454 S456 L459 V488	V454-V486 PolarHBondContact N-O 3.1Å; V454-V486 PolarHBondContact O-N 3.39Å; S456-V486 WeakPolarHBondContact OG-CG2 3.32Å; L459-V486 HydrophobicContact CD1-CB 3.72Å; L459-V486 HydrophobicContact CD1-CG1 3.87Å; L459-V486 HydrophobicContact CD1-CG2 4.2Å; V486-V488 HydrophobicContact CG1-CG2 4.4Å
487	F	87.2	Confident	71.1	Confident	11 Å²	11	51.7 Å²	51.7	5%	0.048	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	125.7	177.1	-81.2	-102.7	0	0	0	109.8	M451 P453 E555 L605 L608 A609 F644	M451-F487 HydrophobicContact CB-CD1 3.96Å; M451-F487 HydrophobicContact CE-CB 3.99Å; P453-F487 HydrophobicContact CB-CE1 4.21Å; P453-F487 HydrophobicContact CB-CZ 4.13Å; F487-E555 HydrophobicContact CB-CB 3.84Å; F487-E555 HydrophobicContact CB-CG 4.44Å; F487-L605 HydrophobicContact CD2-CD2 4.23Å; F487-L605 WeakPolarHBondContact CE1-O 3.38Å; F487-L605 HydrophobicContact CE2-CB 4.1Å; F487-L605 HydrophobicContact CE2-CD1 4.31Å; F487-L605 HydrophobicContact CE2-CD2 3.64Å; F487-L605 HydrophobicContact CE2-CG 4.21Å; F487-L605 HydrophobicContact CZ-CB 3.77Å; F487-L605 HydrophobicContact CZ-CD2 4.03Å; F487-L605 HydrophobicContact CZ-CG 4.37Å; F487-L605 WeakPolarHBondContact CZ-O 3.37Å; F487-L608 HydrophobicContact CD1-CB 4.23Å; F487-L608 HydrophobicContact CE1-CB 3.97Å; F487-A609 HydrophobicContact CE1-CB 3.9Å; F487-A609 HydrophobicContact CZ-CB 4.48Å; F487-F644 HydrophobicContact CE1-CE1 4.48Å; F487-F644 HydrophobicContact CE2-CE1 4.09Å; F487-F644 HydrophobicContact CZ-CD1 4.18Å; F487-F644 AromaticContact CZ-CE1 3.51Å; F487-F644 HydrophobicContact CZ-CE1 3.51Å; F487-F644 HydrophobicContact CZ-CZ 4.06Å
488	V	89.7	Confident	73.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.3	-179.6	-171	0	0	0	0	108.6	V452 V454 L459 V486 F490 F530 C550	V452-V488 WeakPolarHBondContact CB-O 3.47Å; V452-V488 PolarHBondContact N-O 3.25Å; V452-V488 PolarHBondContact O-N 3.01Å; V454-V488 HydrophobicContact CB-CG2 4.35Å; V454-V488 HydrophobicContact CG2-CB 4.3Å; V454-V488 HydrophobicContact CG2-CG2 3.91Å; L459-V488 HydrophobicContact CD1-CG2 4.19Å; L459-V488 HydrophobicContact CD2-CG2 4.45Å; V486-V488 HydrophobicContact CG1-CG2 4.4Å; V488-F490 PolarHBondContact O-N 3.2Å; V488-F530 HydrophobicContact CG1-CD2 4.43Å; V488-C550 HydrophobicContact CG1-CB 3.52Å
489	A	91.8	Very high	76.9	Confident	0 Å²	0	40 Å²	40	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	123.6	178.9	0	0	0	0	0	110.8	V448 M451 C550 V551 V554	V448-A489 HydrophobicContact CB-CB 4.48Å; V448-A489 HydrophobicContact CG1-CB 3.64Å; V448-A489 HydrophobicContact CG2-CB 4Å; M451-A489 HydrophobicContact CE-CB 4.15Å; M451-A489 HydrophobicContact SD-CB 3.62Å; A489-C550 CarbonylContact O-C 3.47Å; A489-C550 VanDerWaalsContact O-CA 3.26Å; A489-C550 WeakPolarHBondContact O-CA 3.41Å; A489-V551 HydrophobicContact CB-CB 4.26Å; A489-V551 PolarHBondContact N-O 3.49Å; A489-V551 PolarHBondContact O-N 3.21Å; A489-V554 HydrophobicContact CB-CG2 3.43Å; A489-V554 VanDerWaalsContact CB-CG2 3.43Å
490	F	92.9	Very high	80	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.018	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	117.1	173.3	-175.3	-126.8	0	0	0	110.5	A113 V130 L148 S449 K450 V452 V488 M532 L548	A113-F490 HydrophobicContact CB-CE2 3.94Å; A113-F490 HydrophobicContact CB-CZ 3.66Å; V130-F490 HydrophobicContact CG2-CZ 4.31Å; L148-F490 HydrophobicContact CD1-CD1 3.5Å; L148-F490 HydrophobicContact CD1-CE1 3.43Å; L148-F490 VanDerWaalsContact CD1-CE1 3.43Å; L148-F490 HydrophobicContact CD1-CG 4.19Å; L148-F490 HydrophobicContact CD1-CZ 4.05Å; S449-F490 PolarHBondContact N-O 3.4Å; S449-F490 PolarHBondContact OG-O 3.42Å; K450-F490 HydrophobicContact CG-CB 4.11Å; K450-F490 HydrophobicContact CG-CD1 4.46Å; K450-F490 PolarHBondContact O-N 3Å; V452-F490 HydrophobicContact CG2-CB 3.83Å; V488-F490 PolarHBondContact O-N 3.2Å; F490-M532 HydrophobicContact CD2-CE 4.04Å; F490-M532 HydrophobicContact CE2-CE 4.37Å; F490-M532 HydrophobicContact CG-CE 4.49Å; F490-L548 HydrophobicContact CE2-CB 4.24Å; F490-L548 HydrophobicContact CZ-CD1 4Å
491	A	94	Very high	82.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	167.2	-163.6	0	0	0	0	0	113.4	V446 F447 V448 L548 V549	V446-A491 HydrophobicContact CG1-CB 3.69Å; F447-A491 CarbonylContact O-C 3.54Å; F447-A491 WeakPolarHBondContact O-CA 3.33Å; F447-A491 VanDerWaalsContact O-CB 3.23Å; F447-A491 WeakPolarHBondContact O-CB 3.3Å; V448-A491 HydrophobicContact CB-CB 4.5Å; V448-A491 HydrophobicContact CG2-CB 3.97Å; A491-L548 CarbonylContact O-C 3.54Å; A491-L548 WeakPolarHBondContact O-CA 3.19Å; A491-V549 HydrophobicContact CB-CG1 4.18Å; A491-V549 PolarHBondContact N-O 2.88Å; A491-V549 PolarHBondContact O-N 3.2Å
492	R	94.8	Very high	85.8	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	135.9	168.1	173.8	172.2	175.3	176.1	0.4	110.1	L148 D150 V446 F447 F494 L548	L148-R492 HydrophobicContact CD2-CB 3.7Å; L148-R492 VanDerWaalsContact O-CD 3.24Å; L148-R492 WeakPolarHBondContact O-CD 3.38Å; L148-R492 PolarHBondContact O-NH1 3.25Å; D150-R492 VanDerWaalsContact CG-NH1 3.34Å; D150-R492 IonicContact OD1-CZ 2.68Å; D150-R492 IonicContact OD1-NH1 2.78Å; D150-R492 PolarHBondContact OD1-NH1 3.12Å; D150-R492 IonicContact OD1-NH2 3.49Å; D150-R492 PolarHBondContact OD1-NH2 2.78Å; D150-R492 IonicContact OD2-CZ 3.25Å; D150-R492 IonicContact OD2-NH1 3.92Å; D150-R492 PolarHBondContact OD2-NH1 3.38Å; D150-R492 IonicContact OD2-NH2 3.41Å; D150-R492 PolarHBondContact OD2-NH2 3.31Å; D150-R492 VanDerWaalsContact OD2-NH2 3.15Å; V446-R492 WeakPolarHBondContact CA-O 3.3Å; F447-R492 PolarHBondContact N-O 3.23Å; F447-R492 PolarHBondContact O-N 3.14Å; R492-F494 HydrophobicContact CB-CE2 4.44Å; R492-F494 HydrophobicContact CG-CD2 4.45Å; R492-F494 HydrophobicContact CG-CE2 4.37Å; R492-F494 HydrophobicContact CG-CZ 4.46Å; R492-L548 HydrophobicContact CB-CD2 3.95Å; R492-L548 HydrophobicContact CG-CD2 4.29Å
493	V	94.6	Very high	88.2	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	114.4	169.1	-171.4	0	0	0	0	107.7	T444 V446 T495 L498 V543 A545 G546 N547 V549	T444-V493 HydrophobicContact CG2-CG1 4.47Å; V446-V493 HydrophobicContact CG2-CG1 4.36Å; V446-V493 HydrophobicContact CG2-CG2 4.2Å; V493-T495 WeakPolarHBondContact CG1-O 3.43Å; V493-L498 HydrophobicContact CG2-CB 4.05Å; V493-L498 HydrophobicContact CG2-CD2 4.29Å; V493-V543 HydrophobicContact CG2-CG1 4.23Å; V493-A545 HydrophobicContact CG1-CB 4.47Å; V493-A545 CarbonylContact O-C 3.6Å; V493-A545 WeakPolarHBondContact O-CA 3.47Å; V493-G546 PolarHBondContact O-N 2.87Å; V493-N547 PolarHBondContact N-O 3.04Å; V493-N547 VanDerWaalsContact N-O 3.14Å; V493-V549 HydrophobicContact CG2-CG1 3.86Å
494	F	91.6	Very high	90.1	Very high	1 Å²	1	33.2 Å²	33.2	0%	0.004	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-38.6	179	-82.2	-77.6	0	0	0	112.3	L403 L411 I434 I445 F447 R492 L573	L403-F494 HydrophobicContact CD1-CD1 4.46Å; L403-F494 HydrophobicContact CD1-CE1 4.21Å; L411-F494 HydrophobicContact CD1-CE1 3.81Å; L411-F494 HydrophobicContact CD1-CZ 3.89Å; I434-F494 HydrophobicContact CG2-CD1 4.14Å; I445-F494 PolarHBondContact O-N 2.65Å; F447-F494 HydrophobicContact CB-CD2 4.06Å; F447-F494 HydrophobicContact CB-CE2 3.64Å; R492-F494 HydrophobicContact CB-CE2 4.44Å; R492-F494 HydrophobicContact CG-CD2 4.45Å; R492-F494 HydrophobicContact CG-CE2 4.37Å; R492-F494 HydrophobicContact CG-CZ 4.46Å; F494-L573 HydrophobicContact CD2-CD1 3.96Å; F494-L573 HydrophobicContact CE2-CD1 4.15Å
495	T	92.5	Very high	91.2	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	159.5	-179.7	55.8	0	0	0	0	110.3	F433 I434 P443 T444 I445 V493	F433-T495 VanDerWaalsContact C-CG2 3.47Å; F433-T495 HydrophobicContact CB-CG2 4.01Å; F433-T495 WeakPolarHBondContact O-CG2 3.47Å; I434-T495 HydrophobicContact CB-CG2 4.25Å; I434-T495 HydrophobicContact CG1-CG2 3.69Å; P443-T495 VanDerWaalsContact O-CB 3.31Å; P443-T495 WeakPolarHBondContact O-CB 3.46Å; P443-T495 PolarHBondContact O-OG1 2.87Å; T444-T495 VanDerWaalsContact CA-O 3.3Å; T444-T495 WeakPolarHBondContact CA-O 3.42Å; I445-T495 VanDerWaalsContact CB-OG1 3.3Å; I445-T495 WeakPolarHBondContact CB-OG1 3.29Å; I445-T495 VanDerWaalsContact CG1-OG1 3.3Å; I445-T495 WeakPolarHBondContact CG1-OG1 3.07Å; I445-T495 PolarHBondContact N-O 2.78Å; I445-T495 PolarHBondContact N-OG1 2.88Å; I445-T495 PolarHBondContact O-N 2.82Å; V493-T495 WeakPolarHBondContact CG1-O 3.43Å
496	G	91.4	Very high	91.7	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.149	C	C	.	.	S	Bend	trans	73.6	-159.9	178.4	0	0	0	0	0	114.3	T438 A545	T438-G496 PolarHBondContact O-N 3.43Å; G496-A545 PolarHBondContact O-N 2.87Å
497	K	92.8	Very high	91.8	Very high	76 Å²	76	27.4 Å²	27.4	33%	0.33	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	119.1	179	-176.6	177.4	177.2	179.9	0	108.4	V439 T444 V499 Q502 S542	V439-K497 HydrophobicContact CG1-CB 3.99Å; T444-K497 PolarHBondContact OG1-N 3.03Å; K497-V499 HydrophobicContact CD-CG2 4.45Å; K497-V499 HydrophobicContact CG-CG2 4.17Å; K497-Q502 PolarHBondContact O-OE1 2.99Å; K497-Q502 VanDerWaalsContact O-OE1 3.08Å; K497-S542 WeakPolarHBondContact CE-OG 3.45Å; K497-S542 PolarHBondContact NZ-OG 2.92Å
498	L	93.9	Very high	91.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	127.1	176	-170.8	64.9	0	0	0	109.4	T444 V446 V493 L504 I526 L529 S542 V543 V549 V551	T444-L498 HydrophobicContact CG2-CB 4.5Å; T444-L498 HydrophobicContact CG2-CD1 4.46Å; V446-L498 HydrophobicContact CG2-CD1 4.12Å; V446-L498 HydrophobicContact CG2-CD2 4.24Å; V493-L498 HydrophobicContact CG2-CB 4.05Å; V493-L498 HydrophobicContact CG2-CD2 4.29Å; L498-L504 HydrophobicContact CD1-CD1 3.74Å; L498-I526 HydrophobicContact CD1-CD1 4.16Å; L498-I526 HydrophobicContact CD1-CG1 3.93Å; L498-I526 HydrophobicContact CD1-CG2 4.29Å; L498-I526 HydrophobicContact CG-CG2 4.42Å; L498-L529 HydrophobicContact CD2-CD1 4.37Å; L498-L529 HydrophobicContact CD2-CD2 3.64Å; L498-L529 HydrophobicContact CG-CD1 4.13Å; L498-L529 HydrophobicContact CG-CD2 4.12Å; L498-S542 CarbonylContact O-C 3.44Å; L498-S542 WeakPolarHBondContact O-CA 3.41Å; L498-S542 WeakPolarHBondContact O-CB 3.29Å; L498-V543 PolarHBondContact N-O 3.22Å; L498-V543 PolarHBondContact O-N 2.9Å; L498-V549 HydrophobicContact CD2-CG1 4.18Å; L498-V551 HydrophobicContact CD2-CG2 3.84Å
499	V	93.9	Very high	90	Very high	59 Å²	59	33.8 Å²	33.8	36%	0.358	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143.4	-179.6	-174	0	0	0	0	109.9	K497 G501 Q502	K497-V499 HydrophobicContact CD-CG2 4.45Å; K497-V499 HydrophobicContact CG-CG2 4.17Å; V499-G501 PolarHBondContact O-N 3.48Å; V499-Q502 HydrophobicContact CB-CB 4.48Å; V499-Q502 WeakPolarHBondContact O-CB 3.4Å; V499-Q502 PolarHBondContact O-N 3.05Å; V499-Q502 VanDerWaalsContact O-N 3.08Å
500	K	92.6	Very high	88.5	Confident	117 Å²	117	36.7 Å²	36.7	51%	0.509	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	131.8	171.5	173.2	171.6	175.9	177	0	110.7	Q502 G527 D528 E541	K500-Q502 VanDerWaalsContact C-N 3.3Å; K500-G527 WeakPolarHBondContact CG-O 3.27Å; K500-D528 WeakPolarHBondContact CD-OD1 3.42Å; K500-D528 WeakPolarHBondContact CE-OD1 3.42Å; K500-D528 IonicContact NZ-OD1 3.79Å; K500-D528 PolarHBondContact NZ-OD1 2.95Å; K500-E541 PolarHBondContact N-O 3.44Å; K500-E541 VanDerWaalsContact N-O 3.08Å
501	G	91	Very high	86.7	Confident	44 Å²	44	37.2 Å²	37.2	45%	0.454	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.2	-1.7	-177.3	0	0	0	0	0	115.1	V499 I526	V499-G501 PolarHBondContact O-N 3.48Å; G501-I526 VanDerWaalsContact CA-O 3.27Å; G501-I526 WeakPolarHBondContact CA-O 3.42Å; G501-I526 PolarHBondContact N-O 3.35Å
502	Q	92.6	Very high	84.9	Confident	43 Å²	43	37.8 Å²	37.8	20%	0.201	21%	0.21	C	C	.	.			trans	-65.8	141	175.8	-173.1	175.4	2	0	0	110.9	K497 V499 K500 L504 I526	K497-Q502 PolarHBondContact O-OE1 2.99Å; K497-Q502 VanDerWaalsContact O-OE1 3.08Å; V499-Q502 HydrophobicContact CB-CB 4.48Å; V499-Q502 WeakPolarHBondContact O-CB 3.4Å; V499-Q502 PolarHBondContact O-N 3.05Å; V499-Q502 VanDerWaalsContact O-N 3.08Å; K500-Q502 VanDerWaalsContact C-N 3.3Å; Q502-L504 HydrophobicContact CG-CD2 4.25Å; Q502-I526 WeakPolarHBondContact O-CB 3.48Å; Q502-I526 VanDerWaalsContact O-CG1 3.25Å; Q502-I526 WeakPolarHBondContact O-CG1 3.37Å; Q502-I526 PolarHBondContact O-N 3.47Å
503	K	92.9	Very high	83.1	Confident	121 Å²	121	37.9 Å²	37.9	53%	0.526	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	126.7	174.6	-78.1	157.5	153	-102.7	0	109.9	E523	K503-E523 HydrophobicContact CB-CG 4.38Å; K503-E523 WeakPolarHBondContact CB-OE1 3.39Å; K503-E523 WeakPolarHBondContact CD-OE1 3.44Å; K503-E523 WeakPolarHBondContact CE-OE1 3.34Å; K503-E523 WeakPolarHBondContact CG-OE1 3.47Å; K503-E523 IonicContact NZ-OE1 2.69Å; K503-E523 PolarHBondContact NZ-OE1 2.78Å; K503-E523 IonicContact NZ-OE2 3.09Å; K503-E523 PolarHBondContact NZ-OE2 2.86Å
504	L	92.6	Very high	81.1	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	159.7	175.7	-60.1	-177.1	0	0	0	109.7	V446 L498 Q502 E523 V524 I526 L564 T566	V446-L504 HydrophobicContact CG2-CD1 4.38Å; L498-L504 HydrophobicContact CD1-CD1 3.74Å; Q502-L504 HydrophobicContact CG-CD2 4.25Å; L504-E523 CarbonylContact O-C 3.57Å; L504-V524 PolarHBondContact N-O 2.85Å; L504-V524 PolarHBondContact O-N 2.89Å; L504-I526 HydrophobicContact CD1-CD1 3.82Å; L504-I526 HydrophobicContact CD1-CG1 3.98Å; L504-I526 HydrophobicContact CG-CD1 4.38Å; L504-I526 HydrophobicContact CG-CG1 4.12Å; L504-L564 HydrophobicContact CB-CB 4.29Å; L504-L564 HydrophobicContact CD1-CB 3.81Å; L504-L564 HydrophobicContact CD1-CD1 4.46Å; L504-T566 HydrophobicContact CD2-CG2 3.34Å
505	Y	91.1	Very high	79.3	Confident	78 Å²	78	45.1 Å²	45.1	31%	0.306	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	138.2	170.4	-58.1	-75.6	0	0	0	110.6	I507 A521 Q522 E523 L564 S565 T566 L568	Y505-I507 PolarHBondContact O-N 2.9Å; Y505-A521 HydrophobicContact CD1-CB 3.9Å; Y505-A521 HydrophobicContact CE1-CB 4.42Å; Y505-Q522 WeakPolarHBondContact CA-O 3.37Å; Y505-E523 HydrophobicContact CD1-CB 4.23Å; Y505-E523 HydrophobicContact CE1-CB 4.22Å; Y505-E523 HydrophobicContact CE1-CG 4.34Å; Y505-L564 CarbonylContact O-C 3.5Å; Y505-L564 VanDerWaalsContact O-CA 3.31Å; Y505-L564 WeakPolarHBondContact O-CA 3.45Å; Y505-S565 PolarHBondContact N-O 3.28Å; Y505-S565 PolarHBondContact O-N 3.09Å; Y505-T566 WeakPolarHBondContact CE2-O 3.41Å; Y505-L568 HydrophobicContact CD1-CD1 4.23Å; Y505-L568 HydrophobicContact CD1-CD2 4.29Å; Y505-L568 HydrophobicContact CD1-CG 4.31Å; Y505-L568 HydrophobicContact CD2-CD1 4.24Å; Y505-L568 HydrophobicContact CD2-CD2 4.3Å; Y505-L568 HydrophobicContact CD2-CG 3.79Å; Y505-L568 HydrophobicContact CE1-CD1 4.29Å; Y505-L568 HydrophobicContact CE2-CD1 4.3Å; Y505-L568 HydrophobicContact CE2-CG 4.27Å; Y505-L568 HydrophobicContact CG-CD1 4.19Å; Y505-L568 HydrophobicContact CG-CD2 3.83Å; Y505-L568 HydrophobicContact CG-CG 3.8Å
506	V	88.4	Confident	77.1	Confident	17 Å²	17	46.9 Å²	46.9	10%	0.103	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	116.5	165.8	176.4	0	0	0	0	107.7	P508 Q522 V524 H557 A562 L564	V506-P508 WeakPolarHBondContact O-CD 3.39Å; V506-Q522 HydrophobicContact CB-CB 4.42Å; V506-Q522 PolarHBondContact N-O 3.42Å; V506-V524 HydrophobicContact CG2-CB 4.38Å; V506-V524 HydrophobicContact CG2-CG2 3.37Å; V506-H557 HydrophobicContact CG2-CB 4.1Å; V506-A562 HydrophobicContact CG1-CB 4.32Å; V506-L564 HydrophobicContact CB-CD2 4.26Å; V506-L564 HydrophobicContact CG2-CD2 3.51Å
507	I	84.7	Confident	74.9	Confident	5 Å²	5	55 Å²	55	3%	0.026	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	121.8	178.6	-55.6	-53.7	0	0	0	108.5	Y505 T563 L568 C570	Y505-I507 PolarHBondContact O-N 2.9Å; I507-T563 HydrophobicContact CB-CG2 4.27Å; I507-T563 WeakPolarHBondContact CB-O 3.39Å; I507-T563 HydrophobicContact CG1-CG2 4.03Å; I507-T563 PolarHBondContact N-O 3.02Å; I507-L568 HydrophobicContact CD1-CD2 4.09Å; I507-C570 HydrophobicContact CD1-CB 4.39Å; I507-C570 HydrophobicContact CG1-CB 4.33Å; I507-C570 VanDerWaalsContact CG2-O 3.27Å; I507-C570 WeakPolarHBondContact CG2-O 3.46Å
508	P	72.8	Confident	72.9	Confident	46 Å²	46	55.2 Å²	55.2	30%	0.299	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-58.5	141.8	175.1	-22.4	32.9	0	0	0	110.4	V506 S510 S511 S572	V506-P508 WeakPolarHBondContact O-CD 3.39Å; P508-S510 PolarHBondContact O-N 3.34Å; P508-S511 WeakPolarHBondContact O-CB 3.45Å; P508-S511 PolarHBondContact O-N 3.38Å; P508-S572 WeakPolarHBondContact O-CB 3.44Å
509	S	66.3	Low	71	Confident	99 Å²	99	59.9 Å²	59.9	69%	0.692	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-17	176.2	58	0	0	0	0	113.4
510	S	60.1	Low	69.4	Low	60 Å²	60	66.2 Å²	66.2	42%	0.42	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	6.3	176.6	62.2	0	0	0	0	114	P508 P736 S737	P508-S510 PolarHBondContact O-N 3.34Å; S510-P736 VanDerWaalsContact C-CB 3.48Å; S510-P736 CarbonylContact O-C 3.59Å; S510-P736 WeakPolarHBondContact O-CA 3.17Å; S510-P736 WeakPolarHBondContact O-CB 3.35Å; S510-S737 PolarHBondContact O-N 3.3Å; S510-S737 PolarHBondContact O-OG 2.84Å
511	S	55.7	Low	68.2	Low	15 Å²	15	62.3 Å²	62.3	11%	0.105	37%	0.373	C	S	.	.			trans	-87.5	120.1	179.9	-178.8	0	0	0	0	111.2	P508 G513 P571 S572	P508-S511 WeakPolarHBondContact O-CB 3.45Å; P508-S511 PolarHBondContact O-N 3.38Å; S511-G513 VanDerWaalsContact C-N 3.29Å; S511-G513 PolarHBondContact OG-N 3.48Å; S511-P571 WeakPolarHBondContact O-CA 3.44Å; S511-S572 PolarHBondContact O-N 2.82Å
512	N	57.2	Low	67.8	Low	13 Å²	13	64.5 Å²	64.5	7%	0.07	37%	0.371	C	S	.	.	S	Bend	trans	-92.4	17.9	167.9	-70.8	-8.9	0	0	0	112.5	P736 S737 T740	N512-P736 PolarHBondContact ND2-O 2.83Å; N512-S737 WeakPolarHBondContact CB-OG 3.48Å; N512-S737 PolarHBondContact N-OG 3.46Å; N512-T740 PolarHBondContact ND2-OG1 3.16Å
513	G	55.3	Low	67.6	Low	1 Å²	1	66.4 Å²	66.4	1%	0.01	38%	0.38	C	S	.	.	S	Bend	trans	80.1	18.7	-178	0	0	0	0	0	114.2	S424 S511 D569	S424-G513 WeakPolarHBondContact CB-O 3.46Å; S424-G513 PolarHBondContact OG-O 3.11Å; S511-G513 VanDerWaalsContact C-N 3.29Å; S511-G513 PolarHBondContact OG-N 3.48Å; G513-D569 WeakPolarHBondContact CA-O 3.35Å
514	T	54.4	Low	67.5	Low	46 Å²	46	60.7 Å²	60.7	28%	0.282	36%	0.355	S	S	.	.			trans	-104.2	125.1	161.3	45.2	0	0	0	0	108.6	A516 S737 E738	T514-A516 VanDerWaalsContact C-N 3.32Å; T514-A516 PolarHBondContact O-N 3.41Å; T514-S737 WeakPolarHBondContact OG1-CB 3.5Å; T514-S737 PolarHBondContact OG1-OG 2.93Å; T514-E738 PolarHBondContact OG1-O 2.96Å
515	H	54	Low	67.5	Low	108 Å²	108	64.4 Å²	64.4	50%	0.5	38%	0.378	S	S	.	.			trans	-60.8	97	165	-83.6	-98.6	0	0	0	108.8	N517 L568 D569	H515-N517 PolarHBondContact O-N 3.44Å; H515-N517 VanDerWaalsContact O-N 3.11Å; H515-L568 WeakPolarHBondContact CE1-CB 3.27Å; H515-L568 WeakPolarHBondContact CE1-CD1 3.28Å; H515-L568 WeakPolarHBondContact NE2-CB 3.32Å; H515-D569 IonicContact CD2-OD1 3.15Å; H515-D569 PolarHBondContact CD2-OD1 3.5Å; H515-D569 IonicContact NE2-OD1 2.83Å
516	A	46	Very low	67.5	Low	37 Å²	37	60.8 Å²	60.8	31%	0.306	36%	0.364	S	S	.	.			trans	-65.6	112.3	168.4	0	0	0	0	0	107.7	T514 G518 V519	T514-A516 VanDerWaalsContact C-N 3.32Å; T514-A516 PolarHBondContact O-N 3.41Å; A516-G518 PolarHBondContact O-N 3.08Å; A516-V519 HydrophobicContact CB-CG2 4.28Å; A516-V519 PolarHBondContact O-N 3.46Å
517	N	44.3	Very low	67.6	Low	169 Å²	169	61 Å²	61	90%	0.904	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	113.3	172.2	-78.5	-31.8	0	0	0	108.9	H515	H515-N517 PolarHBondContact O-N 3.44Å; H515-N517 VanDerWaalsContact O-N 3.11Å
518	G	50.4	Low	67.9	Low	81 Å²	81	64.1 Å²	64.1	84%	0.835	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.6	-1.9	173.2	0	0	0	0	0	117.5	A516	A516-G518 PolarHBondContact O-N 3.08Å
519	V	55.5	Low	68.9	Low	99 Å²	99	62 Å²	62	60%	0.6	37%	0.373	S	S	*	.			trans	-94.3	113.2	169.9	-174.9	0	0	0	0	109.3	A516 A521	A516-V519 HydrophobicContact CB-CG2 4.28Å; A516-V519 PolarHBondContact O-N 3.46Å; V519-A521 PolarHBondContact O-N 3.36Å
520	E	59.6	Low	70.1	Confident	191 Å²	191	57.7 Å²	57.7	89%	0.893	34%	0.341	S	S	*	.			trans	-60.7	110.7	174.4	-73.6	-173.9	163.9	0	0	109.9	Q522	E520-Q522 PolarHBondContact O-N 2.91Å
521	A	67.4	Low	71.5	Confident	36 Å²	36	55 Å²	55	30%	0.298	32%	0.322	S	S	.	.			trans	-66.3	125.8	173.9	0	0	0	0	0	110.1	Y505 V519 E523 L568	Y505-A521 HydrophobicContact CD1-CB 3.9Å; Y505-A521 HydrophobicContact CE1-CB 4.42Å; V519-A521 PolarHBondContact O-N 3.36Å; A521-E523 PolarHBondContact O-N 3.34Å; A521-L568 HydrophobicContact CB-CD1 3.65Å; A521-L568 HydrophobicContact CB-CD2 3.48Å; A521-L568 VanDerWaalsContact CB-CD2 3.48Å; A521-L568 HydrophobicContact CB-CG 4.2Å
522	Q	82.7	Confident	73	Confident	90 Å²	90	54.7 Å²	54.7	42%	0.421	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	108.2	177.5	-169.8	171.1	32.3	0	0	110	Y505 V506 E520 H557	Y505-Q522 WeakPolarHBondContact CA-O 3.37Å; V506-Q522 HydrophobicContact CB-CB 4.42Å; V506-Q522 PolarHBondContact N-O 3.42Å; E520-Q522 PolarHBondContact O-N 2.91Å; Q522-H557 VanDerWaalsContact CD-ND1 3.28Å; Q522-H557 PolarHBondContact NE2-ND1 3.22Å
523	E	88.8	Confident	74.3	Confident	82 Å²	82	54.9 Å²	54.9	38%	0.383	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	136.2	173.6	-169.5	-174.7	-173.6	0	0	110.5	K503 L504 Y505 A521	K503-E523 HydrophobicContact CB-CG 4.38Å; K503-E523 WeakPolarHBondContact CB-OE1 3.39Å; K503-E523 WeakPolarHBondContact CD-OE1 3.44Å; K503-E523 WeakPolarHBondContact CE-OE1 3.34Å; K503-E523 WeakPolarHBondContact CG-OE1 3.47Å; K503-E523 IonicContact NZ-OE1 2.69Å; K503-E523 PolarHBondContact NZ-OE1 2.78Å; K503-E523 IonicContact NZ-OE2 3.09Å; K503-E523 PolarHBondContact NZ-OE2 2.86Å; L504-E523 CarbonylContact O-C 3.57Å; Y505-E523 HydrophobicContact CD1-CB 4.23Å; Y505-E523 HydrophobicContact CE1-CB 4.22Å; Y505-E523 HydrophobicContact CE1-CG 4.34Å; A521-E523 PolarHBondContact O-N 3.34Å
524	V	90.6	Very high	75.6	Confident	2 Å²	2	55 Å²	55	1%	0.012	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.9	-179.8	-179.7	0	0	0	0	109.2	L504 V506 V554 H557	L504-V524 PolarHBondContact N-O 2.85Å; L504-V524 PolarHBondContact O-N 2.89Å; V506-V524 HydrophobicContact CG2-CB 4.38Å; V506-V524 HydrophobicContact CG2-CG2 3.37Å; V524-V554 HydrophobicContact CG1-CB 4.22Å; V524-V554 HydrophobicContact CG1-CG1 3.73Å; V524-H557 HydrophobicContact CG2-CB 3.5Å; V524-H557 VanDerWaalsContact CG2-CD2 3.49Å; V524-H557 WeakPolarHBondContact CG2-CD2 3.43Å
525	T	92.5	Very high	76.6	Confident	77 Å²	77	57.1 Å²	57.1	47%	0.472	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	125.4	174.1	-56.3	0	0	0	0	109.4	G527	T525-G527 PolarHBondContact O-N 3.45Å
526	I	91.8	Very high	77.7	Confident	2 Å²	2	57.2 Å²	57.2	1%	0.01	33%	0.325	C	S	.	.			trans	-70.9	121.8	-178.8	-62.4	-66.1	0	0	0	109.7	L498 G501 Q502 L504 L529 V551 V554 L564	L498-I526 HydrophobicContact CD1-CD1 4.16Å; L498-I526 HydrophobicContact CD1-CG1 3.93Å; L498-I526 HydrophobicContact CD1-CG2 4.29Å; L498-I526 HydrophobicContact CG-CG2 4.42Å; G501-I526 VanDerWaalsContact CA-O 3.27Å; G501-I526 WeakPolarHBondContact CA-O 3.42Å; G501-I526 PolarHBondContact N-O 3.35Å; Q502-I526 WeakPolarHBondContact O-CB 3.48Å; Q502-I526 VanDerWaalsContact O-CG1 3.25Å; Q502-I526 WeakPolarHBondContact O-CG1 3.37Å; Q502-I526 PolarHBondContact O-N 3.47Å; L504-I526 HydrophobicContact CD1-CD1 3.82Å; L504-I526 HydrophobicContact CD1-CG1 3.98Å; L504-I526 HydrophobicContact CG-CD1 4.38Å; L504-I526 HydrophobicContact CG-CG1 4.12Å; I526-L529 HydrophobicContact CG2-CD2 3.62Å; I526-L529 HydrophobicContact CG2-CG 4.26Å; I526-V551 HydrophobicContact CD1-CG1 3.81Å; I526-V551 HydrophobicContact CG2-CG1 3.92Å; I526-V554 HydrophobicContact CD1-CG1 4.1Å; I526-L564 HydrophobicContact CD1-CD1 4.27Å
527	G	89.7	Confident	79.5	Confident	22 Å²	22	56 Å²	56	23%	0.227	31%	0.313	C	S	.	.			trans	-79.1	-140.3	175	0	0	0	0	0	112.1	K500 T525 A552	K500-G527 WeakPolarHBondContact CG-O 3.27Å; T525-G527 PolarHBondContact O-N 3.45Å; G527-A552 VanDerWaalsContact CA-O 3.22Å; G527-A552 WeakPolarHBondContact CA-O 3.38Å; G527-A552 PolarHBondContact N-O 3.14Å
528	D	91.2	Very high	81.5	Confident	71 Å²	71	49.5 Å²	49.5	38%	0.38	28%	0.277	S	S	.	.			trans	-69.9	142.9	177.2	-68.2	-51.1	0	0	0	112.3	K500 F530 A552	K500-D528 WeakPolarHBondContact CD-OD1 3.42Å; K500-D528 WeakPolarHBondContact CE-OD1 3.42Å; K500-D528 IonicContact NZ-OD1 3.79Å; K500-D528 PolarHBondContact NZ-OD1 2.95Å; D528-F530 HydrophobicContact CB-CD2 4.41Å; D528-F530 HydrophobicContact CB-CE2 3.44Å; D528-F530 VanDerWaalsContact CB-CE2 3.44Å; D528-F530 HydrophobicContact CB-CZ 3.5Å; D528-A552 HydrophobicContact CB-CB 4.34Å; D528-A552 PolarHBondContact O-N 3.35Å
529	L	92.5	Very high	83.3	Confident	1 Å²	1	49 Å²	49	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	139.2	176.3	-58.5	176.4	0	0	0	109.6	L498 I526 P539 V540 V549 C550 V551	L498-L529 HydrophobicContact CD2-CD1 4.37Å; L498-L529 HydrophobicContact CD2-CD2 3.64Å; L498-L529 HydrophobicContact CG-CD1 4.13Å; L498-L529 HydrophobicContact CG-CD2 4.12Å; I526-L529 HydrophobicContact CG2-CD2 3.62Å; I526-L529 HydrophobicContact CG2-CG 4.26Å; L529-P539 WeakPolarHBondContact O-CA 3.48Å; L529-V540 HydrophobicContact CB-CG2 3.78Å; L529-V540 WeakPolarHBondContact CB-O 3.45Å; L529-V540 PolarHBondContact O-N 2.8Å; L529-V549 HydrophobicContact CB-CG2 4.34Å; L529-V549 HydrophobicContact CD2-CG2 4.14Å; L529-C550 CarbonylContact C-O 3.35Å; L529-C550 WeakPolarHBondContact CA-O 3.44Å; L529-V551 HydrophobicContact CD2-CB 4.3Å; L529-V551 HydrophobicContact CD2-CG1 4.05Å; L529-V551 HydrophobicContact CD2-CG2 3.87Å
530	F	91.6	Very high	84.9	Confident	9 Å²	9	45.4 Å²	45.4	4%	0.039	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	148.1	179.5	-52.6	-90.7	0	0	0	111.7	L459 V488 D528 Y537 E538 P539 C550 A552	L459-F530 HydrophobicContact CB-CE1 4.49Å; L459-F530 HydrophobicContact CB-CZ 4.34Å; L459-F530 HydrophobicContact CD2-CD1 4.32Å; L459-F530 HydrophobicContact CD2-CD2 4.41Å; L459-F530 HydrophobicContact CD2-CE1 4.05Å; L459-F530 HydrophobicContact CD2-CE2 4.15Å; L459-F530 HydrophobicContact CD2-CG 4.5Å; L459-F530 HydrophobicContact CD2-CZ 3.96Å; V488-F530 HydrophobicContact CG1-CD2 4.43Å; D528-F530 HydrophobicContact CB-CD2 4.41Å; D528-F530 HydrophobicContact CB-CE2 3.44Å; D528-F530 VanDerWaalsContact CB-CE2 3.44Å; D528-F530 HydrophobicContact CB-CZ 3.5Å; F530-Y537 HydrophobicContact CB-CD1 4.24Å; F530-E538 CarbonylContact C-O 3.48Å; F530-E538 WeakPolarHBondContact CA-O 3.31Å; F530-P539 HydrophobicContact CD1-CB 4.07Å; F530-P539 HydrophobicContact CE1-CB 4.07Å; F530-C550 HydrophobicContact CB-CB 3.92Å; F530-C550 PolarHBondContact N-O 2.91Å; F530-C550 WeakPolarHBondContact O-CB 3.28Å; F530-C550 PolarHBondContact O-N 2.9Å; F530-A552 HydrophobicContact CE2-CB 4.01Å
531	I	90.5	Very high	86.3	Confident	3 Å²	3	44.1 Å²	44.1	2%	0.015	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	124.9	163.9	-57.5	-61.2	0	0	0	107.9	M533 Y537 E538 V540 V543 L548	I531-M533 HydrophobicContact CG2-SD 4.34Å; I531-M533 PolarHBondContact O-N 2.73Å; I531-Y537 CarbonylContact O-C 3.59Å; I531-E538 HydrophobicContact CB-CB 4.36Å; I531-E538 PolarHBondContact N-O 3.02Å; I531-E538 PolarHBondContact O-N 2.9Å; I531-V540 HydrophobicContact CD1-CG2 4.4Å; I531-V540 HydrophobicContact CG1-CG1 3.77Å; I531-V540 HydrophobicContact CG1-CG2 4.13Å; I531-V543 HydrophobicContact CD1-CG2 4.13Å; I531-L548 WeakPolarHBondContact CD1-O 3.42Å
532	M	87.9	Confident	87.4	Confident	8 Å²	8	43 Å²	43	4%	0.039	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	126.1	178.2	-165	-175.9	-66.2	0	0	109.7	A113 V452 F490 Y537 C550	A113-M532 HydrophobicContact CB-CB 4.27Å; A113-M532 HydrophobicContact CB-CG 4.5Å; A113-M532 HydrophobicContact CB-SD 3.97Å; A113-M532 PolarHBondContact N-SD 2.86Å; A113-M532 CarbonylContact O-C 3.56Å; A113-M532 WeakPolarHBondContact O-CG 3.24Å; V452-M532 HydrophobicContact CG1-CE 4.45Å; V452-M532 HydrophobicContact CG2-CE 4.39Å; F490-M532 HydrophobicContact CD2-CE 4.04Å; F490-M532 HydrophobicContact CE2-CE 4.37Å; F490-M532 HydrophobicContact CG-CE 4.49Å; M532-Y537 HydrophobicContact CB-CE1 4.49Å; M532-Y537 HydrophobicContact CE-CE1 3.96Å; M532-Y537 HydrophobicContact CG-CE1 4.05Å; M532-C550 VanDerWaalsContact CE-SG 3.55Å
533	M	84.6	Confident	87.9	Confident	18 Å²	18	38.8 Å²	38.8	9%	0.089	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	49.5	-179.4	-69.7	-59.4	-58.9	0	0	110	R48 I84 I114 I531 R535 E536 E538	R48-M533 PolarHBondContact NH2-SD 3.37Å; R48-M533 VanDerWaalsContact NH2-SD 3.36Å; I84-M533 HydrophobicContact CD1-CE 3.93Å; I114-M533 HydrophobicContact CD1-CE 4.38Å; I114-M533 HydrophobicContact CG1-CE 3.88Å; I114-M533 HydrophobicContact CG1-SD 4.33Å; I531-M533 HydrophobicContact CG2-SD 4.34Å; I531-M533 PolarHBondContact O-N 2.73Å; M533-R535 PolarHBondContact O-N 3.27Å; M533-E536 HydrophobicContact CB-CB 4.39Å; M533-E536 PolarHBondContact N-O 2.84Å; M533-E538 HydrophobicContact CG-CB 4.41Å
534	G	81.5	Confident	88	Confident	4 Å²	4	35.8 Å²	35.8	4%	0.041	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.8	-102.3	-171.3	0	0	0	0	0	111.5	A113	A113-G534 PolarHBondContact O-N 3.31Å
535	R	74.7	Confident	88.1	Confident	89 Å²	89	35.7 Å²	35.7	34%	0.336	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-19.6	-179.7	-60.1	-178.2	-176	-168.7	-3.8	113.2	Y95 D97 M533	Y95-R535 PolarHBondContact O-NE 3.39Å; D97-R535 PolarHBondContact O-NH2 2.93Å; M533-R535 PolarHBondContact O-N 3.27Å
536	E	78	Confident	88	Confident	110 Å²	110	32 Å²	32	51%	0.514	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	156.6	-175.7	-60.9	-179	-175.8	0	0	111.8	M533	M533-E536 HydrophobicContact CB-CB 4.39Å; M533-E536 PolarHBondContact N-O 2.84Å
537	Y	84.2	Confident	88.1	Confident	13 Å²	13	32 Å²	32	5%	0.051	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	99.3	-178.1	-70	-94.2	0	0	0	110.1	V454 L459 R464 F530 I531 M532 P539 C550	V454-Y537 HydrophobicContact CB-CE2 4.48Å; V454-Y537 HydrophobicContact CG1-CD2 3.93Å; V454-Y537 HydrophobicContact CG1-CE2 3.59Å; V454-Y537 HydrophobicContact CG2-CE1 3.95Å; V454-Y537 HydrophobicContact CG2-CE2 3.99Å; V454-Y537 WeakPolarHBondContact CG2-OH 3.46Å; L459-Y537 HydrophobicContact CD2-CD1 4.47Å; L459-Y537 HydrophobicContact CD2-CD2 4.36Å; L459-Y537 HydrophobicContact CD2-CG 4.03Å; R464-Y537 PolarHBondContact NH1-O 3.32Å; R464-Y537 VanDerWaalsContact NH2-C 3.34Å; R464-Y537 VanDerWaalsContact NH2-N 3.14Å; R464-Y537 PolarHBondContact NH2-O 2.9Å; F530-Y537 HydrophobicContact CB-CD1 4.24Å; I531-Y537 CarbonylContact O-C 3.59Å; M532-Y537 HydrophobicContact CB-CE1 4.49Å; M532-Y537 HydrophobicContact CE-CE1 3.96Å; M532-Y537 HydrophobicContact CG-CE1 4.05Å; Y537-P539 VanDerWaalsContact O-CD 3.32Å; Y537-P539 WeakPolarHBondContact O-CD 3.47Å; Y537-C550 HydrophobicContact CD1-CB 4.49Å
538	E	84.8	Confident	88.3	Confident	32 Å²	32	31.5 Å²	31.5	15%	0.15	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	116	-177	-170.5	-169.5	132.9	0	0	110.2	M45 R48 F530 I531 M533	M45-E538 HydrophobicContact CE-CG 3.94Å; M45-E538 WeakPolarHBondContact CE-OE1 3.35Å; M45-E538 VanDerWaalsContact SD-CD 3.54Å; M45-E538 VanDerWaalsContact SD-OE1 3.32Å; R48-E538 IonicContact CZ-OE2 3.61Å; R48-E538 IonicContact NH1-OE2 2.73Å; R48-E538 PolarHBondContact NH1-OE2 3.31Å; F530-E538 CarbonylContact C-O 3.48Å; F530-E538 WeakPolarHBondContact CA-O 3.31Å; I531-E538 HydrophobicContact CB-CB 4.36Å; I531-E538 PolarHBondContact N-O 3.02Å; I531-E538 PolarHBondContact O-N 2.9Å; M533-E538 HydrophobicContact CG-CB 4.41Å
539	P	88.3	Confident	88.5	Confident	70 Å²	70	28.1 Å²	28.1	46%	0.455	14%	0.14	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	135.9	179.9	29.2	-34.1	0	0	0	110.7	L529 F530 Y537	L529-P539 WeakPolarHBondContact O-CA 3.48Å; F530-P539 HydrophobicContact CD1-CB 4.07Å; F530-P539 HydrophobicContact CE1-CB 4.07Å; Y537-P539 VanDerWaalsContact O-CD 3.32Å; Y537-P539 WeakPolarHBondContact O-CD 3.47Å
540	V	89.2	Confident	88.6	Confident	24 Å²	24	28.1 Å²	28.1	15%	0.145	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	148.6	179.4	-66.9	0	0	0	0	110.6	L529 I531 V543	L529-V540 HydrophobicContact CB-CG2 3.78Å; L529-V540 WeakPolarHBondContact CB-O 3.45Å; L529-V540 PolarHBondContact O-N 2.8Å; I531-V540 HydrophobicContact CD1-CG2 4.4Å; I531-V540 HydrophobicContact CG1-CG1 3.77Å; I531-V540 HydrophobicContact CG1-CG2 4.13Å; V540-V543 HydrophobicContact CG2-CG2 3.61Å
541	E	88.7	Confident	88.6	Confident	164 Å²	164	27.7 Å²	27.7	77%	0.766	14%	0.138	S	C	*	.	S	Bend	trans	-82.4	-30.9	179.2	-64.7	-174.6	164.9	0	0	112.6	K500	K500-E541 PolarHBondContact N-O 3.44Å; K500-E541 VanDerWaalsContact N-O 3.08Å
542	S	91.6	Very high	88.6	Confident	13 Å²	13	28 Å²	28	9%	0.091	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	153.1	-179.5	64.6	0	0	0	0	112.7	K497 L498	K497-S542 WeakPolarHBondContact CE-OG 3.45Å; K497-S542 PolarHBondContact NZ-OG 2.92Å; L498-S542 CarbonylContact O-C 3.44Å; L498-S542 WeakPolarHBondContact O-CA 3.41Å; L498-S542 WeakPolarHBondContact O-CB 3.29Å
543	V	92.5	Very high	88.4	Confident	1 Å²	1	29.2 Å²	29.2	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	129.3	-179.9	-178.7	0	0	0	0	110	V493 L498 I531 V540 N547 V549	V493-V543 HydrophobicContact CG2-CG1 4.23Å; L498-V543 PolarHBondContact N-O 3.22Å; L498-V543 PolarHBondContact O-N 2.9Å; I531-V543 HydrophobicContact CD1-CG2 4.13Å; V540-V543 HydrophobicContact CG2-CG2 3.61Å; V543-N547 HydrophobicContact CG1-CB 3.51Å; V543-V549 HydrophobicContact CB-CB 4.49Å; V543-V549 HydrophobicContact CB-CG2 4.31Å; V543-V549 HydrophobicContact CG1-CB 4.26Å; V543-V549 HydrophobicContact CG2-CB 4.29Å; V543-V549 HydrophobicContact CG2-CG2 3.75Å
544	C	92.5	Very high	88.5	Confident	19 Å²	19	28.3 Å²	28.3	13%	0.128	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	161.1	178.5	-63.9	0	0	0	0	112.5	V439 N547	V439-C544 HydrophobicContact CG2-CB 4.42Å; C544-N547 PolarHBondContact O-N 3.42Å; C544-N547 PolarHBondContact O-ND2 3.25Å
545	A	92.5	Very high	88.5	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.3	142.3	171.5	0	0	0	0	0	113.6	C437 V439 V493 G496	C437-A545 HydrophobicContact CB-CB 3.91Å; V439-A545 HydrophobicContact CG2-CB 4.2Å; V493-A545 HydrophobicContact CG1-CB 4.47Å; V493-A545 CarbonylContact O-C 3.6Å; V493-A545 WeakPolarHBondContact O-CA 3.47Å; G496-A545 PolarHBondContact O-N 2.87Å
546	G	90.4	Very high	88.8	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.4	-12.4	-178.3	0	0	0	0	0	114.9	N60 V493	N60-G546 PolarHBondContact ND2-O 3.06Å; N60-G546 PolarHBondContact OD1-O 2.71Å; V493-G546 PolarHBondContact O-N 2.87Å
547	N	93.4	Very high	89	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.005	17%	0.172	C	C	.	.			trans	-95.4	154.5	-178.3	-67.2	-81	0	0	0	113.1	Q52 I58 V493 V543 C544	Q52-N547 WeakPolarHBondContact CG-OD1 3.3Å; Q52-N547 PolarHBondContact O-ND2 3.47Å; I58-N547 WeakPolarHBondContact CD1-ND2 3.37Å; I58-N547 WeakPolarHBondContact CD1-OD1 3.34Å; V493-N547 PolarHBondContact N-O 3.04Å; V493-N547 VanDerWaalsContact N-O 3.14Å; V543-N547 HydrophobicContact CG1-CB 3.51Å; C544-N547 PolarHBondContact O-N 3.42Å; C544-N547 PolarHBondContact O-ND2 3.25Å
548	L	94.5	Very high	88.9	Confident	11 Å²	11	32.5 Å²	32.5	6%	0.058	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	142.3	165.4	-52.9	-174.6	0	0	0	109.7	N128 V130 L148 F490 A491 R492 I531	N128-L548 HydrophobicContact CB-CD1 3.88Å; N128-L548 HydrophobicContact CB-CG 4.12Å; V130-L548 HydrophobicContact CG2-CD1 3.7Å; L148-L548 HydrophobicContact CB-CD2 3.98Å; F490-L548 HydrophobicContact CE2-CB 4.24Å; F490-L548 HydrophobicContact CZ-CD1 4Å; A491-L548 CarbonylContact O-C 3.54Å; A491-L548 WeakPolarHBondContact O-CA 3.19Å; R492-L548 HydrophobicContact CB-CD2 3.95Å; R492-L548 HydrophobicContact CG-CD2 4.29Å; I531-L548 WeakPolarHBondContact CD1-O 3.42Å
549	V	94.8	Very high	88.4	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	150.2	-176.6	64	0	0	0	0	110.9	A491 V493 L498 L529 V543 V551	A491-V549 HydrophobicContact CB-CG1 4.18Å; A491-V549 PolarHBondContact N-O 2.88Å; A491-V549 PolarHBondContact O-N 3.2Å; V493-V549 HydrophobicContact CG2-CG1 3.86Å; L498-V549 HydrophobicContact CD2-CG1 4.18Å; L529-V549 HydrophobicContact CB-CG2 4.34Å; L529-V549 HydrophobicContact CD2-CG2 4.14Å; V543-V549 HydrophobicContact CB-CB 4.49Å; V543-V549 HydrophobicContact CB-CG2 4.31Å; V543-V549 HydrophobicContact CG1-CB 4.26Å; V543-V549 HydrophobicContact CG2-CB 4.29Å; V543-V549 HydrophobicContact CG2-CG2 3.75Å; V549-V551 HydrophobicContact CG1-CG2 4Å; V549-V551 HydrophobicContact CG2-CG2 4.28Å
550	C	93.6	Very high	88	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122.6	169.5	-77.4	0	0	0	0	108.8	V488 A489 L529 F530 M532 Y537	V488-C550 HydrophobicContact CG1-CB 3.52Å; A489-C550 CarbonylContact O-C 3.47Å; A489-C550 VanDerWaalsContact O-CA 3.26Å; A489-C550 WeakPolarHBondContact O-CA 3.41Å; L529-C550 CarbonylContact C-O 3.35Å; L529-C550 WeakPolarHBondContact CA-O 3.44Å; F530-C550 HydrophobicContact CB-CB 3.92Å; F530-C550 PolarHBondContact N-O 2.91Å; F530-C550 WeakPolarHBondContact O-CB 3.28Å; F530-C550 PolarHBondContact O-N 2.9Å; M532-C550 VanDerWaalsContact CE-SG 3.55Å; Y537-C550 HydrophobicContact CD1-CB 4.49Å
551	V	93.1	Very high	87.7	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	120.1	-174.9	-173.8	0	0	0	0	110.2	A489 L498 I526 L529 V549 V554	A489-V551 HydrophobicContact CB-CB 4.26Å; A489-V551 PolarHBondContact N-O 3.49Å; A489-V551 PolarHBondContact O-N 3.21Å; L498-V551 HydrophobicContact CD2-CG2 3.84Å; I526-V551 HydrophobicContact CD1-CG1 3.81Å; I526-V551 HydrophobicContact CG2-CG1 3.92Å; L529-V551 HydrophobicContact CD2-CB 4.3Å; L529-V551 HydrophobicContact CD2-CG1 4.05Å; L529-V551 HydrophobicContact CD2-CG2 3.87Å; V549-V551 HydrophobicContact CG1-CG2 4Å; V549-V551 HydrophobicContact CG2-CG2 4.28Å; V551-V554 HydrophobicContact CG1-CG1 3.77Å; V551-V554 HydrophobicContact CG1-CG2 4.44Å
552	A	90.5	Very high	87.7	Confident	9 Å²	9	30.6 Å²	30.6	7%	0.074	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	158.6	173.9	0	0	0	0	0	111.8	G527 D528 F530	G527-A552 VanDerWaalsContact CA-O 3.22Å; G527-A552 WeakPolarHBondContact CA-O 3.38Å; G527-A552 PolarHBondContact N-O 3.14Å; D528-A552 HydrophobicContact CB-CB 4.34Å; D528-A552 PolarHBondContact O-N 3.35Å; F530-A552 HydrophobicContact CE2-CB 4.01Å
553	G	83.8	Confident	87.6	Confident	34 Å²	34	30 Å²	30	35%	0.351	16%	0.159	S	C	.	.	S	Bend	trans	86.2	7.2	174.5	0	0	0	0	0	115.1	E555	G553-E555 WeakPolarHBondContact CA-OE2 3.47Å; G553-E555 PolarHBondContact N-OE2 3.31Å
554	V	85.4	Confident	87.6	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.159	C	C	.	.			trans	-105.4	-2.7	-178	-58.4	0	0	0	0	113.2	M451 A489 V524 I526 V551 K556 H557 I558	M451-V554 HydrophobicContact CE-CG2 4.27Å; A489-V554 HydrophobicContact CB-CG2 3.43Å; A489-V554 VanDerWaalsContact CB-CG2 3.43Å; V524-V554 HydrophobicContact CG1-CB 4.22Å; V524-V554 HydrophobicContact CG1-CG1 3.73Å; I526-V554 HydrophobicContact CD1-CG1 4.1Å; V551-V554 HydrophobicContact CG1-CG1 3.77Å; V551-V554 HydrophobicContact CG1-CG2 4.44Å; V554-K556 VanDerWaalsContact C-N 3.25Å; V554-K556 PolarHBondContact O-N 3.07Å; V554-H557 PolarHBondContact O-N 2.9Å; V554-H557 VanDerWaalsContact O-N 3.14Å; V554-I558 HydrophobicContact CB-CD1 3.77Å; V554-I558 HydrophobicContact CB-CG1 4.43Å; V554-I558 HydrophobicContact CG2-CD1 3.65Å; V554-I558 PolarHBondContact O-N 3.03Å
555	E	82.3	Confident	87.6	Confident	60 Å²	60	29 Å²	29	28%	0.28	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-22	-171.3	63.9	-81.5	-178.7	0	0	115	M451 F487 G553 H557	M451-E555 HydrophobicContact CE-CB 3.71Å; F487-E555 HydrophobicContact CB-CB 3.84Å; F487-E555 HydrophobicContact CB-CG 4.44Å; G553-E555 WeakPolarHBondContact CA-OE2 3.47Å; G553-E555 PolarHBondContact N-OE2 3.31Å; E555-H557 VanDerWaalsContact C-N 3.34Å
556	K	81.4	Confident	87.5	Confident	180 Å²	180	31.4 Å²	31.4	78%	0.783	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-18	178.6	-65	-178.2	-178.1	175.7	0	113.5	V554	V554-K556 VanDerWaalsContact C-N 3.25Å; V554-K556 PolarHBondContact O-N 3.07Å
557	H	82.4	Confident	87.3	Confident	59 Å²	59	32.9 Å²	32.9	27%	0.273	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-14.9	-169.6	-55.6	-75	0	0	0	112.7	V506 Q522 V524 V554 E555	V506-H557 HydrophobicContact CG2-CB 4.1Å; Q522-H557 VanDerWaalsContact CD-ND1 3.28Å; Q522-H557 PolarHBondContact NE2-ND1 3.22Å; V524-H557 HydrophobicContact CG2-CB 3.5Å; V524-H557 VanDerWaalsContact CG2-CD2 3.49Å; V524-H557 WeakPolarHBondContact CG2-CD2 3.43Å; V554-H557 PolarHBondContact O-N 2.9Å; V554-H557 VanDerWaalsContact O-N 3.14Å; E555-H557 VanDerWaalsContact C-N 3.34Å
558	I	81.1	Confident	86.8	Confident	4 Å²	4	34.4 Å²	34.4	2%	0.021	19%	0.186	C	C	.	.			trans	-112.9	129.9	-176.1	-57.9	179.7	0	0	0	108.9	V448 M451 V554 A562 L564 L608	V448-I558 HydrophobicContact CB-CD1 4.26Å; V448-I558 HydrophobicContact CG1-CD1 4.25Å; V448-I558 HydrophobicContact CG1-CG2 4.34Å; V448-I558 HydrophobicContact CG2-CD1 3.83Å; M451-I558 HydrophobicContact SD-CB 4.39Å; M451-I558 HydrophobicContact SD-CG2 4.19Å; V554-I558 HydrophobicContact CB-CD1 3.77Å; V554-I558 HydrophobicContact CB-CG1 4.43Å; V554-I558 HydrophobicContact CG2-CD1 3.65Å; V554-I558 PolarHBondContact O-N 3.03Å; I558-A562 HydrophobicContact CB-CB 4.38Å; I558-A562 HydrophobicContact CD1-CB 4.14Å; I558-A562 HydrophobicContact CG1-CB 3.9Å; I558-A562 HydrophobicContact CG2-CB 3.84Å; I558-L564 HydrophobicContact CD1-CD1 4.44Å; I558-L564 HydrophobicContact CD1-CD2 4.24Å; I558-L608 WeakPolarHBondContact O-CD2 3.47Å
559	L	75	Confident	86.1	Confident	141 Å²	141	36.8 Å²	36.8	74%	0.738	20%	0.199	S	C	*	.	S	Bend	trans	-85.3	-60.6	175.5	-67.3	174.1	0	0	0	112.3	L608	L559-L608 WeakPolarHBondContact O-CD2 3.49Å
560	K	78.4	Confident	85.4	Confident	58 Å²	58	36.7 Å²	36.7	25%	0.252	20%	0.198	S	C	.	.	S	Bend	trans	-132.7	-58.8	-177.2	-67.8	-174.4	169	-160.7	0	110.9	P611 V613	K560-P611 PolarHBondContact NZ-O 3.09Å; K560-V613 PolarHBondContact NZ-O 3.45Å
561	S	84.4	Confident	84.7	Confident	40 Å²	40	36.8 Å²	36.8	28%	0.28	20%	0.199	S	C	.	.			trans	-130.2	154.7	171.8	55.7	0	0	0	0	108.9	V448	V448-S561 WeakPolarHBondContact O-CA 3.37Å; V448-S561 WeakPolarHBondContact O-CB 3.5Å
562	A	87.7	Confident	84	Confident	11 Å²	11	37.6 Å²	37.6	9%	0.091	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	151.8	176.6	0	0	0	0	0	110.8	V448 V506 I558 L564	V448-A562 PolarHBondContact N-O 3.21Å; V448-A562 PolarHBondContact O-N 3.14Å; V448-A562 VanDerWaalsContact O-N 3.15Å; V506-A562 HydrophobicContact CG1-CB 4.32Å; I558-A562 HydrophobicContact CB-CB 4.38Å; I558-A562 HydrophobicContact CD1-CB 4.14Å; I558-A562 HydrophobicContact CG1-CB 3.9Å; I558-A562 HydrophobicContact CG2-CB 3.84Å; A562-L564 HydrophobicContact CB-CD2 4.48Å
563	T	90.2	Very high	83.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	126.8	164.9	-61.4	0	0	0	0	108.4	I445 I507 L573	I445-T563 HydrophobicContact CG2-CG2 4.24Å; I507-T563 HydrophobicContact CB-CG2 4.27Å; I507-T563 WeakPolarHBondContact CB-O 3.39Å; I507-T563 HydrophobicContact CG1-CG2 4.03Å; I507-T563 PolarHBondContact N-O 3.02Å; T563-L573 HydrophobicContact CG2-CB 4.43Å; T563-L573 HydrophobicContact CG2-CD1 4.02Å; T563-L573 HydrophobicContact CG2-CG 3.84Å; T563-L573 WeakPolarHBondContact OG1-CA 3.33Å; T563-L573 VanDerWaalsContact OG1-CB 3.26Å; T563-L573 WeakPolarHBondContact OG1-CB 3.35Å; T563-L573 PolarHBondContact OG1-N 3.27Å
564	L	92.1	Very high	82.7	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	133.8	172.9	-48.2	177.2	0	0	0	108.2	I445 V446 V448 L504 Y505 V506 I526 I558 A562	I445-L564 WeakPolarHBondContact CA-O 3.44Å; V446-L564 HydrophobicContact CB-CB 4.24Å; V446-L564 PolarHBondContact N-O 2.97Å; V446-L564 PolarHBondContact O-N 3.19Å; V448-L564 HydrophobicContact CG2-CD1 4.06Å; V448-L564 HydrophobicContact CG2-CG 4.35Å; L504-L564 HydrophobicContact CB-CB 4.29Å; L504-L564 HydrophobicContact CD1-CB 3.81Å; L504-L564 HydrophobicContact CD1-CD1 4.46Å; Y505-L564 CarbonylContact O-C 3.5Å; Y505-L564 VanDerWaalsContact O-CA 3.31Å; Y505-L564 WeakPolarHBondContact O-CA 3.45Å; V506-L564 HydrophobicContact CB-CD2 4.26Å; V506-L564 HydrophobicContact CG2-CD2 3.51Å; I526-L564 HydrophobicContact CD1-CD1 4.27Å; I558-L564 HydrophobicContact CD1-CD1 4.44Å; I558-L564 HydrophobicContact CD1-CD2 4.24Å; A562-L564 HydrophobicContact CB-CD2 4.48Å
565	S	92.1	Very high	81.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	147.6	179.8	176.4	0	0	0	0	112.3	T444 Y505 S567 C570	T444-S565 VanDerWaalsContact O-CA 3.24Å; T444-S565 WeakPolarHBondContact O-CA 3.4Å; Y505-S565 PolarHBondContact N-O 3.28Å; Y505-S565 PolarHBondContact O-N 3.09Å; S565-S567 VanDerWaalsContact C-N 3.28Å; S565-S567 WeakPolarHBondContact CB-O 3.37Å; S565-S567 PolarHBondContact OG-N 2.8Å; S565-S567 PolarHBondContact OG-O 2.88Å; S565-C570 WeakPolarHBondContact OG-CB 3.4Å
566	T	91.7	Very high	80.8	Confident	49 Å²	49	38.8 Å²	38.8	30%	0.301	21%	0.209	S	C	.	.	S	Bend	trans	-70.4	-27.2	167.7	51	0	0	0	0	112.4	P443 T444 L504 Y505	P443-T566 VanDerWaalsContact CA-OG1 3.26Å; P443-T566 WeakPolarHBondContact CA-OG1 3.33Å; P443-T566 WeakPolarHBondContact CB-OG1 3.39Å; T444-T566 PolarHBondContact N-OG1 3.17Å; T444-T566 PolarHBondContact O-N 3.43Å; T444-T566 VanDerWaalsContact O-N 3.11Å; L504-T566 HydrophobicContact CD2-CG2 3.34Å; Y505-T566 WeakPolarHBondContact CE2-O 3.41Å
567	S	86.3	Confident	79.9	Confident	32 Å²	32	35.6 Å²	35.6	22%	0.224	20%	0.196	C	C	.	.			trans	-107.5	135.9	175.8	174.5	0	0	0	0	110.7	S565 D569 C570	S565-S567 VanDerWaalsContact C-N 3.28Å; S565-S567 WeakPolarHBondContact CB-O 3.37Å; S565-S567 PolarHBondContact OG-N 2.8Å; S565-S567 PolarHBondContact OG-O 2.88Å; S567-D569 VanDerWaalsContact C-N 3.3Å; S567-D569 WeakPolarHBondContact OG-CB 3.46Å; S567-D569 PolarHBondContact OG-N 2.93Å; S567-D569 VanDerWaalsContact OG-N 3.15Å; S567-D569 PolarHBondContact OG-OD2 3.44Å; S567-C570 WeakPolarHBondContact O-CB 3.45Å
568	L	83	Confident	78.9	Confident	33 Å²	33	34.5 Å²	34.5	17%	0.173	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-11.2	176.3	-79.7	166.4	0	0	0	113	Y505 I507 H515 A521 C570	Y505-L568 HydrophobicContact CD1-CD1 4.23Å; Y505-L568 HydrophobicContact CD1-CD2 4.29Å; Y505-L568 HydrophobicContact CD1-CG 4.31Å; Y505-L568 HydrophobicContact CD2-CD1 4.24Å; Y505-L568 HydrophobicContact CD2-CD2 4.3Å; Y505-L568 HydrophobicContact CD2-CG 3.79Å; Y505-L568 HydrophobicContact CE1-CD1 4.29Å; Y505-L568 HydrophobicContact CE2-CD1 4.3Å; Y505-L568 HydrophobicContact CE2-CG 4.27Å; Y505-L568 HydrophobicContact CG-CD1 4.19Å; Y505-L568 HydrophobicContact CG-CD2 3.83Å; Y505-L568 HydrophobicContact CG-CG 3.8Å; I507-L568 HydrophobicContact CD1-CD2 4.09Å; H515-L568 WeakPolarHBondContact CE1-CB 3.27Å; H515-L568 WeakPolarHBondContact CE1-CD1 3.28Å; H515-L568 WeakPolarHBondContact NE2-CB 3.32Å; A521-L568 HydrophobicContact CB-CD1 3.65Å; A521-L568 HydrophobicContact CB-CD2 3.48Å; A521-L568 VanDerWaalsContact CB-CD2 3.48Å; A521-L568 HydrophobicContact CB-CG 4.2Å; L568-C570 PolarHBondContact O-N 2.82Å
569	D	77.9	Confident	78.2	Confident	60 Å²	60	37.8 Å²	37.8	32%	0.321	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-6.8	169.5	-58.8	-54.1	0	0	0	112.8	A426 G513 H515 S567	A426-D569 HydrophobicContact CB-CB 3.95Å; G513-D569 WeakPolarHBondContact CA-O 3.35Å; H515-D569 IonicContact CD2-OD1 3.15Å; H515-D569 PolarHBondContact CD2-OD1 3.5Å; H515-D569 IonicContact NE2-OD1 2.83Å; S567-D569 VanDerWaalsContact C-N 3.3Å; S567-D569 WeakPolarHBondContact OG-CB 3.46Å; S567-D569 PolarHBondContact OG-N 2.93Å; S567-D569 VanDerWaalsContact OG-N 3.15Å; S567-D569 PolarHBondContact OG-OD2 3.44Å
570	C	80.3	Confident	78	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.177	C	C	.	.	S	Bend	trans	-70.9	127.6	175.8	-173.7	0	0	0	0	110.2	L430 I507 S565 S567 L568	L430-C570 HydrophobicContact CD1-CB 4.09Å; I507-C570 HydrophobicContact CD1-CB 4.39Å; I507-C570 HydrophobicContact CG1-CB 4.33Å; I507-C570 VanDerWaalsContact CG2-O 3.27Å; I507-C570 WeakPolarHBondContact CG2-O 3.46Å; S565-C570 WeakPolarHBondContact OG-CB 3.4Å; S567-C570 WeakPolarHBondContact O-CB 3.45Å; L568-C570 PolarHBondContact O-N 2.82Å
571	P	78.7	Confident	77.8	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.013	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-68.8	157.9	169.3	30.7	-33.7	0	0	0	110.1	L412 L423 A427 S511 L573	L412-P571 HydrophobicContact CB-CG 4.42Å; L412-P571 HydrophobicContact CD2-CG 3.74Å; L423-P571 HydrophobicContact CD2-CB 4.4Å; A427-P571 HydrophobicContact CB-CG 4.14Å; S511-P571 WeakPolarHBondContact O-CA 3.44Å; P571-L573 PolarHBondContact O-N 2.92Å
572	S	78.8	Confident	77.7	Confident	16 Å²	16	33.5 Å²	33.5	11%	0.112	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-63.7	124.2	170.1	-175.7	0	0	0	0	109.1	G414 P508 S511	G414-S572 WeakPolarHBondContact CA-O 3.48Å; P508-S572 WeakPolarHBondContact O-CB 3.44Å; S511-S572 PolarHBondContact O-N 2.82Å
573	L	78.3	Confident	77.6	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.021	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-70.4	150.7	170.5	-56.1	173.8	0	0	0	109.5	L411 L412 I445 F447 F494 T563 P571	L411-L573 HydrophobicContact CB-CD2 4.48Å; L411-L573 WeakPolarHBondContact O-CA 3.11Å; L412-L573 HydrophobicContact CD2-CD2 4Å; I445-L573 HydrophobicContact CG2-CD1 3.75Å; F447-L573 HydrophobicContact CB-CD1 3.93Å; F447-L573 HydrophobicContact CD2-CB 3.68Å; F447-L573 HydrophobicContact CD2-CD1 4.28Å; F447-L573 HydrophobicContact CE2-CB 4.04Å; F447-L573 HydrophobicContact CG-CB 4.39Å; F447-L573 HydrophobicContact CG-CD1 4.4Å; F494-L573 HydrophobicContact CD2-CD1 3.96Å; F494-L573 HydrophobicContact CE2-CD1 4.15Å; T563-L573 HydrophobicContact CG2-CB 4.43Å; T563-L573 HydrophobicContact CG2-CD1 4.02Å; T563-L573 HydrophobicContact CG2-CG 3.84Å; T563-L573 WeakPolarHBondContact OG1-CA 3.33Å; T563-L573 VanDerWaalsContact OG1-CB 3.26Å; T563-L573 WeakPolarHBondContact OG1-CB 3.35Å; T563-L573 PolarHBondContact OG1-N 3.27Å; P571-L573 PolarHBondContact O-N 2.92Å
574	C	69.2	Low	77.5	Confident	11 Å²	11	33.4 Å²	33.4	7%	0.074	18%	0.184	C	C	.	.			trans	8.2	122.4	171.7	-161	0	0	0	0	118.3	V147 L411 F447	V147-C574 HydrophobicContact CG1-CB 4.44Å; L411-C574 HydrophobicContact CD2-CB 4.22Å; L411-C574 PolarHBondContact O-N 2.87Å; L411-C574 VanDerWaalsContact O-N 3.16Å; F447-C574 HydrophobicContact CZ-CB 4.26Å; F447-C574 WeakPolarHBondContact CZ-O 3.34Å
575	S	63	Low	77.4	Confident	72 Å²	72	36.4 Å²	36.4	50%	0.503	20%	0.195	S	C	.	.			trans	-81.9	120.9	163.4	-179.6	0	0	0	0	110.3	K577	S575-K577 PolarHBondContact O-N 2.84Å
576	L	65.7	Low	77.5	Confident	41 Å²	41	36.4 Å²	36.4	22%	0.215	20%	0.195	C	C	.	.			trans	-66.2	93.4	175.3	-72.3	168.6	0	0	0	110.2	V147 S449 A578	V147-L576 HydrophobicContact CB-CD2 4.44Å; V147-L576 HydrophobicContact CG2-CD2 3.66Å; S449-L576 WeakPolarHBondContact O-CD1 3.22Å; L576-A578 PolarHBondContact O-N 3.1Å
577	K	61.8	Low	77.5	Confident	114 Å²	114	34.4 Å²	34.4	50%	0.496	18%	0.183	S	C	.	.			trans	-86.5	100.6	165.9	-67	-168.2	177.1	-168	0	108.4	S575 D718	S575-K577 PolarHBondContact O-N 2.84Å; K577-D718 IonicContact NZ-OD2 3.41Å; K577-D718 PolarHBondContact NZ-OD2 3.37Å
578	A	60.9	Low	77.8	Confident	36 Å²	36	32.9 Å²	32.9	30%	0.298	17%	0.172	S	C	.	.			trans	-58.9	138.9	169.4	0	0	0	0	0	109.5	L576 A580 C612	L576-A578 PolarHBondContact O-N 3.1Å; A578-A580 VanDerWaalsContact C-N 3.3Å; A578-A580 PolarHBondContact O-N 2.85Å; A578-C612 VanDerWaalsContact CB-SG 3.52Å
579	Y	66.4	Low	78.2	Confident	73 Å²	73	34.7 Å²	34.7	29%	0.286	18%	0.18	S	C	.	.	S	Bend	trans	-74.3	-22.9	179.9	82.9	-101.2	0	0	0	112.6	A136 S139 Q165 A168 V962	A136-Y579 WeakPolarHBondContact CA-OH 2.97Å; S139-Y579 VanDerWaalsContact CB-CD1 3.48Å; S139-Y579 VanDerWaalsContact CB-CZ 3.47Å; Q165-Y579 PolarHBondContact NE2-OH 3.29Å; Q165-Y579 VanDerWaalsContact NE2-OH 3.09Å; Q165-Y579 PolarHBondContact OE1-OH 2.66Å; A168-Y579 HydrophobicContact CB-CE1 4.36Å; A168-Y579 HydrophobicContact CB-CE2 4.26Å; Y579-V962 HydrophobicContact CE2-CG1 4.48Å
580	A	71.2	Confident	78.9	Confident	7 Å²	7	32.7 Å²	32.7	6%	0.058	17%	0.17	C	C	.	.	S	Bend	trans	-103.1	126.1	175.4	0	0	0	0	0	110.4	S139 A578 V628	S139-A580 VanDerWaalsContact OG-CB 3.3Å; S139-A580 WeakPolarHBondContact OG-CB 3.14Å; A578-A580 VanDerWaalsContact C-N 3.3Å; A578-A580 PolarHBondContact O-N 2.85Å; A580-V628 HydrophobicContact CB-CG1 3.57Å
581	E	74	Confident	79.5	Confident	114 Å²	114	38.8 Å²	38.8	53%	0.533	20%	0.199	S	C	.	.	P	Polyproline II helix	trans	-78.4	134.6	178.1	-63.3	-163.1	152.3	0	0	111.4	I583 F963	E581-I583 HydrophobicContact CB-CD1 4.49Å; E581-I583 HydrophobicContact CB-CG1 4.4Å; E581-I583 PolarHBondContact O-N 3.03Å; E581-F963 HydrophobicContact CB-CD1 4.38Å
582	P	82.7	Confident	80	Confident	27 Å²	27	44.5 Å²	44.5	18%	0.175	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-74.3	116	174.4	31.2	-34.1	0	0	0	110.5	K614 V626 T627 V628	P582-K614 HydrophobicContact CG-CD 4.12Å; P582-V626 HydrophobicContact CB-CG1 4Å; P582-V626 WeakPolarHBondContact O-CG1 3.31Å; P582-T627 CarbonylContact C-O 3.6Å; P582-T627 VanDerWaalsContact CA-O 3.26Å; P582-T627 WeakPolarHBondContact CA-O 3.27Å; P582-V628 HydrophobicContact CB-CG2 4.35Å
583	I	85.7	Confident	80.6	Confident	9 Å²	9	48 Å²	48	5%	0.046	26%	0.256	C	S	.	.			trans	-122.3	-34.9	-172.5	-67.8	174	0	0	0	112.7	E581 R585 T627 P658 P892 V939 F963	E581-I583 HydrophobicContact CB-CD1 4.49Å; E581-I583 HydrophobicContact CB-CG1 4.4Å; E581-I583 PolarHBondContact O-N 3.03Å; I583-R585 PolarHBondContact O-N 2.85Å; I583-T627 PolarHBondContact N-O 3.32Å; I583-P658 HydrophobicContact CG2-CG 4Å; I583-P658 VanDerWaalsContact O-CD 3.27Å; I583-P658 WeakPolarHBondContact O-CD 3.3Å; I583-P892 HydrophobicContact CG2-CB 4.4Å; I583-P892 HydrophobicContact CG2-CG 4.24Å; I583-V939 HydrophobicContact CG2-CG1 4.35Å; I583-F963 HydrophobicContact CD1-CB 3.64Å; I583-F963 HydrophobicContact CD1-CD1 3.63Å; I583-F963 HydrophobicContact CD1-CD2 3.02Å; I583-F963 HydrophobicContact CD1-CE1 4.01Å; I583-F963 HydrophobicContact CD1-CE2 3.47Å; I583-F963 VanDerWaalsContact CD1-CE2 3.47Å; I583-F963 HydrophobicContact CD1-CG 3.1Å; I583-F963 HydrophobicContact CD1-CZ 3.94Å
584	V	88.3	Confident	81.2	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.2	-177.6	176.1	0	0	0	0	108.8	V626 T627 L633 P655 F943	V584-V626 CarbonylContact O-C 3.1Å; V584-V626 VanDerWaalsContact O-CA 3.26Å; V584-V626 WeakPolarHBondContact O-CA 3.4Å; V584-T627 PolarHBondContact N-O 2.98Å; V584-T627 PolarHBondContact O-N 3.33Å; V584-L633 HydrophobicContact CG1-CD2 3.94Å; V584-P655 HydrophobicContact CG1-CB 4.31Å; V584-F943 HydrophobicContact CB-CZ 4.48Å; V584-F943 HydrophobicContact CG1-CE1 3.76Å; V584-F943 HydrophobicContact CG1-CZ 3.78Å; V584-F943 HydrophobicContact CG2-CE1 4.17Å; V584-F943 HydrophobicContact CG2-CZ 3.97Å
585	R	90.5	Very high	82.3	Confident	63 Å²	63	53.3 Å²	53.3	24%	0.238	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	150.2	-179.5	-52.6	-170	-176.1	164.6	5.3	110.9	I583 E618 V624 L625 V626 I656	I583-R585 PolarHBondContact O-N 2.85Å; R585-E618 IonicContact NH1-OE1 3.43Å; R585-V624 HydrophobicContact CB-CG1 3.82Å; R585-V624 HydrophobicContact CG-CG1 4.38Å; R585-L625 CarbonylContact C-O 3.6Å; R585-L625 VanDerWaalsContact CA-O 3.27Å; R585-L625 WeakPolarHBondContact CA-O 3.48Å; R585-V626 HydrophobicContact CB-CG2 4.49Å; R585-V626 HydrophobicContact CG-CB 4.49Å; R585-V626 HydrophobicContact CG-CG1 4.09Å; R585-V626 HydrophobicContact CG-CG2 3.87Å; R585-I656 HydrophobicContact CB-CB 4Å; R585-I656 HydrophobicContact CB-CG2 4.21Å; R585-I656 WeakPolarHBondContact CB-O 3.09Å; R585-I656 PolarHBondContact N-O 2.84Å; R585-I656 WeakPolarHBondContact O-CA 3.02Å; R585-I656 WeakPolarHBondContact O-CB 3.33Å; R585-I656 PolarHBondContact O-N 2.92Å
586	V	92.4	Very high	83.7	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.006	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	133.6	172.5	169	0	0	0	0	109	V588 V624 L625 L633 V652	V586-V588 HydrophobicContact CG1-CG2 4.12Å; V586-V624 WeakPolarHBondContact O-CA 3.47Å; V586-L625 PolarHBondContact N-O 3.3Å; V586-L625 PolarHBondContact O-N 3.19Å; V586-L633 HydrophobicContact CB-CD1 4.08Å; V586-L633 HydrophobicContact CG2-CD1 3.65Å; V586-L633 HydrophobicContact CG2-CD2 3.47Å; V586-L633 VanDerWaalsContact CG2-CD2 3.47Å; V586-L633 HydrophobicContact CG2-CG 4.15Å; V586-V652 HydrophobicContact CG1-CB 4.5Å; V586-V652 HydrophobicContact CG1-CG1 3.22Å
587	S	91.7	Very high	84.9	Confident	6 Å²	6	55 Å²	55	4%	0.042	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	128.5	169.4	-53.9	0	0	0	0	109	E622 H623 S653	S587-E622 WeakPolarHBondContact CB-OE2 2.81Å; S587-E622 PolarHBondContact OG-OE2 2.83Å; S587-H623 CarbonylContact C-O 3.57Å; S587-H623 WeakPolarHBondContact CA-O 3.36Å; S587-S653 PolarHBondContact N-OG 3.38Å; S587-S653 PolarHBondContact O-N 2.71Å
588	V	93.3	Very high	86.2	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	122	179.7	-174.9	0	0	0	0	108.4	V586 L599 H623 L625 L637 L640 L650	V586-V588 HydrophobicContact CG1-CG2 4.12Å; V588-L599 HydrophobicContact CG1-CD1 3.89Å; V588-L599 HydrophobicContact CG1-CD2 4.32Å; V588-H623 PolarHBondContact N-O 3.46Å; V588-H623 WeakPolarHBondContact O-CB 3.46Å; V588-L625 HydrophobicContact CG2-CB 4.29Å; V588-L637 HydrophobicContact CG2-CD2 4.18Å; V588-L640 HydrophobicContact CG1-CD2 4.01Å; V588-L650 HydrophobicContact CG1-CB 4.41Å; V588-L650 HydrophobicContact CG1-CD1 4.2Å; V588-L650 HydrophobicContact CG1-CD2 4.27Å
589	E	92	Very high	87.7	Confident	71 Å²	71	51.1 Å²	51.1	33%	0.332	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147.7	177.6	-63.4	-178	152	0	0	109.5	L650 K651	E589-L650 CarbonylContact O-C 3.45Å; E589-K651 PolarHBondContact N-O 2.88Å; E589-K651 PolarHBondContact O-N 2.67Å; E589-K651 IonicContact OE2-NZ 3.14Å
590	P	93.1	Very high	88.9	Confident	18 Å²	18	50.4 Å²	50.4	12%	0.117	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	147.4	168.3	34.8	-32.1	0	0	0	109.1	Q592 D595 L596 L599 I648	P590-Q592 WeakPolarHBondContact CB-O 3.43Å; P590-Q592 WeakPolarHBondContact CG-O 3.38Å; P590-Q592 PolarHBondContact O-N 3.24Å; P590-D595 HydrophobicContact CB-CB 4.06Å; P590-L596 HydrophobicContact CG-CB 4.2Å; P590-L596 HydrophobicContact CG-CD1 4.18Å; P590-L599 HydrophobicContact CG-CD2 4.4Å; P590-I648 HydrophobicContact CB-CG2 4.08Å
591	Q	91.3	Very high	89.7	Confident	129 Å²	129	53 Å²	53	60%	0.603	30%	0.298	S	S	*	.	S	Bend	trans	-63	-34.8	173.4	-74.1	-169.6	16	0	0	111.9	D649	Q591-D649 HydrophobicContact CB-CB 4.2Å; Q591-D649 VanDerWaalsContact CD-CB 3.44Å; Q591-D649 HydrophobicContact CG-CB 3.85Å; Q591-D649 WeakPolarHBondContact CG-O 3.4Å; Q591-D649 PolarHBondContact N-O 2.8Å
592	Q	90.7	Very high	90.4	Very high	121 Å²	121	47.6 Å²	47.6	57%	0.565	27%	0.273	S	S	*	.	S	Bend	trans	-108.7	128.6	175.5	-57.2	-175.5	20.2	0	0	110	P590 S594 D595	P590-Q592 WeakPolarHBondContact CB-O 3.43Å; P590-Q592 WeakPolarHBondContact CG-O 3.38Å; P590-Q592 PolarHBondContact O-N 3.24Å; Q592-S594 PolarHBondContact O-N 3Å; Q592-S594 VanDerWaalsContact O-N 3.13Å; Q592-D595 PolarHBondContact O-N 3.43Å; Q592-D595 VanDerWaalsContact O-N 3.08Å
593	A	90.8	Very high	90.8	Very high	91 Å²	91	46.8 Å²	46.8	75%	0.752	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-62.5	-21.6	-179.2	0	0	0	0	0	113.6	D595 L596	A593-D595 PolarHBondContact O-N 2.88Å; A593-L596 WeakPolarHBondContact O-CB 3.38Å; A593-L596 PolarHBondContact O-N 3.01Å
594	S	91.7	Very high	91	Very high	83 Å²	83	53.1 Å²	53.1	58%	0.58	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-61	-28.9	174.4	49.8	0	0	0	0	113.2	Q592 L596 P597	Q592-S594 PolarHBondContact O-N 3Å; Q592-S594 VanDerWaalsContact O-N 3.13Å; S594-L596 VanDerWaalsContact C-N 3.31Å; S594-L596 PolarHBondContact O-N 3.42Å; S594-P597 VanDerWaalsContact O-CD 3.29Å; S594-P597 WeakPolarHBondContact O-CD 3.17Å
595	D	92.1	Very high	91	Very high	42 Å²	42	55.6 Å²	55.6	23%	0.225	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-91.2	0.8	-171.9	-57.1	-20.8	0	0	0	112.4	P590 Q592 A593 P597 T598 L599 I648	P590-D595 HydrophobicContact CB-CB 4.06Å; Q592-D595 PolarHBondContact O-N 3.43Å; Q592-D595 VanDerWaalsContact O-N 3.08Å; A593-D595 PolarHBondContact O-N 2.88Å; D595-P597 VanDerWaalsContact C-CD 3.45Å; D595-T598 WeakPolarHBondContact O-CB 3.27Å; D595-T598 PolarHBondContact O-N 3.47Å; D595-T598 VanDerWaalsContact O-N 3.07Å; D595-L599 PolarHBondContact O-N 3.39Å; D595-I648 HydrophobicContact CB-CD1 3.89Å; D595-I648 HydrophobicContact CB-CG1 3.95Å; D595-I648 HydrophobicContact CB-CG2 3.81Å
596	L	91.3	Very high	91	Very high	62 Å²	62	52.6 Å²	52.6	33%	0.325	30%	0.296	S	S	.	.	H	α-helix	trans	-54.2	-42.9	179.3	-174	65.6	0	0	0	113.8	P590 A593 S594 T598 L599 I600	P590-L596 HydrophobicContact CG-CB 4.2Å; P590-L596 HydrophobicContact CG-CD1 4.18Å; A593-L596 WeakPolarHBondContact O-CB 3.38Å; A593-L596 PolarHBondContact O-N 3.01Å; S594-L596 VanDerWaalsContact C-N 3.31Å; S594-L596 PolarHBondContact O-N 3.42Å; L596-T598 VanDerWaalsContact C-N 3.27Å; L596-T598 PolarHBondContact O-N 3.29Å; L596-L599 HydrophobicContact CD1-CD2 4.41Å; L596-L599 PolarHBondContact O-N 2.51Å; L596-I600 HydrophobicContact CD1-CD1 4.45Å; L596-I600 HydrophobicContact CG-CD1 4.01Å; L596-I600 WeakPolarHBondContact O-CG1 3.38Å; L596-I600 PolarHBondContact O-N 3.23Å
597	P	90.9	Very high	90.7	Very high	88 Å²	88	54 Å²	54	57%	0.571	31%	0.305	S	S	*	.	H	α-helix	trans	-60.4	-37.7	176.8	-23.4	35.5	0	0	0	112.8	S594 D595 I600 S601	S594-P597 VanDerWaalsContact O-CD 3.29Å; S594-P597 WeakPolarHBondContact O-CD 3.17Å; D595-P597 VanDerWaalsContact C-CD 3.45Å; P597-I600 PolarHBondContact O-N 3.29Å; P597-S601 WeakPolarHBondContact O-CB 3.4Å; P597-S601 PolarHBondContact O-N 2.91Å
598	T	90	Very high	90.5	Very high	68 Å²	68	55.1 Å²	55.1	42%	0.417	31%	0.311	S	S	.	.	H	α-helix	trans	-71.8	-38.8	178.9	-49.3	0	0	0	0	111.1	D595 L596 S601 G602 I648	D595-T598 WeakPolarHBondContact O-CB 3.27Å; D595-T598 PolarHBondContact O-N 3.47Å; D595-T598 VanDerWaalsContact O-N 3.07Å; L596-T598 VanDerWaalsContact C-N 3.27Å; L596-T598 PolarHBondContact O-N 3.29Å; T598-S601 PolarHBondContact O-N 3.5Å; T598-G602 PolarHBondContact O-N 2.94Å; T598-I648 HydrophobicContact CG2-CD1 3.24Å
599	L	91.8	Very high	90.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.5	-47.6	170.6	173.8	62.2	0	0	0	111.5	V588 P590 D595 L596 S601 G602 L603 L640 L650	V588-L599 HydrophobicContact CG1-CD1 3.89Å; V588-L599 HydrophobicContact CG1-CD2 4.32Å; P590-L599 HydrophobicContact CG-CD2 4.4Å; D595-L599 PolarHBondContact O-N 3.39Å; L596-L599 HydrophobicContact CD1-CD2 4.41Å; L596-L599 PolarHBondContact O-N 2.51Å; L599-S601 VanDerWaalsContact C-N 3.29Å; L599-S601 PolarHBondContact O-N 3.48Å; L599-G602 PolarHBondContact O-N 3.26Å; L599-G602 VanDerWaalsContact O-N 3.12Å; L599-L603 HydrophobicContact CD1-CD1 4.08Å; L599-L603 HydrophobicContact CD1-CG 3.97Å; L599-L603 HydrophobicContact CG-CD1 4.01Å; L599-L603 HydrophobicContact CG-CG 4.34Å; L599-L603 WeakPolarHBondContact O-CG 3.45Å; L599-L603 PolarHBondContact O-N 3.17Å; L599-L640 HydrophobicContact CD1-CD1 4.44Å; L599-L640 HydrophobicContact CD1-CD2 3.95Å; L599-L640 HydrophobicContact CD1-CG 4.48Å; L599-L650 HydrophobicContact CD1-CD2 3.82Å
600	I	90.9	Very high	89.9	Confident	58 Å²	58	52.4 Å²	52.4	30%	0.297	30%	0.3	S	S	.	.	H	α-helix	trans	-59.7	-43	178.6	-68.7	166.2	0	0	0	110.6	L596 P597 K604 H623	L596-I600 HydrophobicContact CD1-CD1 4.45Å; L596-I600 HydrophobicContact CG-CD1 4.01Å; L596-I600 WeakPolarHBondContact O-CG1 3.38Å; L596-I600 PolarHBondContact O-N 3.23Å; P597-I600 PolarHBondContact O-N 3.29Å; I600-K604 HydrophobicContact CG2-CD 4.5Å; I600-K604 WeakPolarHBondContact O-CG 2.97Å; I600-K604 PolarHBondContact O-N 3.09Å; I600-K604 VanDerWaalsContact O-N 3.07Å; I600-H623 WeakPolarHBondContact CG1-NE2 3.38Å
601	S	88	Confident	89.4	Confident	62 Å²	62	52.6 Å²	52.6	43%	0.434	30%	0.301	S	S	.	.	H	α-helix	trans	-60.6	-48	173.7	-172.1	0	0	0	0	111	P597 T598 L599 L603 K604 L605	P597-S601 WeakPolarHBondContact O-CB 3.4Å; P597-S601 PolarHBondContact O-N 2.91Å; T598-S601 PolarHBondContact O-N 3.5Å; L599-S601 VanDerWaalsContact C-N 3.29Å; L599-S601 PolarHBondContact O-N 3.48Å; S601-L603 PolarHBondContact O-N 3.48Å; S601-K604 WeakPolarHBondContact O-CB 3.27Å; S601-K604 PolarHBondContact O-N 2.9Å; S601-L605 WeakPolarHBondContact O-CG 3.39Å; S601-L605 PolarHBondContact O-N 3.21Å
602	G	89.9	Confident	89	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.1	-41.6	178.7	0	0	0	0	0	113.4	T598 L599 L605 L606 L640	T598-G602 PolarHBondContact O-N 2.94Å; L599-G602 PolarHBondContact O-N 3.26Å; L599-G602 VanDerWaalsContact O-N 3.12Å; G602-L605 PolarHBondContact O-N 3.04Å; G602-L606 WeakPolarHBondContact O-CB 3.26Å; G602-L606 PolarHBondContact O-N 3.34Å; G602-L640 VanDerWaalsContact C-CD1 3.48Å
603	L	91.7	Very high	89	Confident	10 Å²	10	41 Å²	41	5%	0.052	25%	0.248	C	C	.	.	H	α-helix	trans	-65	-38.8	175.6	-73.7	173	0	0	0	112.3	L599 S601 L606 S607 A615 H623 L625 L640	L599-L603 HydrophobicContact CD1-CD1 4.08Å; L599-L603 HydrophobicContact CD1-CG 3.97Å; L599-L603 HydrophobicContact CG-CD1 4.01Å; L599-L603 HydrophobicContact CG-CG 4.34Å; L599-L603 WeakPolarHBondContact O-CG 3.45Å; L599-L603 PolarHBondContact O-N 3.17Å; S601-L603 PolarHBondContact O-N 3.48Å; L603-L606 PolarHBondContact O-N 3.01Å; L603-S607 WeakPolarHBondContact O-CB 3.42Å; L603-S607 PolarHBondContact O-N 3.16Å; L603-A615 HydrophobicContact CB-CB 4.19Å; L603-A615 HydrophobicContact CD2-CB 4.38Å; L603-H623 HydrophobicContact CD1-CB 3.91Å; L603-L625 HydrophobicContact CD2-CD1 4.36Å; L603-L640 HydrophobicContact CD2-CD1 4.29Å; L603-L640 HydrophobicContact CD2-CD2 3.81Å; L603-L640 HydrophobicContact CG-CD1 4.45Å; L603-L640 HydrophobicContact CG-CD2 4.49Å
604	K	87.9	Confident	88.8	Confident	142 Å²	142	41.9 Å²	41.9	62%	0.617	23%	0.234	S	C	*	.	H	α-helix	trans	-62.3	-48.8	173.1	-73.6	175.2	-179.4	-179.9	0	110.8	I600 S601 L606 S607 L608	I600-K604 HydrophobicContact CG2-CD 4.5Å; I600-K604 WeakPolarHBondContact O-CG 2.97Å; I600-K604 PolarHBondContact O-N 3.09Å; I600-K604 VanDerWaalsContact O-N 3.07Å; S601-K604 WeakPolarHBondContact O-CB 3.27Å; S601-K604 PolarHBondContact O-N 2.9Å; K604-L606 VanDerWaalsContact C-N 3.33Å; K604-L606 PolarHBondContact O-N 2.82Å; K604-S607 PolarHBondContact O-N 2.89Å; K604-L608 WeakPolarHBondContact O-CG 3.43Å; K604-L608 PolarHBondContact O-N 3.4Å
605	L	88.5	Confident	88.8	Confident	53 Å²	53	39.7 Å²	39.7	28%	0.277	22%	0.221	S	C	.	.	H	α-helix	trans	-60.7	-40.5	177.9	-66.2	-177.2	0	0	0	112.3	F487 S601 G602 L608 A609 F644	F487-L605 HydrophobicContact CD2-CD2 4.23Å; F487-L605 WeakPolarHBondContact CE1-O 3.38Å; F487-L605 HydrophobicContact CE2-CB 4.1Å; F487-L605 HydrophobicContact CE2-CD1 4.31Å; F487-L605 HydrophobicContact CE2-CD2 3.64Å; F487-L605 HydrophobicContact CE2-CG 4.21Å; F487-L605 HydrophobicContact CZ-CB 3.77Å; F487-L605 HydrophobicContact CZ-CD2 4.03Å; F487-L605 HydrophobicContact CZ-CG 4.37Å; F487-L605 WeakPolarHBondContact CZ-O 3.37Å; S601-L605 WeakPolarHBondContact O-CG 3.39Å; S601-L605 PolarHBondContact O-N 3.21Å; G602-L605 PolarHBondContact O-N 3.04Å; L605-L608 HydrophobicContact CD2-CD1 4.3Å; L605-L608 WeakPolarHBondContact O-CB 3.26Å; L605-L608 PolarHBondContact O-N 2.94Å; L605-A609 PolarHBondContact O-N 3.37Å; L605-F644 HydrophobicContact CB-CB 4.21Å; L605-F644 HydrophobicContact CB-CD1 3.84Å; L605-F644 HydrophobicContact CB-CE1 4.39Å; L605-F644 HydrophobicContact CB-CG 4.03Å; L605-F644 HydrophobicContact CD1-CD1 4.26Å
606	L	90.5	Very high	88.6	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.5	-43.6	174.5	179.8	65.4	0	0	0	111.8	G602 L603 K604 L608 A609 D610 V613 L625 C636 D639 L640 F644	G602-L606 WeakPolarHBondContact O-CB 3.26Å; G602-L606 PolarHBondContact O-N 3.34Å; L603-L606 PolarHBondContact O-N 3.01Å; K604-L606 VanDerWaalsContact C-N 3.33Å; K604-L606 PolarHBondContact O-N 2.82Å; L606-L608 PolarHBondContact O-N 3.29Å; L606-A609 PolarHBondContact O-N 3.09Å; L606-A609 VanDerWaalsContact O-N 3.16Å; L606-D610 PolarHBondContact O-N 3.4Å; L606-V613 HydrophobicContact CD2-CG1 4.4Å; L606-V613 HydrophobicContact CG-CG1 4.3Å; L606-L625 HydrophobicContact CD2-CD1 3.74Å; L606-L625 HydrophobicContact CD2-CD2 4.28Å; L606-C636 HydrophobicContact CD1-CB 4.35Å; L606-C636 HydrophobicContact CD2-CB 4.12Å; L606-D639 HydrophobicContact CD1-CB 4.05Å; L606-L640 HydrophobicContact CD2-CB 4.42Å; L606-F644 HydrophobicContact CB-CD2 3.91Å; L606-F644 HydrophobicContact CB-CE2 4.16Å; L606-F644 HydrophobicContact CD1-CD2 4.09Å; L606-F644 HydrophobicContact CD1-CE2 3.81Å
607	S	87.4	Confident	88.6	Confident	29 Å²	29	42 Å²	42	20%	0.203	23%	0.234	C	C	.	.	H	α-helix	trans	-66.9	-23.3	176.8	-175.7	0	0	0	0	113.5	L603 K604	L603-S607 WeakPolarHBondContact O-CB 3.42Å; L603-S607 PolarHBondContact O-N 3.16Å; K604-S607 PolarHBondContact O-N 2.89Å
608	L	85.8	Confident	88.1	Confident	31 Å²	31	39.5 Å²	39.5	16%	0.162	22%	0.215	C	C	.	.	H	α-helix	trans	-76.7	-40.9	170.6	-64.6	176.8	0	0	0	110.8	M451 F487 I558 L559 K604 L605 L606	M451-L608 WeakPolarHBondContact CB-O 3.32Å; F487-L608 HydrophobicContact CD1-CB 4.23Å; F487-L608 HydrophobicContact CE1-CB 3.97Å; I558-L608 WeakPolarHBondContact O-CD2 3.47Å; L559-L608 WeakPolarHBondContact O-CD2 3.49Å; K604-L608 WeakPolarHBondContact O-CG 3.43Å; K604-L608 PolarHBondContact O-N 3.4Å; L605-L608 HydrophobicContact CD2-CD1 4.3Å; L605-L608 WeakPolarHBondContact O-CB 3.26Å; L605-L608 PolarHBondContact O-N 2.94Å; L606-L608 PolarHBondContact O-N 3.29Å
609	A	86.8	Confident	87.4	Confident	9 Å²	9	45 Å²	45	7%	0.074	24%	0.241	C	C	.	.	H	α-helix	trans	-70.8	-38.8	-175.3	0	0	0	0	0	113.7	P453 F487 L605 L606 F644	P453-A609 HydrophobicContact CG-CB 4.09Å; F487-A609 HydrophobicContact CE1-CB 3.9Å; F487-A609 HydrophobicContact CZ-CB 4.48Å; L605-A609 PolarHBondContact O-N 3.37Å; L606-A609 PolarHBondContact O-N 3.09Å; L606-A609 VanDerWaalsContact O-N 3.16Å; A609-F644 HydrophobicContact CB-CE2 4.2Å; A609-F644 HydrophobicContact CB-CZ 3.78Å
610	D	87.6	Confident	86.7	Confident	4 Å²	4	48.6 Å²	48.6	2%	0.021	26%	0.264	C	S	.	.			trans	-111.2	123.6	-178.8	-172.5	-65.5	0	0	0	111.8	L606 C612 V613 H632 R635	L606-D610 PolarHBondContact O-N 3.4Å; D610-C612 VanDerWaalsContact C-N 3.34Å; D610-C612 PolarHBondContact O-N 3.27Å; D610-C612 WeakPolarHBondContact OD1-CA 3.39Å; D610-C612 WeakPolarHBondContact OD1-CB 3.27Å; D610-C612 PolarHBondContact OD1-N 3.28Å; D610-V613 HydrophobicContact CB-CB 4.03Å; D610-V613 HydrophobicContact CB-CG2 3.59Å; D610-V613 PolarHBondContact OD1-N 2.93Å; D610-H632 IonicContact OD1-CE1 3.69Å; D610-H632 IonicContact OD1-NE2 3.46Å; D610-H632 IonicContact OD2-CD2 2.72Å; D610-H632 IonicContact OD2-CE1 2.72Å; D610-H632 IonicContact OD2-NE2 2.98Å; D610-H632 PolarHBondContact OD2-NE2 3.16Å; D610-R635 IonicContact OD2-CZ 3.45Å; D610-R635 IonicContact OD2-NH2 3.92Å; D610-R635 PolarHBondContact OD2-NH2 2.83Å
611	P	81.1	Confident	86.3	Confident	22 Å²	22	48 Å²	48	14%	0.143	27%	0.271	C	S	.	.	S	Bend	trans	-67.2	-30.1	-177.1	26.6	-33.9	0	0	0	113.8	K560	K560-P611 PolarHBondContact NZ-O 3.09Å
612	C	84.6	Confident	86.2	Confident	8 Å²	8	47.1 Å²	47.1	5%	0.054	26%	0.26	C	S	.	.	S	Bend	trans	-88	-23.5	-175.9	-83.7	0	0	0	0	113.6	G140 A578 D610 V628	G140-C612 WeakPolarHBondContact CA-SG 3.5Å; A578-C612 VanDerWaalsContact CB-SG 3.52Å; D610-C612 VanDerWaalsContact C-N 3.34Å; D610-C612 PolarHBondContact O-N 3.27Å; D610-C612 WeakPolarHBondContact OD1-CA 3.39Å; D610-C612 WeakPolarHBondContact OD1-CB 3.27Å; D610-C612 PolarHBondContact OD1-N 3.28Å; C612-V628 HydrophobicContact CB-CG2 4.1Å
613	V	89.3	Confident	86.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.266	C	S	.	.			trans	-64.1	137.9	178.7	171.1	0	0	0	0	111.2	K560 L606 D610 L625 T627 C636	K560-V613 PolarHBondContact NZ-O 3.45Å; L606-V613 HydrophobicContact CD2-CG1 4.4Å; L606-V613 HydrophobicContact CG-CG1 4.3Å; D610-V613 HydrophobicContact CB-CB 4.03Å; D610-V613 HydrophobicContact CB-CG2 3.59Å; D610-V613 PolarHBondContact OD1-N 2.93Å; V613-L625 HydrophobicContact CG1-CD1 3.39Å; V613-T627 HydrophobicContact CG2-CG2 4.44Å; V613-C636 WeakPolarHBondContact CG2-SG 3.45Å
614	K	87.7	Confident	86.3	Confident	108 Å²	108	47.8 Å²	47.8	47%	0.47	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.8	167.3	-59.4	175.3	-178	171.6	0	108.4	P582 V626	P582-K614 HydrophobicContact CG-CD 4.12Å; K614-V626 HydrophobicContact CB-CB 4.24Å; K614-V626 PolarHBondContact N-O 3.42Å; K614-V626 VanDerWaalsContact N-O 3.11Å; K614-V626 PolarHBondContact O-N 3.26Å
615	A	90.2	Very high	86.5	Confident	37 Å²	37	41 Å²	41	31%	0.306	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	128.1	171.5	0	0	0	0	0	108.7	L603 V624	L603-A615 HydrophobicContact CB-CB 4.19Å; L603-A615 HydrophobicContact CD2-CB 4.38Å; A615-V624 WeakPolarHBondContact CA-O 3.4Å
616	F	89.1	Confident	86.7	Confident	71 Å²	71	38.8 Å²	38.8	31%	0.311	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	165.2	175.1	58.3	-92.7	0	0	0	110.4	E618 V624 V626	F616-E618 HydrophobicContact CD2-CG 4.22Å; F616-E618 HydrophobicContact CE2-CG 3.67Å; F616-V624 HydrophobicContact CE2-CB 4.21Å; F616-V624 HydrophobicContact CZ-CB 4.38Å; F616-V624 HydrophobicContact CZ-CG1 4.25Å; F616-V624 PolarHBondContact N-O 3.42Å; F616-V624 VanDerWaalsContact N-O 3.1Å; F616-V624 PolarHBondContact O-N 3.22Å; F616-V626 HydrophobicContact CD1-CG2 4.39Å; F616-V626 HydrophobicContact CE1-CG2 3.45Å; F616-V626 VanDerWaalsContact CE1-CG2 3.45Å; F616-V626 HydrophobicContact CZ-CG2 3.98Å
617	V	90	Very high	86.7	Confident	82 Å²	82	38.8 Å²	38.8	50%	0.497	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127	173.6	-175	0	0	0	0	107.5	E622	V617-E622 WeakPolarHBondContact CA-O 3.42Å
618	E	81.9	Confident	86.7	Confident	36 Å²	36	37.9 Å²	37.9	17%	0.168	22%	0.215	C	C	.	.			trans	-74.2	163.5	172.2	-79	-166.6	172.5	0	0	111	R585 F616 T620 G621 E622 V624	R585-E618 IonicContact NH1-OE1 3.43Å; F616-E618 HydrophobicContact CD2-CG 4.22Å; F616-E618 HydrophobicContact CE2-CG 3.67Å; E618-T620 PolarHBondContact O-N 2.8Å; E618-G621 PolarHBondContact O-N 2.89Å; E618-E622 PolarHBondContact N-O 3.07Å; E618-V624 HydrophobicContact CB-CG2 4.4Å; E618-V624 HydrophobicContact CG-CB 4.38Å; E618-V624 HydrophobicContact CG-CG2 3.67Å
619	D	74.2	Confident	86.6	Confident	182 Å²	182	36.6 Å²	36.6	97%	0.973	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-18.9	179.2	-60.3	-33.4	0	0	0	112.4	G621	D619-G621 VanDerWaalsContact C-N 3.27Å; D619-G621 PolarHBondContact O-N 2.64Å
620	T	76.9	Confident	86.5	Confident	77 Å²	77	39 Å²	39	47%	0.472	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-14.1	172.8	55.4	0	0	0	0	113.8	E618 E622	E618-T620 PolarHBondContact O-N 2.8Å; T620-E622 PolarHBondContact OG1-N 3.32Å
621	G	82.6	Confident	86.4	Confident	44 Å²	44	41.3 Å²	41.3	45%	0.454	23%	0.23	S	C	.	.	S	Bend	trans	88.7	-3	-171.9	0	0	0	0	0	114.4	E618 D619	E618-G621 PolarHBondContact O-N 2.89Å; D619-G621 VanDerWaalsContact C-N 3.27Å; D619-G621 PolarHBondContact O-N 2.64Å
622	E	86.8	Confident	86.8	Confident	45 Å²	45	40.3 Å²	40.3	21%	0.21	22%	0.224	C	C	.	.			trans	-72.2	139	176.4	-65.9	-175.3	-170.6	0	0	111.2	S587 V617 E618 T620 V624	S587-E622 WeakPolarHBondContact CB-OE2 2.81Å; S587-E622 PolarHBondContact OG-OE2 2.83Å; V617-E622 WeakPolarHBondContact CA-O 3.42Å; E618-E622 PolarHBondContact N-O 3.07Å; T620-E622 PolarHBondContact OG1-N 3.32Å; E622-V624 HydrophobicContact CB-CG2 4.5Å
623	H	91.2	Very high	87.1	Confident	24 Å²	24	40.4 Å²	40.4	11%	0.111	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	113.3	176.1	-64	63.9	0	0	0	109	S587 V588 I600 L603	S587-H623 CarbonylContact C-O 3.57Å; S587-H623 WeakPolarHBondContact CA-O 3.36Å; V588-H623 PolarHBondContact N-O 3.46Å; V588-H623 WeakPolarHBondContact O-CB 3.46Å; I600-H623 WeakPolarHBondContact CG1-NE2 3.38Å; L603-H623 HydrophobicContact CD1-CB 3.91Å
624	V	91.5	Very high	87.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	126.4	-173.7	180	0	0	0	0	110.6	R585 V586 A615 F616 E618 E622 V626	R585-V624 HydrophobicContact CB-CG1 3.82Å; R585-V624 HydrophobicContact CG-CG1 4.38Å; V586-V624 WeakPolarHBondContact O-CA 3.47Å; A615-V624 WeakPolarHBondContact CA-O 3.4Å; F616-V624 HydrophobicContact CE2-CB 4.21Å; F616-V624 HydrophobicContact CZ-CB 4.38Å; F616-V624 HydrophobicContact CZ-CG1 4.25Å; F616-V624 PolarHBondContact N-O 3.42Å; F616-V624 VanDerWaalsContact N-O 3.1Å; F616-V624 PolarHBondContact O-N 3.22Å; E618-V624 HydrophobicContact CB-CG2 4.4Å; E618-V624 HydrophobicContact CG-CB 4.38Å; E618-V624 HydrophobicContact CG-CG2 3.67Å; E622-V624 HydrophobicContact CB-CG2 4.5Å; V624-V626 HydrophobicContact CG1-CG2 4.21Å
625	L	93	Very high	87.2	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	129.8	171.6	-175.9	70.5	0	0	0	109.4	R585 V586 V588 L603 L606 V613 T627 L633 C636 L637	R585-L625 CarbonylContact C-O 3.6Å; R585-L625 VanDerWaalsContact CA-O 3.27Å; R585-L625 WeakPolarHBondContact CA-O 3.48Å; V586-L625 PolarHBondContact N-O 3.3Å; V586-L625 PolarHBondContact O-N 3.19Å; V588-L625 HydrophobicContact CG2-CB 4.29Å; L603-L625 HydrophobicContact CD2-CD1 4.36Å; L606-L625 HydrophobicContact CD2-CD1 3.74Å; L606-L625 HydrophobicContact CD2-CD2 4.28Å; V613-L625 HydrophobicContact CG1-CD1 3.39Å; L625-T627 HydrophobicContact CD2-CG2 4.34Å; L625-T627 HydrophobicContact CG-CG2 4.22Å; L625-L633 HydrophobicContact CD2-CD1 4.17Å; L625-C636 HydrophobicContact CD2-CB 3.93Å; L625-L637 HydrophobicContact CD2-CD2 4.32Å
626	V	91.7	Very high	87.2	Confident	5 Å²	5	36.5 Å²	36.5	3%	0.03	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	128.5	177.4	-166.5	0	0	0	0	110.9	P582 V584 R585 K614 F616 V624	P582-V626 HydrophobicContact CB-CG1 4Å; P582-V626 WeakPolarHBondContact O-CG1 3.31Å; V584-V626 CarbonylContact O-C 3.1Å; V584-V626 VanDerWaalsContact O-CA 3.26Å; V584-V626 WeakPolarHBondContact O-CA 3.4Å; R585-V626 HydrophobicContact CB-CG2 4.49Å; R585-V626 HydrophobicContact CG-CB 4.49Å; R585-V626 HydrophobicContact CG-CG1 4.09Å; R585-V626 HydrophobicContact CG-CG2 3.87Å; K614-V626 HydrophobicContact CB-CB 4.24Å; K614-V626 PolarHBondContact N-O 3.42Å; K614-V626 VanDerWaalsContact N-O 3.11Å; K614-V626 PolarHBondContact O-N 3.26Å; F616-V626 HydrophobicContact CD1-CG2 4.39Å; F616-V626 HydrophobicContact CE1-CG2 3.45Å; F616-V626 VanDerWaalsContact CE1-CG2 3.45Å; F616-V626 HydrophobicContact CZ-CG2 3.98Å; V624-V626 HydrophobicContact CG1-CG2 4.21Å
627	T	91.1	Very high	87.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	170.5	-177.9	66.1	0	0	0	0	111.7	P582 I583 V584 V613 L625 G629 L633 C636	P582-T627 CarbonylContact C-O 3.6Å; P582-T627 VanDerWaalsContact CA-O 3.26Å; P582-T627 WeakPolarHBondContact CA-O 3.27Å; I583-T627 PolarHBondContact N-O 3.32Å; V584-T627 PolarHBondContact N-O 2.98Å; V584-T627 PolarHBondContact O-N 3.33Å; V613-T627 HydrophobicContact CG2-CG2 4.44Å; L625-T627 HydrophobicContact CD2-CG2 4.34Å; L625-T627 HydrophobicContact CG-CG2 4.22Å; T627-G629 PolarHBondContact OG1-O 3.2Å; T627-L633 HydrophobicContact CG2-CB 4.41Å; T627-L633 HydrophobicContact CG2-CD1 4.13Å; T627-L633 WeakPolarHBondContact OG1-CB 3.45Å; T627-C636 HydrophobicContact CG2-CB 4.32Å
628	V	86.9	Confident	87.3	Confident	11 Å²	11	33 Å²	33	7%	0.067	18%	0.182	C	C	.	.	S	Bend	trans	-73.8	-44.1	-177.3	178	0	0	0	0	112.3	A580 P582 C612 H632 Y894	A580-V628 HydrophobicContact CB-CG1 3.57Å; P582-V628 HydrophobicContact CB-CG2 4.35Å; C612-V628 HydrophobicContact CB-CG2 4.1Å; V628-H632 PolarHBondContact N-ND1 2.72Å; V628-Y894 PolarHBondContact O-OH 3.33Å
629	G	85.2	Confident	87.7	Confident	4 Å²	4	31.2 Å²	31.2	4%	0.041	17%	0.174	C	C	.	.	S	Bend	trans	-157.1	-176.7	-174.6	0	0	0	0	0	112.1	D137 T627 H632 L633	D137-G629 WeakPolarHBondContact OD2-CA 3.4Å; T627-G629 PolarHBondContact OG1-O 3.2Å; G629-H632 PolarHBondContact O-N 3.17Å; G629-L633 WeakPolarHBondContact O-CB 3.48Å; G629-L633 PolarHBondContact O-N 2.73Å
630	E	84.2	Confident	88.5	Confident	58 Å²	58	22.6 Å²	22.6	27%	0.271	13%	0.128	S	C	.	.	H	α-helix	trans	-65.8	-42.9	-175.5	-175.4	176.7	177.7	0	0	112.7	H632 L633 Q634 F943 G944	E630-H632 VanDerWaalsContact C-N 3.32Å; E630-H632 PolarHBondContact O-N 3.34Å; E630-L633 WeakPolarHBondContact O-CB 3.41Å; E630-L633 PolarHBondContact O-N 3.41Å; E630-Q634 WeakPolarHBondContact O-CG 3.34Å; E630-Q634 PolarHBondContact O-N 3.38Å; E630-F943 HydrophobicContact CB-CD1 4.41Å; E630-F943 HydrophobicContact CG-CD1 4.42Å; E630-G944 PolarHBondContact OE2-N 2.79Å
631	M	84.7	Confident	89	Confident	53 Å²	53	22.9 Å²	22.9	26%	0.261	12%	0.124	S	C	.	.	H	α-helix	trans	-67.6	-37.9	179.9	-69.4	-67.3	-71.4	0	0	110.9	I107 D137 R635	I107-M631 HydrophobicContact CD1-CE 3.81Å; D137-M631 HydrophobicContact CB-CB 4.48Å; D137-M631 WeakPolarHBondContact OD2-CB 3.35Å; D137-M631 PolarHBondContact OD2-N 3.32Å; D137-M631 VanDerWaalsContact OD2-N 3.1Å; M631-R635 PolarHBondContact O-N 3.47Å; M631-R635 VanDerWaalsContact O-N 3.16Å
632	H	89.9	Confident	89.1	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-63.4	-45	172	-169.4	-179.6	0	0	0	111.7	D137 F138 D610 V628 G629 E630 Q634 R635 C636	D137-H632 HydrophobicContact CB-CB 4.03Å; D137-H632 PolarHBondContact O-ND1 3.21Å; D137-H632 PolarHBondContact OD2-N 3.35Å; F138-H632 HydrophobicContact CE1-CB 4.33Å; D610-H632 IonicContact OD1-CE1 3.69Å; D610-H632 IonicContact OD1-NE2 3.46Å; D610-H632 IonicContact OD2-CD2 2.72Å; D610-H632 IonicContact OD2-CE1 2.72Å; D610-H632 IonicContact OD2-NE2 2.98Å; D610-H632 PolarHBondContact OD2-NE2 3.16Å; V628-H632 PolarHBondContact N-ND1 2.72Å; G629-H632 PolarHBondContact O-N 3.17Å; E630-H632 VanDerWaalsContact C-N 3.32Å; E630-H632 PolarHBondContact O-N 3.34Å; H632-Q634 PolarHBondContact O-N 2.82Å; H632-R635 PolarHBondContact O-N 2.95Å; H632-C636 PolarHBondContact CD2-SG 3.01Å; H632-C636 PolarHBondContact NE2-SG 3.05Å; H632-C636 VanDerWaalsContact NE2-SG 3.38Å; H632-C636 PolarHBondContact O-N 3.35Å; H632-C636 PolarHBondContact O-SG 2.82Å
633	L	91.2	Very high	88.9	Confident	10 Å²	10	27.3 Å²	27.3	5%	0.052	13%	0.125	C	C	.	.	H	α-helix	trans	-57.3	-50.3	177.6	178	63.2	0	0	0	111.8	V584 V586 L625 T627 G629 E630 R635 C636 L637 P655	V584-L633 HydrophobicContact CG1-CD2 3.94Å; V586-L633 HydrophobicContact CB-CD1 4.08Å; V586-L633 HydrophobicContact CG2-CD1 3.65Å; V586-L633 HydrophobicContact CG2-CD2 3.47Å; V586-L633 VanDerWaalsContact CG2-CD2 3.47Å; V586-L633 HydrophobicContact CG2-CG 4.15Å; L625-L633 HydrophobicContact CD2-CD1 4.17Å; T627-L633 HydrophobicContact CG2-CB 4.41Å; T627-L633 HydrophobicContact CG2-CD1 4.13Å; T627-L633 WeakPolarHBondContact OG1-CB 3.45Å; G629-L633 WeakPolarHBondContact O-CB 3.48Å; G629-L633 PolarHBondContact O-N 2.73Å; E630-L633 WeakPolarHBondContact O-CB 3.41Å; E630-L633 PolarHBondContact O-N 3.41Å; L633-R635 PolarHBondContact O-N 2.98Å; L633-C636 WeakPolarHBondContact O-CB 3.5Å; L633-C636 PolarHBondContact O-N 3Å; L633-C636 VanDerWaalsContact O-N 3.15Å; L633-L637 HydrophobicContact CD1-CD1 4.18Å; L633-L637 HydrophobicContact CD1-CG 4.23Å; L633-L637 HydrophobicContact CG-CD1 4.06Å; L633-L637 HydrophobicContact CG-CG 4.49Å; L633-L637 WeakPolarHBondContact O-CG 3.36Å; L633-L637 PolarHBondContact O-N 3.37Å; L633-P655 HydrophobicContact CD2-CG 4.26Å
634	Q	88.8	Confident	88.7	Confident	58 Å²	58	27 Å²	27	27%	0.271	12%	0.123	S	C	.	.	H	α-helix	trans	-57.4	-47.9	178.4	-71.7	178.5	-3.4	0	0	111.6	E630 H632 C636 L637 D638	E630-Q634 WeakPolarHBondContact O-CG 3.34Å; E630-Q634 PolarHBondContact O-N 3.38Å; H632-Q634 PolarHBondContact O-N 2.82Å; Q634-C636 VanDerWaalsContact C-N 3.26Å; Q634-C636 PolarHBondContact O-N 3.06Å; Q634-L637 PolarHBondContact O-N 3.16Å; Q634-D638 PolarHBondContact O-N 3.31Å
635	R	89.4	Confident	88.2	Confident	6 Å²	6	27 Å²	27	2%	0.023	12%	0.123	C	C	.	.	H	α-helix	trans	-57.2	-40.3	177.3	-168.7	-167.7	73.5	68.5	5.8	112.1	M109 F138 D610 M631 H632 L633 D639	M109-R635 HydrophobicContact CE-CG 4.32Å; M109-R635 HydrophobicContact SD-CB 4.4Å; M109-R635 HydrophobicContact SD-CG 3.96Å; F138-R635 HydrophobicContact CE1-CB 4.33Å; F138-R635 VanDerWaalsContact CE1-CD 3.46Å; D610-R635 IonicContact OD2-CZ 3.45Å; D610-R635 IonicContact OD2-NH2 3.92Å; D610-R635 PolarHBondContact OD2-NH2 2.83Å; M631-R635 PolarHBondContact O-N 3.47Å; M631-R635 VanDerWaalsContact O-N 3.16Å; H632-R635 PolarHBondContact O-N 2.95Å; L633-R635 PolarHBondContact O-N 2.98Å; R635-D639 IonicContact CZ-OD2 2.86Å; R635-D639 IonicContact NH1-OD2 2.75Å; R635-D639 PolarHBondContact NH1-OD2 3.36Å; R635-D639 WeakPolarHBondContact O-CB 3.46Å; R635-D639 PolarHBondContact O-N 3.11Å
636	C	92.1	Very high	87.4	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-69.5	-40.5	179	-69	0	0	0	0	112.6	L606 V613 L625 T627 H632 L633 Q634 D639 L640	L606-C636 HydrophobicContact CD1-CB 4.35Å; L606-C636 HydrophobicContact CD2-CB 4.12Å; V613-C636 WeakPolarHBondContact CG2-SG 3.45Å; L625-C636 HydrophobicContact CD2-CB 3.93Å; T627-C636 HydrophobicContact CG2-CB 4.32Å; H632-C636 PolarHBondContact CD2-SG 3.01Å; H632-C636 PolarHBondContact NE2-SG 3.05Å; H632-C636 VanDerWaalsContact NE2-SG 3.38Å; H632-C636 PolarHBondContact O-N 3.35Å; H632-C636 PolarHBondContact O-SG 2.82Å; L633-C636 WeakPolarHBondContact O-CB 3.5Å; L633-C636 PolarHBondContact O-N 3Å; L633-C636 VanDerWaalsContact O-N 3.15Å; Q634-C636 VanDerWaalsContact C-N 3.26Å; Q634-C636 PolarHBondContact O-N 3.06Å; C636-D639 PolarHBondContact O-N 3.29Å; C636-L640 VanDerWaalsContact O-CB 3.32Å; C636-L640 WeakPolarHBondContact O-CB 3.13Å; C636-L640 PolarHBondContact O-N 2.9Å
637	L	92.3	Very high	86.7	Confident	35 Å²	35	33.1 Å²	33.1	18%	0.183	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-41.5	176.1	-68.3	173.5	0	0	0	111.2	V588 L625 L633 Q634 L640 H641 V652	V588-L637 HydrophobicContact CG2-CD2 4.18Å; L625-L637 HydrophobicContact CD2-CD2 4.32Å; L633-L637 HydrophobicContact CD1-CD1 4.18Å; L633-L637 HydrophobicContact CD1-CG 4.23Å; L633-L637 HydrophobicContact CG-CD1 4.06Å; L633-L637 HydrophobicContact CG-CG 4.49Å; L633-L637 WeakPolarHBondContact O-CG 3.36Å; L633-L637 PolarHBondContact O-N 3.37Å; Q634-L637 PolarHBondContact O-N 3.16Å; L637-L640 PolarHBondContact O-N 3.11Å; L637-H641 WeakPolarHBondContact O-CB 3.39Å; L637-H641 PolarHBondContact O-N 3.46Å; L637-V652 HydrophobicContact CD1-CG1 3.89Å; L637-V652 HydrophobicContact CD2-CG1 3.97Å; L637-V652 HydrophobicContact CD2-CG2 4.09Å
638	D	88.8	Confident	86.4	Confident	43 Å²	43	33.6 Å²	33.6	23%	0.23	19%	0.185	C	C	.	.	H	α-helix	trans	-63.7	-44.4	175	-72.3	-27	0	0	0	111.6	Q634 L640 H641 R642	Q634-D638 PolarHBondContact O-N 3.31Å; D638-L640 VanDerWaalsContact C-N 3.33Å; D638-L640 PolarHBondContact O-N 2.97Å; D638-H641 PolarHBondContact O-N 3.44Å; D638-R642 WeakPolarHBondContact O-CB 3.12Å; D638-R642 WeakPolarHBondContact O-CG 3.48Å; D638-R642 PolarHBondContact O-N 2.96Å
639	D	89.1	Confident	86.5	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.7	-40.8	174.6	-84.5	-10.2	0	0	0	111.7	R99 L606 R635 C636 R643 F644	R99-D639 IonicContact CZ-OD1 3.97Å; R99-D639 IonicContact CZ-OD2 2.59Å; R99-D639 VanDerWaalsContact NH1-CG 3.26Å; R99-D639 IonicContact NH1-OD1 2.99Å; R99-D639 PolarHBondContact NH1-OD1 3.06Å; R99-D639 IonicContact NH1-OD2 3.23Å; R99-D639 PolarHBondContact NH1-OD2 2.87Å; R99-D639 IonicContact NH2-OD1 2.9Å; R99-D639 PolarHBondContact NH2-OD1 3.49Å; R99-D639 IonicContact NH2-OD2 3.58Å; R99-D639 PolarHBondContact NH2-OD2 3.32Å; L606-D639 HydrophobicContact CD1-CB 4.05Å; R635-D639 IonicContact CZ-OD2 2.86Å; R635-D639 IonicContact NH1-OD2 2.75Å; R635-D639 PolarHBondContact NH1-OD2 3.36Å; R635-D639 WeakPolarHBondContact O-CB 3.46Å; R635-D639 PolarHBondContact O-N 3.11Å; C636-D639 PolarHBondContact O-N 3.29Å; D639-R643 WeakPolarHBondContact O-CA 3.43Å; D639-R643 VanDerWaalsContact O-CB 3.27Å; D639-R643 WeakPolarHBondContact O-CB 3.35Å; D639-R643 PolarHBondContact O-N 3.39Å; D639-R643 IonicContact OD1-CZ 2.75Å; D639-R643 IonicContact OD1-NE 3.57Å; D639-R643 PolarHBondContact OD1-NE 3.28Å; D639-R643 VanDerWaalsContact OD1-NE 3.14Å; D639-R643 IonicContact OD1-NH1 2.7Å; D639-R643 IonicContact OD1-NH2 3.16Å; D639-F644 HydrophobicContact CB-CD2 4.2Å; D639-F644 HydrophobicContact CB-CE2 3.88Å; D639-F644 WeakPolarHBondContact O-CD2 3.16Å; D639-F644 PolarHBondContact O-N 2.91Å; D639-F644 VanDerWaalsContact O-N 3.11Å
640	L	91	Very high	86.8	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.21	C	C	.	.	I	π-helix	trans	-65.4	-48.7	177.8	-171.4	61.8	0	0	0	111.2	V588 L599 G602 L603 L606 C636 L637 D638 F644 A645 L650	V588-L640 HydrophobicContact CG1-CD2 4.01Å; L599-L640 HydrophobicContact CD1-CD1 4.44Å; L599-L640 HydrophobicContact CD1-CD2 3.95Å; L599-L640 HydrophobicContact CD1-CG 4.48Å; G602-L640 VanDerWaalsContact C-CD1 3.48Å; L603-L640 HydrophobicContact CD2-CD1 4.29Å; L603-L640 HydrophobicContact CD2-CD2 3.81Å; L603-L640 HydrophobicContact CG-CD1 4.45Å; L603-L640 HydrophobicContact CG-CD2 4.49Å; L606-L640 HydrophobicContact CD2-CB 4.42Å; C636-L640 VanDerWaalsContact O-CB 3.32Å; C636-L640 WeakPolarHBondContact O-CB 3.13Å; C636-L640 PolarHBondContact O-N 2.9Å; L637-L640 PolarHBondContact O-N 3.11Å; D638-L640 VanDerWaalsContact C-N 3.33Å; D638-L640 PolarHBondContact O-N 2.97Å; L640-F644 HydrophobicContact CD1-CB 4.43Å; L640-A645 HydrophobicContact CD1-CB 4.07Å; L640-A645 HydrophobicContact CG-CB 4.37Å; L640-A645 WeakPolarHBondContact O-CA 3.43Å; L640-A645 WeakPolarHBondContact O-CB 3.25Å; L640-A645 PolarHBondContact O-N 3.42Å; L640-L650 HydrophobicContact CB-CD1 4.5Å; L640-L650 HydrophobicContact CD2-CD1 3.8Å; L640-L650 HydrophobicContact CG-CD1 3.87Å
641	H	87.9	Confident	87.1	Confident	84 Å²	84	42 Å²	42	39%	0.389	22%	0.224	S	C	.	.	I	π-helix	trans	-72.2	-40.7	-177.1	-175.1	66	0	0	0	113	L637 D638 A646 I648 L650	L637-H641 WeakPolarHBondContact O-CB 3.39Å; L637-H641 PolarHBondContact O-N 3.46Å; D638-H641 PolarHBondContact O-N 3.44Å; H641-A646 WeakPolarHBondContact O-CA 3.3Å; H641-I648 PolarHBondContact ND1-O 3.33Å; H641-L650 HydrophobicContact CB-CD1 4.47Å
642	R	83.9	Confident	87.5	Confident	137 Å²	137	42.4 Å²	42.4	52%	0.517	23%	0.229	S	C	.	.	I	π-helix	trans	-88.3	-30.5	-174.7	-62.8	175.4	176.1	174.5	-5.3	113.8	E101 D638	E101-R642 IonicContact OE1-CZ 3.62Å; E101-R642 IonicContact OE1-NH1 3.53Å; E101-R642 PolarHBondContact OE1-NH1 2.88Å; D638-R642 WeakPolarHBondContact O-CB 3.12Å; D638-R642 WeakPolarHBondContact O-CG 3.48Å; D638-R642 PolarHBondContact O-N 2.96Å
643	R	83.4	Confident	87.5	Confident	45 Å²	45	44.2 Å²	44.2	17%	0.17	24%	0.242	C	C	.	.	I	π-helix	trans	-118	-52.6	-167.8	-50.4	-175.6	-166.4	-164.9	2.6	113.8	Y485 D639	Y485-R643 HydrophobicContact CD2-CB 4.21Å; Y485-R643 HydrophobicContact CE2-CB 3.62Å; Y485-R643 HydrophobicContact CE2-CG 4.07Å; D639-R643 WeakPolarHBondContact O-CA 3.43Å; D639-R643 VanDerWaalsContact O-CB 3.27Å; D639-R643 WeakPolarHBondContact O-CB 3.35Å; D639-R643 PolarHBondContact O-N 3.39Å; D639-R643 IonicContact OD1-CZ 2.75Å; D639-R643 IonicContact OD1-NE 3.57Å; D639-R643 PolarHBondContact OD1-NE 3.28Å; D639-R643 VanDerWaalsContact OD1-NE 3.14Å; D639-R643 IonicContact OD1-NH1 2.7Å; D639-R643 IonicContact OD1-NH2 3.16Å
644	F	85.9	Confident	87.3	Confident	16 Å²	16	47.4 Å²	47.4	7%	0.07	27%	0.27	C	S	.	.	I	π-helix	trans	-94.7	-32.4	-166.4	-56.7	-49.9	0	0	0	114.4	P453 F487 L605 L606 A609 D639 L640	P453-F644 HydrophobicContact CB-CE1 3.9Å; P453-F644 HydrophobicContact CB-CZ 4.02Å; P453-F644 HydrophobicContact CG-CE1 4.42Å; P453-F644 HydrophobicContact CG-CZ 4.02Å; F487-F644 HydrophobicContact CE1-CE1 4.48Å; F487-F644 HydrophobicContact CE2-CE1 4.09Å; F487-F644 HydrophobicContact CZ-CD1 4.18Å; F487-F644 AromaticContact CZ-CE1 3.51Å; F487-F644 HydrophobicContact CZ-CE1 3.51Å; F487-F644 HydrophobicContact CZ-CZ 4.06Å; L605-F644 HydrophobicContact CB-CB 4.21Å; L605-F644 HydrophobicContact CB-CD1 3.84Å; L605-F644 HydrophobicContact CB-CE1 4.39Å; L605-F644 HydrophobicContact CB-CG 4.03Å; L605-F644 HydrophobicContact CD1-CD1 4.26Å; L606-F644 HydrophobicContact CB-CD2 3.91Å; L606-F644 HydrophobicContact CB-CE2 4.16Å; L606-F644 HydrophobicContact CD1-CD2 4.09Å; L606-F644 HydrophobicContact CD1-CE2 3.81Å; A609-F644 HydrophobicContact CB-CE2 4.2Å; A609-F644 HydrophobicContact CB-CZ 3.78Å; D639-F644 HydrophobicContact CB-CD2 4.2Å; D639-F644 HydrophobicContact CB-CE2 3.88Å; D639-F644 WeakPolarHBondContact O-CD2 3.16Å; D639-F644 PolarHBondContact O-N 2.91Å; D639-F644 VanDerWaalsContact O-N 3.11Å; L640-F644 HydrophobicContact CD1-CB 4.43Å
645	A	82.3	Confident	87.2	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	-121.7	43.1	174	0	0	0	0	0	109.9	L640 G647 I648	L640-A645 HydrophobicContact CD1-CB 4.07Å; L640-A645 HydrophobicContact CG-CB 4.37Å; L640-A645 WeakPolarHBondContact O-CA 3.43Å; L640-A645 WeakPolarHBondContact O-CB 3.25Å; L640-A645 PolarHBondContact O-N 3.42Å; A645-G647 PolarHBondContact O-N 3.26Å; A645-I648 HydrophobicContact CB-CD1 4.33Å; A645-I648 PolarHBondContact O-N 2.98Å
646	A	75.1	Confident	86.9	Confident	53 Å²	53	47.9 Å²	47.9	44%	0.438	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	133.7	-176.6	0	0	0	0	0	111.5	H641	H641-A646 WeakPolarHBondContact O-CA 3.3Å
647	G	76.7	Confident	86.6	Confident	82 Å²	82	48.1 Å²	48.1	85%	0.845	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	3.9	179.7	0	0	0	0	0	115.2	A645	A645-G647 PolarHBondContact O-N 3.26Å
648	I	85.7	Confident	86.2	Confident	9 Å²	9	46.8 Å²	46.8	5%	0.046	27%	0.273	C	S	.	.			trans	-110.4	131.9	177.6	-60.8	162.7	0	0	0	110	P590 D595 T598 H641 A645 L650	P590-I648 HydrophobicContact CB-CG2 4.08Å; D595-I648 HydrophobicContact CB-CD1 3.89Å; D595-I648 HydrophobicContact CB-CG1 3.95Å; D595-I648 HydrophobicContact CB-CG2 3.81Å; T598-I648 HydrophobicContact CG2-CD1 3.24Å; H641-I648 PolarHBondContact ND1-O 3.33Å; A645-I648 HydrophobicContact CB-CD1 4.33Å; A645-I648 PolarHBondContact O-N 2.98Å; I648-L650 HydrophobicContact CG2-CD2 3.93Å; I648-L650 PolarHBondContact O-N 2.75Å
649	D	88.8	Confident	86.3	Confident	94 Å²	94	45.3 Å²	45.3	50%	0.503	26%	0.264	S	S	.	.			trans	-79.5	119.8	170.2	-66.4	-41.9	0	0	0	109.7	Q591	Q591-D649 HydrophobicContact CB-CB 4.2Å; Q591-D649 VanDerWaalsContact CD-CB 3.44Å; Q591-D649 HydrophobicContact CG-CB 3.85Å; Q591-D649 WeakPolarHBondContact CG-O 3.4Å; Q591-D649 PolarHBondContact N-O 2.8Å
650	L	90.7	Very high	86.4	Confident	26 Å²	26	45.7 Å²	45.7	14%	0.136	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	135.3	-178.5	-59.5	177.2	0	0	0	110.3	V588 E589 L599 L640 H641 I648 V652	V588-L650 HydrophobicContact CG1-CB 4.41Å; V588-L650 HydrophobicContact CG1-CD1 4.2Å; V588-L650 HydrophobicContact CG1-CD2 4.27Å; E589-L650 CarbonylContact O-C 3.45Å; L599-L650 HydrophobicContact CD1-CD2 3.82Å; L640-L650 HydrophobicContact CB-CD1 4.5Å; L640-L650 HydrophobicContact CD2-CD1 3.8Å; L640-L650 HydrophobicContact CG-CD1 3.87Å; H641-L650 HydrophobicContact CB-CD1 4.47Å; I648-L650 HydrophobicContact CG2-CD2 3.93Å; I648-L650 PolarHBondContact O-N 2.75Å; L650-V652 HydrophobicContact CB-CG2 4.24Å
651	K	92.3	Very high	86.6	Confident	131 Å²	131	45.7 Å²	45.7	57%	0.57	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	114.6	165.5	-176.4	-173.8	172	-158.4	0	107.9	E589	E589-K651 PolarHBondContact N-O 2.88Å; E589-K651 PolarHBondContact O-N 2.67Å; E589-K651 IonicContact OE2-NZ 3.14Å
652	V	92.1	Very high	86.9	Confident	61 Å²	61	41.9 Å²	41.9	37%	0.37	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	127.5	-175.6	-174.7	0	0	0	0	108.4	V586 L637 L650	V586-V652 HydrophobicContact CG1-CB 4.5Å; V586-V652 HydrophobicContact CG1-CG1 3.22Å; L637-V652 HydrophobicContact CD1-CG1 3.89Å; L637-V652 HydrophobicContact CD2-CG1 3.97Å; L637-V652 HydrophobicContact CD2-CG2 4.09Å; L650-V652 HydrophobicContact CB-CG2 4.24Å
653	S	90.1	Very high	87.3	Confident	39 Å²	39	35.5 Å²	35.5	27%	0.273	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-69	163.8	175.8	78	0	0	0	0	111.4	S587	S587-S653 PolarHBondContact N-OG 3.38Å; S587-S653 PolarHBondContact O-N 2.71Å
654	A	87	Confident	87.6	Confident	77 Å²	77	34.9 Å²	34.9	64%	0.636	23%	0.226	S	C	*	.	P	Polyproline II helix	trans	-58.2	152.1	163.3	0	0	0	0	0	110.2	I656	A654-I656 PolarHBondContact O-N 2.65Å
655	P	86.5	Confident	87.5	Confident	56 Å²	56	38.2 Å²	38.2	36%	0.364	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-55.3	127.1	174.8	-26	35	0	0	0	112.3	V584 L633 F943	V584-P655 HydrophobicContact CG1-CB 4.31Å; L633-P655 HydrophobicContact CD2-CG 4.26Å; P655-F943 HydrophobicContact CB-CD1 3.84Å; P655-F943 HydrophobicContact CB-CD2 4.23Å; P655-F943 HydrophobicContact CB-CE1 3.3Å; P655-F943 HydrophobicContact CB-CE2 3.74Å; P655-F943 HydrophobicContact CB-CG 4.28Å; P655-F943 HydrophobicContact CB-CZ 3.25Å; P655-F943 HydrophobicContact CG-CD1 3.84Å; P655-F943 HydrophobicContact CG-CE1 3.74Å; P655-F943 HydrophobicContact CG-CG 4.37Å; P655-F943 HydrophobicContact CG-CZ 4.18Å
656	I	83.9	Confident	87.2	Confident	18 Å²	18	42 Å²	42	9%	0.092	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-102.3	128	-179.5	-66.5	155.8	0	0	0	108.2	R585 A654	R585-I656 HydrophobicContact CB-CB 4Å; R585-I656 HydrophobicContact CB-CG2 4.21Å; R585-I656 WeakPolarHBondContact CB-O 3.09Å; R585-I656 PolarHBondContact N-O 2.84Å; R585-I656 WeakPolarHBondContact O-CA 3.02Å; R585-I656 WeakPolarHBondContact O-CB 3.33Å; R585-I656 PolarHBondContact O-N 2.92Å; A654-I656 PolarHBondContact O-N 2.65Å
657	V	85.1	Confident	87	Confident	4 Å²	4	42.9 Å²	42.9	2%	0.024	27%	0.274	C	S	.	.			trans	-105.2	131.2	172.5	-178.7	0	0	0	0	108.6	F659 P892 V939 V940 F943	V657-F659 WeakPolarHBondContact O-CD2 3.41Å; V657-F659 PolarHBondContact O-N 2.95Å; V657-P892 HydrophobicContact CG1-CG 3.32Å; V657-V939 HydrophobicContact CG1-CB 4.02Å; V657-V939 HydrophobicContact CG1-CG1 3.97Å; V657-V939 HydrophobicContact CG2-CB 4.44Å; V657-V939 HydrophobicContact CG2-CG1 3.81Å; V657-V940 HydrophobicContact CB-CB 4.29Å; V657-V940 HydrophobicContact CG2-CB 4.03Å; V657-V940 HydrophobicContact CG2-CG2 4.42Å; V657-F943 HydrophobicContact CG2-CE2 3.73Å; V657-F943 HydrophobicContact CG2-CZ 4.21Å
658	P	85	Confident	86.5	Confident	8 Å²	8	46.8 Å²	46.8	5%	0.052	27%	0.271	C	S	.	.			trans	-67.9	130.2	172.9	26.9	-32	0	0	0	110.2	I583 P892 W966	I583-P658 HydrophobicContact CG2-CG 4Å; I583-P658 VanDerWaalsContact O-CD 3.27Å; I583-P658 WeakPolarHBondContact O-CD 3.3Å; P658-P892 VanDerWaalsContact O-CD 3.29Å; P658-P892 WeakPolarHBondContact O-CD 3.48Å; P658-W966 HydrophobicContact CB-CH2 4.18Å; P658-W966 HydrophobicContact CG-CH2 4Å; P658-W966 WeakPolarHBondContact O-CZ3 3.46Å
659	F	90.3	Very high	85.6	Confident	12 Å²	12	49.4 Å²	49.4	5%	0.053	29%	0.287	C	S	.	.			trans	-101.7	164.2	167	-65.2	-86.3	0	0	0	109.4	V657 E837 M891 V940 Y999 V1003	V657-F659 WeakPolarHBondContact O-CD2 3.41Å; V657-F659 PolarHBondContact O-N 2.95Å; F659-E837 HydrophobicContact CB-CG 4.28Å; F659-E837 WeakPolarHBondContact O-CB 3.5Å; F659-M891 HydrophobicContact CD1-CB 4.17Å; F659-M891 HydrophobicContact CE1-CB 4.12Å; F659-M891 HydrophobicContact CE1-CE 4.26Å; F659-V940 HydrophobicContact CZ-CB 4.38Å; F659-V940 HydrophobicContact CZ-CG1 4.48Å; F659-V940 HydrophobicContact CZ-CG2 4.34Å; F659-Y999 HydrophobicContact CE1-CD2 4.47Å; F659-Y999 HydrophobicContact CE1-CG 4.44Å; F659-Y999 HydrophobicContact CZ-CD1 4.35Å; F659-Y999 HydrophobicContact CZ-CG 4.14Å; F659-V1003 HydrophobicContact CD2-CG2 3.58Å; F659-V1003 HydrophobicContact CE2-CG2 3.84Å
660	A	91.9	Very high	84.3	Confident	7 Å²	7	46.2 Å²	46.2	6%	0.058	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	164.9	164.1	0	0	0	0	0	109.7	P838 R840 V890	A660-P838 CarbonylContact C-O 3.55Å; A660-P838 VanDerWaalsContact CA-O 3.26Å; A660-P838 WeakPolarHBondContact CA-O 3.26Å; A660-P838 VanDerWaalsContact CB-O 3.31Å; A660-P838 WeakPolarHBondContact CB-O 3.31Å; A660-R840 HydrophobicContact CB-CB 3.98Å; A660-V890 HydrophobicContact CB-CB 4.07Å; A660-V890 PolarHBondContact N-O 2.78Å; A660-V890 PolarHBondContact O-N 2.83Å
661	E	93.9	Very high	83	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137	-179.5	-56.7	-174.1	-156.8	0	0	109.5	G832 P833 M834 C835 D836 E837 P838 I839 R840 F882	E661-G832 VanDerWaalsContact OE2-CA 3.31Å; E661-G832 WeakPolarHBondContact OE2-CA 3.43Å; E661-P833 VanDerWaalsContact OE2-CD 3.26Å; E661-P833 WeakPolarHBondContact OE2-CD 3.47Å; E661-P833 VanDerWaalsContact OE2-N 3.11Å; E661-M834 HydrophobicContact CB-CE 3.66Å; E661-M834 HydrophobicContact CG-CB 4.48Å; E661-M834 HydrophobicContact CG-CE 3.68Å; E661-M834 VanDerWaalsContact OE2-CB 3.31Å; E661-M834 WeakPolarHBondContact OE2-CB 3.36Å; E661-M834 PolarHBondContact OE2-N 2.94Å; E661-C835 WeakPolarHBondContact OE1-CA 3.35Å; E661-C835 PolarHBondContact OE1-N 2.9Å; E661-D836 PolarHBondContact OE1-N 3.17Å; E661-E837 HydrophobicContact CG-CB 4.1Å; E661-E837 PolarHBondContact OE1-N 3.26Å; E661-P838 PolarHBondContact N-O 3.37Å; E661-I839 CarbonylContact O-C 3.49Å; E661-I839 VanDerWaalsContact O-CA 3.3Å; E661-I839 WeakPolarHBondContact O-CA 3.42Å; E661-R840 PolarHBondContact O-N 2.85Å; E661-F882 HydrophobicContact CB-CZ 4.03Å
662	T	94.4	Very high	81.4	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	169.8	176.6	-160.1	0	0	0	0	111	R840 R888 V890 I968	T662-R840 VanDerWaalsContact CB-O 3.29Å; T662-R840 WeakPolarHBondContact CB-O 3.33Å; T662-R840 PolarHBondContact OG1-O 3.19Å; T662-R888 HydrophobicContact CG2-CB 4.03Å; T662-R888 PolarHBondContact N-O 3.01Å; T662-R888 PolarHBondContact O-N 3.25Å; T662-V890 HydrophobicContact CG2-CG2 3.39Å; T662-I968 HydrophobicContact CG2-CD1 4.09Å; T662-I968 HydrophobicContact CG2-CG1 4.13Å; T662-I968 HydrophobicContact CG2-CG2 4.14Å
663	I	92.6	Very high	80.1	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	149.3	170.3	54	167.1	0	0	0	109	A702 L703 P704 V842 F882 Q885 P886 Q887	I663-A702 HydrophobicContact CD1-CB 3.97Å; I663-L703 VanDerWaalsContact CD1-C 3.47Å; I663-P704 HydrophobicContact CG1-CB 4.42Å; I663-V842 HydrophobicContact CD1-CG1 3.89Å; I663-V842 HydrophobicContact CD1-CG2 4.46Å; I663-V842 HydrophobicContact CG1-CG1 4.15Å; I663-V842 HydrophobicContact CG1-CG2 3.8Å; I663-F882 HydrophobicContact CG2-CD1 3.96Å; I663-F882 HydrophobicContact CG2-CD2 3.72Å; I663-F882 HydrophobicContact CG2-CE1 3.87Å; I663-F882 HydrophobicContact CG2-CE2 3.62Å; I663-F882 HydrophobicContact CG2-CG 3.91Å; I663-F882 HydrophobicContact CG2-CZ 3.7Å; I663-Q885 HydrophobicContact CB-CB 3.91Å; I663-Q885 HydrophobicContact CD1-CB 4.08Å; I663-Q885 HydrophobicContact CD1-CG 3.91Å; I663-Q885 HydrophobicContact CG2-CB 3.76Å; I663-P886 WeakPolarHBondContact CA-O 3.44Å; I663-Q887 HydrophobicContact CG2-CG 4.49Å
664	I	89.7	Confident	78.6	Confident	33 Å²	33	51.7 Å²	51.7	17%	0.169	30%	0.303	C	S	.	.			trans	-117.8	157.8	174.1	61.1	167.5	0	0	0	109.5	P886 R888 I968	I664-P886 HydrophobicContact CD1-CB 4.46Å; I664-P886 HydrophobicContact CG1-CB 3.87Å; I664-P886 HydrophobicContact CG1-CG 4.43Å; I664-P886 PolarHBondContact N-O 3.1Å; I664-P886 WeakPolarHBondContact O-CD 3.49Å; I664-R888 HydrophobicContact CD1-CG 3.86Å; I664-R888 HydrophobicContact CG1-CG 4.02Å; I664-R888 HydrophobicContact CG2-CB 4.36Å; I664-R888 HydrophobicContact CG2-CG 3.77Å; I664-I968 HydrophobicContact CG2-CD1 4.29Å; I664-I968 HydrophobicContact CG2-CG2 4.25Å
665	P	83	Confident	77.6	Confident	86 Å²	86	54.4 Å²	54.4	56%	0.558	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-54.6	146.2	166.7	-21.6	32.5	0	0	0	110.8	P704	P665-P704 HydrophobicContact CG-CG 3.89Å
666	P	77.1	Confident	76.4	Confident	79 Å²	79	55.7 Å²	55.7	51%	0.513	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-51.7	132.1	172.1	-24.9	33.8	0	0	0	111.2	P886	P666-P886 HydrophobicContact CB-CG 4.35Å; P666-P886 HydrophobicContact CG-CG 4.33Å
667	P	69.4	Low	75	Confident	71 Å²	71	60.6 Å²	60.6	46%	0.461	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-65.1	141.7	176.6	27.7	-33.4	0	0	0	110.3	I676	P667-I676 HydrophobicContact CB-CD1 4.49Å; P667-I676 HydrophobicContact CG-CD1 4.2Å; P667-I676 WeakPolarHBondContact O-CD1 3.42Å
668	E	68	Low	73.4	Confident	165 Å²	165	65.8 Å²	65.8	77%	0.771	37%	0.368	S	S	*	.	S	Bend	trans	-84.7	-20.1	175.6	-62.6	-176.4	169.7	0	0	112.4	I676	E668-I676 PolarHBondContact O-N 2.75Å
669	V	65.4	Low	71.5	Confident	64 Å²	64	71.4 Å²	71.4	39%	0.388	40%	0.402	S	S	.	.	B	Isolated β-bridge	trans	-130.9	140.1	-173.3	-166.6	0	0	0	0	108.9	N673 E674	V669-N673 HydrophobicContact CG1-CB 4.31Å; V669-N673 WeakPolarHBondContact CG1-O 3.3Å; V669-E674 CarbonylContact C-O 3.55Å; V669-E674 VanDerWaalsContact CA-O 3.3Å; V669-E674 WeakPolarHBondContact CA-O 3.36Å; V669-E674 VanDerWaalsContact CG1-O 3.28Å; V669-E674 WeakPolarHBondContact CG1-O 3.48Å
670	D	62.5	Low	69.3	Low	26 Å²	26	79.1 Å²	79.1	14%	0.139	44%	0.438	C	S	.	.			trans	-79.6	-178.6	176.9	74.5	9.3	0	0	0	112.9	A672 N673 E674 I676	D670-A672 PolarHBondContact O-N 3.34Å; D670-A672 VanDerWaalsContact OD1-C 3.3Å; D670-A672 VanDerWaalsContact OD1-CA 3.29Å; D670-A672 WeakPolarHBondContact OD1-CA 3.47Å; D670-A672 WeakPolarHBondContact OD1-CB 3.27Å; D670-A672 PolarHBondContact OD1-N 3.06Å; D670-N673 PolarHBondContact O-N 3.43Å; D670-N673 PolarHBondContact OD1-N 2.82Å; D670-E674 PolarHBondContact N-O 3.49Å; D670-E674 PolarHBondContact OD1-N 3.03Å; D670-I676 HydrophobicContact CB-CD1 4.25Å; D670-I676 HydrophobicContact CB-CG1 4.02Å
671	L	63.4	Low	66.7	Low	100 Å²	100	88 Å²	88	52%	0.524	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-11.4	178.6	-69.3	178.7	0	0	0	113.9	N673 W975	L671-N673 VanDerWaalsContact C-N 3.34Å; L671-W975 HydrophobicContact CD1-CD2 3.98Å; L671-W975 VanDerWaalsContact CD1-CE2 3.41Å; L671-W975 HydrophobicContact CD1-CG 4.18Å; L671-W975 HydrophobicContact CD1-CZ2 3.81Å; L671-W975 VanDerWaalsContact CD1-NE1 3.27Å
672	A	58.7	Low	64.5	Low	39 Å²	39	93.2 Å²	93.2	32%	0.322	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	2.7	172.6	0	0	0	0	0	112.3	D670 E674	D670-A672 PolarHBondContact O-N 3.34Å; D670-A672 VanDerWaalsContact OD1-C 3.3Å; D670-A672 VanDerWaalsContact OD1-CA 3.29Å; D670-A672 WeakPolarHBondContact OD1-CA 3.47Å; D670-A672 WeakPolarHBondContact OD1-CB 3.27Å; D670-A672 PolarHBondContact OD1-N 3.06Å; A672-E674 VanDerWaalsContact C-N 3.29Å; A672-E674 HydrophobicContact CB-CG 4.32Å
673	N	64.5	Low	62.5	Low	141 Å²	141	101.3 Å²	101.3	75%	0.754	54%	0.544	S	S	*	.	S	Bend	trans	66.7	21.8	-172.9	-59	-55.2	0	0	0	114.6	V669 D670 L671	V669-N673 HydrophobicContact CG1-CB 4.31Å; V669-N673 WeakPolarHBondContact CG1-O 3.3Å; D670-N673 PolarHBondContact O-N 3.43Å; D670-N673 PolarHBondContact OD1-N 2.82Å; L671-N673 VanDerWaalsContact C-N 3.34Å
674	E	58.7	Low	60.8	Low	93 Å²	93	111.6 Å²	111.6	44%	0.435	58%	0.583	S	S	.	*			trans	-86.2	139.5	171.8	-55.3	-155.5	128.9	0	0	111.2	V669 D670 A672 I676	V669-E674 CarbonylContact C-O 3.55Å; V669-E674 VanDerWaalsContact CA-O 3.3Å; V669-E674 WeakPolarHBondContact CA-O 3.36Å; V669-E674 VanDerWaalsContact CG1-O 3.28Å; V669-E674 WeakPolarHBondContact CG1-O 3.48Å; D670-E674 PolarHBondContact N-O 3.49Å; D670-E674 PolarHBondContact OD1-N 3.03Å; A672-E674 VanDerWaalsContact C-N 3.29Å; A672-E674 HydrophobicContact CB-CG 4.32Å; E674-I676 PolarHBondContact O-N 3.34Å
675	I	65.1	Low	59.9	Low	134 Å²	134	112.6 Å²	112.6	69%	0.687	59%	0.593	S	S	*	*	B	Isolated β-bridge	trans	-65.9	122.1	175.6	-61.2	171.4	0	0	0	108	L677	I675-L677 PolarHBondContact O-N 3.32Å
676	I	62.1	Low	59.9	Low	83 Å²	83	109.6 Å²	109.6	43%	0.426	57%	0.574	S	S	.	*			trans	-69.5	99.7	177	-61.5	169	0	0	0	107.4	P667 E668 D670 E674	P667-I676 HydrophobicContact CB-CD1 4.49Å; P667-I676 HydrophobicContact CG-CD1 4.2Å; P667-I676 WeakPolarHBondContact O-CD1 3.42Å; E668-I676 PolarHBondContact O-N 2.75Å; D670-I676 HydrophobicContact CB-CD1 4.25Å; D670-I676 HydrophobicContact CB-CG1 4.02Å; E674-I676 PolarHBondContact O-N 3.34Å
677	L	54.2	Low	60.5	Low	121 Å²	121	107.5 Å²	107.5	63%	0.634	56%	0.558	S	S	*	*			trans	-57.8	135.2	178.1	-72.5	167.1	0	0	0	109.5	I675 T679	I675-L677 PolarHBondContact O-N 3.32Å; L677-T679 PolarHBondContact O-N 2.84Å
678	P	51.5	Low	61.5	Low	113 Å²	113	107.8 Å²	107.8	73%	0.734	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.7	8.2	-175.5	24.5	-32.8	0	0	0	114.6	Q680	P678-Q680 VanDerWaalsContact C-N 3.28Å; P678-Q680 PolarHBondContact O-N 3.01Å
679	T	45.4	Very low	62.6	Low	126 Å²	126	101 Å²	101	77%	0.773	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-9.7	-174.7	40	0	0	0	0	114.2	L677	L677-T679 PolarHBondContact O-N 2.84Å
680	Q	42.9	Very low	63.8	Low	174 Å²	174	104 Å²	104	81%	0.813	53%	0.532	S	S	*	.	S	Bend	trans	-95.8	94.4	158.3	-63	-170.4	22.9	0	0	108.4	P678 P682	P678-Q680 VanDerWaalsContact C-N 3.28Å; P678-Q680 PolarHBondContact O-N 3.01Å; Q680-P682 VanDerWaalsContact O-N 3.11Å
681	K	38.3	Very low	65	Low	192 Å²	192	102.8 Å²	102.8	84%	0.835	53%	0.526	S	S	*	.			trans	-41.8	123.4	177.3	-79.9	-179.6	176.7	177	0	109.5	K683	K681-K683 PolarHBondContact O-N 3.1Å
682	P	46.4	Very low	66	Low	111 Å²	111	103.5 Å²	103.5	72%	0.721	53%	0.534	S	S	*	.			trans	-53.6	130.4	177.3	20.9	-30.8	0	0	0	107.9	Q680 R684	Q680-P682 VanDerWaalsContact O-N 3.11Å; P682-R684 PolarHBondContact O-N 2.95Å; P682-R684 VanDerWaalsContact O-N 3.16Å
683	K	52.9	Low	67.1	Low	175 Å²	175	103.8 Å²	103.8	76%	0.761	53%	0.534	S	S	*	.			trans	-45.3	127.9	173.3	-79.4	176.4	178.4	171.1	0	107.3	K681 S685	K681-K683 PolarHBondContact O-N 3.1Å; K683-S685 PolarHBondContact O-N 3.38Å; K683-S685 VanDerWaalsContact O-N 3.07Å
684	R	57.4	Low	67.9	Low	217 Å²	217	101.5 Å²	101.5	82%	0.819	52%	0.519	S	S	*	.			trans	-35.3	115.9	-174.3	-73.6	177.8	170.2	171.3	-4.4	110.6	P682 S686	P682-R684 PolarHBondContact O-N 2.95Å; P682-R684 VanDerWaalsContact O-N 3.16Å; R684-S686 VanDerWaalsContact C-N 3.26Å; R684-S686 PolarHBondContact O-N 3.22Å
685	S	70.4	Confident	69	Low	55 Å²	55	97.7 Å²	97.7	39%	0.385	50%	0.503	S	S	.	.	S	Bend	trans	-65.8	-30.3	-176	51.6	0	0	0	0	112.7	K683	K683-S685 PolarHBondContact O-N 3.38Å; K683-S685 VanDerWaalsContact O-N 3.07Å
686	S	82.9	Confident	70	Confident	22 Å²	22	91.5 Å²	91.5	15%	0.154	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	132.9	173.7	-45.2	0	0	0	0	110.7	R684 L700 E847	R684-S686 VanDerWaalsContact C-N 3.26Å; R684-S686 PolarHBondContact O-N 3.22Å; S686-L700 CarbonylContact C-O 3.56Å; S686-L700 WeakPolarHBondContact CA-O 3.33Å; S686-E847 VanDerWaalsContact CB-OE2 3.3Å; S686-E847 WeakPolarHBondContact CB-OE2 3.37Å; S686-E847 VanDerWaalsContact OG-CD 3.27Å; S686-E847 PolarHBondContact OG-OE1 3.22Å; S686-E847 PolarHBondContact OG-OE2 3Å
687	I	89.5	Confident	71.3	Confident	36 Å²	36	89.1 Å²	89.1	19%	0.185	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	134.5	178.2	-57.5	-60	0	0	0	109.2	V689 K699 L700 L880 A881 A884	I687-V689 HydrophobicContact CG2-CG2 3.96Å; I687-K699 CarbonylContact O-C 3.56Å; I687-K699 WeakPolarHBondContact O-CA 3.21Å; I687-L700 PolarHBondContact N-O 2.96Å; I687-L700 PolarHBondContact O-N 3.42Å; I687-L880 HydrophobicContact CB-CB 4.46Å; I687-L880 HydrophobicContact CG1-CB 4.2Å; I687-L880 HydrophobicContact CG2-CB 3.82Å; I687-L880 HydrophobicContact CG2-CD1 4.06Å; I687-A881 HydrophobicContact CG1-CB 4.28Å; I687-A884 HydrophobicContact CD1-CB 4.31Å
688	V	91	Very high	73	Confident	76 Å²	76	83.4 Å²	83.4	46%	0.461	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	126.8	174.2	-178	0	0	0	0	108.8	E697 F698 K699	V688-E697 VanDerWaalsContact CG1-CD 3.43Å; V688-E697 HydrophobicContact CG1-CG 3.37Å; V688-F698 CarbonylContact C-O 3.38Å; V688-F698 VanDerWaalsContact CA-O 3.3Å; V688-F698 WeakPolarHBondContact CA-O 3.29Å; V688-K699 HydrophobicContact CG2-CB 4.33Å; V688-K699 HydrophobicContact CG2-CG 4.05Å
689	V	90.7	Very high	75	Confident	23 Å²	23	81.6 Å²	81.6	14%	0.139	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	141.1	176.5	177.7	0	0	0	0	110.3	I687 E697 F698 S873 L880	I687-V689 HydrophobicContact CG2-CG2 3.96Å; V689-E697 WeakPolarHBondContact O-CA 3.46Å; V689-F698 PolarHBondContact N-O 3.04Å; V689-F698 PolarHBondContact O-N 3.46Å; V689-S873 WeakPolarHBondContact CG1-O 3.48Å; V689-L880 HydrophobicContact CG2-CD1 4.16Å
690	R	91	Very high	77.3	Confident	128 Å²	128	75.6 Å²	75.6	48%	0.483	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	149	176.3	-62.9	-178.7	-176.6	174.5	-6.1	110.8	Y696 E697 L852	R690-Y696 WeakPolarHBondContact CA-O 3.3Å; R690-E697 HydrophobicContact CG-CB 4.08Å; R690-E697 HydrophobicContact CG-CG 3.95Å; R690-E697 IonicContact CZ-OE2 2.85Å; R690-E697 VanDerWaalsContact CZ-OE2 3.23Å; R690-E697 IonicContact NE-OE2 2.82Å; R690-E697 PolarHBondContact NE-OE2 3.34Å; R690-E697 IonicContact NH2-OE2 2.71Å; R690-E697 PolarHBondContact NH2-OE2 3.43Å; R690-L852 HydrophobicContact CG-CD1 4.5Å
691	T	87.4	Confident	79.6	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	34%	0.343	C	S	.	.			trans	-62.5	157	170.4	47	0	0	0	0	112.2	S693 Q694 S695 Y696 F698 Q869 I870 S873	T691-S693 PolarHBondContact O-N 3Å; T691-Q694 WeakPolarHBondContact O-CA 3.48Å; T691-Q694 PolarHBondContact O-N 3.2Å; T691-S695 PolarHBondContact OG1-N 3.25Å; T691-S695 VanDerWaalsContact OG1-N 3.11Å; T691-Y696 HydrophobicContact CG2-CD2 4.35Å; T691-Y696 PolarHBondContact N-O 3.46Å; T691-Y696 PolarHBondContact OG1-N 3.03Å; T691-Y696 PolarHBondContact OG1-O 3.34Å; T691-Y696 VanDerWaalsContact OG1-O 3.14Å; T691-F698 HydrophobicContact CG2-CE2 4.14Å; T691-Q869 HydrophobicContact CG2-CB 4.46Å; T691-I870 HydrophobicContact CG2-CG1 4.21Å; T691-S873 VanDerWaalsContact CA-OG 3.31Å; T691-S873 WeakPolarHBondContact CA-OG 3.28Å
692	T	84.7	Confident	82.3	Confident	114 Å²	114	60.4 Å²	60.4	70%	0.699	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-35.3	177.7	40.8	0	0	0	0	112.5	Q694 Q869	T692-Q694 PolarHBondContact O-N 3Å; T692-Q869 VanDerWaalsContact OG1-CG 3.3Å; T692-Q869 WeakPolarHBondContact OG1-CG 3.46Å; T692-Q869 PolarHBondContact OG1-OE1 2.97Å
693	S	81.8	Confident	84.5	Confident	46 Å²	46	56.5 Å²	56.5	32%	0.322	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-5.7	172.3	62.3	0	0	0	0	114	T691 S695 Q869	T691-S693 PolarHBondContact O-N 3Å; S693-S695 WeakPolarHBondContact CB-OG 3.25Å; S693-S695 PolarHBondContact O-N 3.29Å; S693-S695 WeakPolarHBondContact OG-CB 3.41Å; S693-S695 PolarHBondContact OG-N 2.95Å; S693-S695 PolarHBondContact OG-OG 3.26Å; S693-Q869 PolarHBondContact OG-OE1 3.38Å; S693-Q869 VanDerWaalsContact OG-OE1 3.1Å
694	Q	82.5	Confident	86.3	Confident	93 Å²	93	49.6 Å²	49.6	44%	0.435	25%	0.248	S	C	.	.	S	Bend	trans	56.8	21.2	-169.9	-56.1	-76.2	-45.9	0	0	113.2	T691 T692 L852	T691-Q694 WeakPolarHBondContact O-CA 3.48Å; T691-Q694 PolarHBondContact O-N 3.2Å; T692-Q694 PolarHBondContact O-N 3Å; Q694-L852 WeakPolarHBondContact O-CB 3.4Å; Q694-L852 WeakPolarHBondContact O-CD1 3.48Å
695	S	81.5	Confident	88	Confident	13 Å²	13	39.5 Å²	39.5	9%	0.091	21%	0.211	C	C	.	.			trans	-79	-32.4	-179.1	-51.7	0	0	0	0	112.7	T691 S693 L852	T691-S695 PolarHBondContact OG1-N 3.25Å; T691-S695 VanDerWaalsContact OG1-N 3.11Å; S693-S695 WeakPolarHBondContact CB-OG 3.25Å; S693-S695 PolarHBondContact O-N 3.29Å; S693-S695 WeakPolarHBondContact OG-CB 3.41Å; S693-S695 PolarHBondContact OG-N 2.95Å; S693-S695 PolarHBondContact OG-OG 3.26Å; S695-L852 PolarHBondContact O-N 2.9Å
696	Y	85.3	Confident	89	Confident	3 Å²	3	37.8 Å²	37.8	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	142.3	-179	-60.7	-75.8	0	0	0	111.8	R690 T691 Y817 W849 N850 D851 H866 I870	R690-Y696 WeakPolarHBondContact CA-O 3.3Å; T691-Y696 HydrophobicContact CG2-CD2 4.35Å; T691-Y696 PolarHBondContact N-O 3.46Å; T691-Y696 PolarHBondContact OG1-N 3.03Å; T691-Y696 PolarHBondContact OG1-O 3.34Å; T691-Y696 VanDerWaalsContact OG1-O 3.14Å; Y696-Y817 HydrophobicContact CE1-CE2 4.43Å; Y696-Y817 HydrophobicContact CE2-CE2 4.35Å; Y696-Y817 AromaticContact CZ-CE2 3.8Å; Y696-Y817 WeakPolarHBondContact OH-CE2 3.32Å; Y696-Y817 PolarHBondContact OH-OH 3.24Å; Y696-W849 AromaticContact CD1-NE1 3.65Å; Y696-N850 WeakPolarHBondContact CA-O 3.43Å; Y696-D851 HydrophobicContact CD1-CB 4.09Å; Y696-D851 HydrophobicContact CE1-CB 3.8Å; Y696-D851 VanDerWaalsContact CE1-CG 3.48Å; Y696-D851 WeakPolarHBondContact CE1-OD2 3.44Å; Y696-D851 PolarHBondContact OH-OD2 3.09Å; Y696-H866 HydrophobicContact CE2-CB 4.43Å; Y696-H866 AromaticContact CE2-ND1 3.89Å; Y696-I870 HydrophobicContact CD2-CD1 4.04Å; Y696-I870 HydrophobicContact CD2-CG1 4.15Å; Y696-I870 HydrophobicContact CE2-CD1 4.13Å
697	E	90	Very high	89.3	Confident	33 Å²	33	42.2 Å²	42.2	15%	0.154	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133.4	172.9	-175.9	176.7	83.5	0	0	110.4	V688 V689 R690 W849 N850 L852	V688-E697 VanDerWaalsContact CG1-CD 3.43Å; V688-E697 HydrophobicContact CG1-CG 3.37Å; V689-E697 WeakPolarHBondContact O-CA 3.46Å; R690-E697 HydrophobicContact CG-CB 4.08Å; R690-E697 HydrophobicContact CG-CG 3.95Å; R690-E697 IonicContact CZ-OE2 2.85Å; R690-E697 VanDerWaalsContact CZ-OE2 3.23Å; R690-E697 IonicContact NE-OE2 2.82Å; R690-E697 PolarHBondContact NE-OE2 3.34Å; R690-E697 IonicContact NH2-OE2 2.71Å; R690-E697 PolarHBondContact NH2-OE2 3.43Å; E697-W849 WeakPolarHBondContact O-CA 3.2Å; E697-N850 HydrophobicContact CB-CB 4.39Å; E697-N850 PolarHBondContact N-O 2.91Å; E697-N850 PolarHBondContact O-N 3.46Å; E697-L852 HydrophobicContact CB-CD1 3.95Å; E697-L852 HydrophobicContact CB-CD2 4.41Å; E697-L852 HydrophobicContact CB-CG 4.18Å
698	F	90.4	Very high	89.3	Confident	1 Å²	1	43.9 Å²	43.9	0%	0.004	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.2	179.8	-58.9	-84.3	0	0	0	110.2	V688 V689 T691 L700 L821 D848 W849 I870 V874	V688-F698 CarbonylContact C-O 3.38Å; V688-F698 VanDerWaalsContact CA-O 3.3Å; V688-F698 WeakPolarHBondContact CA-O 3.29Å; V689-F698 PolarHBondContact N-O 3.04Å; V689-F698 PolarHBondContact O-N 3.46Å; T691-F698 HydrophobicContact CG2-CE2 4.14Å; F698-L700 HydrophobicContact CB-CD1 4.42Å; F698-L700 HydrophobicContact CB-CD2 4.42Å; F698-L700 HydrophobicContact CB-CG 4.19Å; F698-L821 HydrophobicContact CD1-CD2 4.26Å; F698-L821 HydrophobicContact CE1-CD1 4.35Å; F698-L821 HydrophobicContact CE1-CD2 4Å; F698-L821 HydrophobicContact CE1-CG 4.45Å; F698-D848 WeakPolarHBondContact CA-O 3.46Å; F698-W849 HydrophobicContact CD1-CB 4.35Å; F698-W849 AromaticContact CD1-CD1 3.78Å; F698-W849 HydrophobicContact CD1-CD2 4.49Å; F698-W849 AromaticContact CD1-CG 3.96Å; F698-W849 HydrophobicContact CD1-CG 3.96Å; F698-W849 AromaticContact CE1-CD1 3.33Å; F698-W849 AromaticContact CE1-CD2 3.85Å; F698-W849 HydrophobicContact CE1-CD2 3.85Å; F698-W849 AromaticContact CE1-CE2 3.61Å; F698-W849 AromaticContact CE1-CG 3.69Å; F698-W849 HydrophobicContact CE1-CG 3.69Å; F698-W849 HydrophobicContact CE1-CZ2 4.34Å; F698-W849 AromaticContact CE1-NE1 3.31Å; F698-W849 VanDerWaalsContact CE1-NE1 3.31Å; F698-W849 AromaticContact CZ-CD1 3.94Å; F698-W849 AromaticContact CZ-NE1 3.6Å; F698-I870 HydrophobicContact CE2-CG2 4.39Å; F698-I870 HydrophobicContact CZ-CG1 4.27Å; F698-I870 HydrophobicContact CZ-CG2 3.83Å; F698-V874 HydrophobicContact CD1-CG2 4.46Å; F698-V874 HydrophobicContact CD2-CG2 4.36Å; F698-V874 HydrophobicContact CE1-CG2 4.33Å; F698-V874 HydrophobicContact CE2-CG2 4.24Å; F698-V874 HydrophobicContact CG-CG2 4.48Å; F698-V874 HydrophobicContact CZ-CG2 4.23Å
699	K	92.5	Very high	89.3	Confident	76 Å²	76	40.3 Å²	40.3	33%	0.33	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.4	169.5	-170.1	-177.2	-179.4	-142.3	0	109.6	I687 V688 E847 D848	I687-K699 CarbonylContact O-C 3.56Å; I687-K699 WeakPolarHBondContact O-CA 3.21Å; V688-K699 HydrophobicContact CG2-CB 4.33Å; V688-K699 HydrophobicContact CG2-CG 4.05Å; K699-E847 HydrophobicContact CB-CB 4.28Å; K699-E847 HydrophobicContact CD-CB 4.04Å; K699-E847 WeakPolarHBondContact CD-OE2 3.31Å; K699-E847 WeakPolarHBondContact CE-OE2 3.4Å; K699-E847 HydrophobicContact CG-CB 4.14Å; K699-E847 IonicContact NZ-OE2 3.52Å; K699-E847 PolarHBondContact NZ-OE2 2.88Å; K699-E847 PolarHBondContact O-N 2.86Å; K699-D848 HydrophobicContact CB-CB 3.58Å; K699-D848 HydrophobicContact CD-CB 4.23Å; K699-D848 PolarHBondContact N-O 3.05Å; K699-D848 PolarHBondContact O-N 3.27Å
700	L	93.3	Very high	89.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.1	-170.5	-58.8	173.9	0	0	0	110.9	S686 I687 F698 F845 V846 L878	S686-L700 CarbonylContact C-O 3.56Å; S686-L700 WeakPolarHBondContact CA-O 3.33Å; I687-L700 PolarHBondContact N-O 2.96Å; I687-L700 PolarHBondContact O-N 3.42Å; F698-L700 HydrophobicContact CB-CD1 4.42Å; F698-L700 HydrophobicContact CB-CD2 4.42Å; F698-L700 HydrophobicContact CB-CG 4.19Å; L700-F845 WeakPolarHBondContact CA-O 3.28Å; L700-V846 HydrophobicContact CD2-CB 4.21Å; L700-V846 HydrophobicContact CD2-CG1 4.12Å; L700-V846 HydrophobicContact CD2-CG2 3.81Å; L700-L878 HydrophobicContact CB-CD2 4.43Å; L700-L878 HydrophobicContact CD1-CD2 4.05Å; L700-L878 HydrophobicContact CD1-CG 4.12Å; L700-L878 HydrophobicContact CD2-CD2 4.33Å
701	K	92.7	Very high	89.2	Confident	47 Å²	47	38.4 Å²	38.4	20%	0.204	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	144.4	178.5	177.4	177.5	178.2	-172.9	0	110.4	L703 F844 F845 E847	K701-L703 HydrophobicContact CD-CD1 4.42Å; K701-L703 HydrophobicContact CG-CG 4.37Å; K701-F844 CarbonylContact O-C 3.59Å; K701-F844 WeakPolarHBondContact O-CA 3.21Å; K701-F845 HydrophobicContact CB-CB 4.28Å; K701-F845 PolarHBondContact N-O 2.87Å; K701-F845 PolarHBondContact O-N 3.06Å; K701-E847 WeakPolarHBondContact CD-OE1 3.3Å
702	A	93.2	Very high	89.2	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	133.9	176.1	0	0	0	0	0	109.9	I663 V842 A843 F844 A881 Q885	I663-A702 HydrophobicContact CD1-CB 3.97Å; A702-V842 HydrophobicContact CB-CG1 4.23Å; A702-A843 WeakPolarHBondContact CA-O 3.25Å; A702-F844 HydrophobicContact CB-CD1 3.82Å; A702-F844 HydrophobicContact CB-CE1 3.82Å; A702-A881 HydrophobicContact CB-CB 4.11Å; A702-Q885 WeakPolarHBondContact O-CG 3.23Å
703	L	92.7	Very high	89.4	Confident	28 Å²	28	33.2 Å²	33.2	15%	0.147	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.6	178.4	-70.6	169.7	0	0	0	110.9	I663 K701 M766 A843 F845	I663-L703 VanDerWaalsContact CD1-C 3.47Å; K701-L703 HydrophobicContact CD-CD1 4.42Å; K701-L703 HydrophobicContact CG-CG 4.37Å; L703-M766 HydrophobicContact CD1-CE 3.56Å; L703-A843 PolarHBondContact N-O 3.44Å; L703-A843 PolarHBondContact O-N 3.42Å; L703-F845 HydrophobicContact CB-CE2 4.02Å; L703-F845 HydrophobicContact CD1-CD2 3.98Å; L703-F845 HydrophobicContact CD1-CE2 3.49Å; L703-F845 VanDerWaalsContact CD1-CE2 3.49Å; L703-F845 HydrophobicContact CD1-CZ 4.04Å; L703-F845 HydrophobicContact CG-CD2 4.44Å; L703-F845 HydrophobicContact CG-CE2 4.14Å
704	P	92.5	Very high	89.5	Confident	30 Å²	30	34.8 Å²	34.8	20%	0.195	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	133.3	175.6	27.8	-33.1	0	0	0	110	I663 P665 W767	I663-P704 HydrophobicContact CG1-CB 4.42Å; P665-P704 HydrophobicContact CG-CG 3.89Å; P704-W767 VanDerWaalsContact O-CZ2 3.3Å; P704-W767 WeakPolarHBondContact O-CZ2 3.39Å
705	L	92.2	Very high	89.5	Confident	5 Å²	5	38.8 Å²	38.8	3%	0.026	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-79.8	134.7	176.5	-168.2	67.4	0	0	0	109.6	I709 Q710 I713 F760 W767 M786 G841 A843	L705-I709 HydrophobicContact CD1-CB 4.45Å; L705-I709 HydrophobicContact CD1-CG2 4.03Å; L705-I709 HydrophobicContact CD2-CB 4.5Å; L705-I709 HydrophobicContact CD2-CG2 3.97Å; L705-I709 HydrophobicContact CG-CB 4.22Å; L705-I709 HydrophobicContact CG-CG2 4.06Å; L705-Q710 HydrophobicContact CB-CG 4.18Å; L705-Q710 HydrophobicContact CD2-CG 3.95Å; L705-Q710 HydrophobicContact CG-CG 4.2Å; L705-Q710 PolarHBondContact O-NE2 3.45Å; L705-I713 HydrophobicContact CD2-CD1 3.87Å; L705-F760 HydrophobicContact CD1-CE1 4.46Å; L705-W767 HydrophobicContact CD1-CH2 4.1Å; L705-W767 HydrophobicContact CD1-CZ3 3.8Å; L705-M786 HydrophobicContact CD1-SD 3.83Å; L705-M786 HydrophobicContact CD2-CG 4.4Å; L705-M786 HydrophobicContact CD2-SD 4.05Å; L705-G841 WeakPolarHBondContact CB-O 3.3Å; L705-G841 PolarHBondContact N-O 2.98Å; L705-A843 HydrophobicContact CD1-CB 4.22Å
706	P	91.2	Very high	89.6	Confident	19 Å²	19	39.5 Å²	39.5	12%	0.123	18%	0.184	C	C	.	.	P	Polyproline II helix	trans	-57	142.4	177.1	-27	36.1	0	0	0	112.8	E708 I709 Q710 Q763 W767	P706-E708 VanDerWaalsContact C-N 3.31Å; P706-E708 PolarHBondContact O-N 2.92Å; P706-I709 HydrophobicContact CB-CG1 4.19Å; P706-I709 PolarHBondContact O-N 3.42Å; P706-Q710 PolarHBondContact O-N 2.87Å; P706-Q710 VanDerWaalsContact O-N 3.09Å; P706-Q763 HydrophobicContact CB-CG 4.12Å; P706-Q763 HydrophobicContact CG-CG 4.02Å; P706-W767 HydrophobicContact CG-CD2 4.12Å; P706-W767 HydrophobicContact CG-CZ2 4.07Å
707	L	88.7	Confident	89.3	Confident	116 Å²	116	42.1 Å²	42.1	61%	0.607	20%	0.197	S	C	*	.	H	α-helix	trans	-61.8	-37.5	-173.3	-173.6	67.7	0	0	0	112.7	I709 Q710 Q711	L707-I709 VanDerWaalsContact C-N 3.33Å; L707-I709 PolarHBondContact O-N 3.48Å; L707-Q710 WeakPolarHBondContact O-CB 3.42Å; L707-Q710 PolarHBondContact O-N 2.93Å; L707-Q711 WeakPolarHBondContact O-CG 3.27Å; L707-Q711 PolarHBondContact O-N 2.71Å
708	E	89.5	Confident	88.4	Confident	71 Å²	71	45.3 Å²	45.3	33%	0.332	22%	0.215	S	C	.	.	H	α-helix	trans	-59	-44.8	177	-177.4	169.3	-152.8	0	0	111.6	P706 Q710 Q711 I712 A759 R762 Q763	P706-E708 VanDerWaalsContact C-N 3.31Å; P706-E708 PolarHBondContact O-N 2.92Å; E708-Q710 PolarHBondContact O-N 3.43Å; E708-Q711 PolarHBondContact O-N 2.71Å; E708-I712 HydrophobicContact CG-CD1 4.35Å; E708-I712 WeakPolarHBondContact O-CG1 3.29Å; E708-I712 PolarHBondContact O-N 3.29Å; E708-I712 VanDerWaalsContact O-N 3.15Å; E708-A759 HydrophobicContact CG-CB 4.28Å; E708-R762 IonicContact OE1-CZ 3.66Å; E708-R762 IonicContact OE1-NH1 3.59Å; E708-R762 PolarHBondContact OE1-NH1 2.96Å; E708-R762 IonicContact OE2-NH1 3.23Å; E708-R762 PolarHBondContact OE2-NH1 3.33Å; E708-Q763 PolarHBondContact OE2-NE2 3.35Å
709	I	91.2	Very high	87.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.8	-41.2	176.3	-56.2	-65.6	0	0	0	111	L705 P706 L707 Q711 I712 I713 L756 A759 F760 M786	L705-I709 HydrophobicContact CD1-CB 4.45Å; L705-I709 HydrophobicContact CD1-CG2 4.03Å; L705-I709 HydrophobicContact CD2-CB 4.5Å; L705-I709 HydrophobicContact CD2-CG2 3.97Å; L705-I709 HydrophobicContact CG-CB 4.22Å; L705-I709 HydrophobicContact CG-CG2 4.06Å; P706-I709 HydrophobicContact CB-CG1 4.19Å; P706-I709 PolarHBondContact O-N 3.42Å; L707-I709 VanDerWaalsContact C-N 3.33Å; L707-I709 PolarHBondContact O-N 3.48Å; I709-Q711 VanDerWaalsContact C-N 3.29Å; I709-Q711 PolarHBondContact O-N 3.47Å; I709-I712 PolarHBondContact O-N 3.03Å; I709-I713 HydrophobicContact CG2-CD1 3.87Å; I709-I713 HydrophobicContact CG2-CG1 4.39Å; I709-I713 WeakPolarHBondContact O-CG1 3.22Å; I709-I713 PolarHBondContact O-N 3.33Å; I709-L756 HydrophobicContact CD1-CD2 4.3Å; I709-L756 HydrophobicContact CG2-CD2 4Å; I709-A759 HydrophobicContact CD1-CB 3.37Å; I709-F760 HydrophobicContact CB-CE1 4.47Å; I709-F760 HydrophobicContact CD1-CD1 3.71Å; I709-F760 HydrophobicContact CD1-CD2 4.06Å; I709-F760 HydrophobicContact CD1-CE1 3.79Å; I709-F760 HydrophobicContact CD1-CE2 4.11Å; I709-F760 HydrophobicContact CD1-CG 3.86Å; I709-F760 HydrophobicContact CD1-CZ 3.99Å; I709-F760 HydrophobicContact CG1-CD1 3.94Å; I709-F760 HydrophobicContact CG1-CE1 3.71Å; I709-F760 HydrophobicContact CG1-CZ 4.16Å; I709-F760 HydrophobicContact CG2-CE1 4.06Å; I709-F760 HydrophobicContact CG2-CE2 4.4Å; I709-F760 HydrophobicContact CG2-CZ 3.74Å; I709-M786 HydrophobicContact CG2-SD 4.43Å
710	Q	90.6	Very high	87	Confident	29 Å²	29	42.3 Å²	42.3	14%	0.136	20%	0.202	C	C	.	.	H	α-helix	trans	-57.4	-43.6	175.2	-66.4	-177.7	50.5	0	0	111.3	L705 P706 L707 E708 I712 I713 E714 L784	L705-Q710 HydrophobicContact CB-CG 4.18Å; L705-Q710 HydrophobicContact CD2-CG 3.95Å; L705-Q710 HydrophobicContact CG-CG 4.2Å; L705-Q710 PolarHBondContact O-NE2 3.45Å; P706-Q710 PolarHBondContact O-N 2.87Å; P706-Q710 VanDerWaalsContact O-N 3.09Å; L707-Q710 WeakPolarHBondContact O-CB 3.42Å; L707-Q710 PolarHBondContact O-N 2.93Å; E708-Q710 PolarHBondContact O-N 3.43Å; Q710-I712 PolarHBondContact O-N 3.44Å; Q710-I713 PolarHBondContact O-N 2.8Å; Q710-E714 WeakPolarHBondContact O-CB 3.45Å; Q710-E714 PolarHBondContact O-N 3.39Å; Q710-L784 HydrophobicContact CB-CD2 4.35Å; Q710-L784 WeakPolarHBondContact O-CD2 3.48Å
711	Q	88.5	Confident	86	Confident	83 Å²	83	44.2 Å²	44.2	39%	0.388	21%	0.212	S	C	.	.	H	α-helix	trans	-63.8	-40.7	178.9	-69.3	174.5	3.7	0	0	112.4	L707 E708 I709 E714 R715	L707-Q711 WeakPolarHBondContact O-CG 3.27Å; L707-Q711 PolarHBondContact O-N 2.71Å; E708-Q711 PolarHBondContact O-N 2.71Å; I709-Q711 VanDerWaalsContact C-N 3.29Å; I709-Q711 PolarHBondContact O-N 3.47Å; Q711-E714 PolarHBondContact O-N 3.42Å; Q711-R715 VanDerWaalsContact O-CG 3.26Å; Q711-R715 WeakPolarHBondContact O-CG 3.31Å; Q711-R715 PolarHBondContact O-N 2.59Å
712	I	88.6	Confident	84.9	Confident	5 Å²	5	44.2 Å²	44.2	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-63.2	-45.7	177.3	-64.4	163.6	0	0	0	110.7	E708 I709 Q710 N716 L752 E755 L756 A759	E708-I712 HydrophobicContact CG-CD1 4.35Å; E708-I712 WeakPolarHBondContact O-CG1 3.29Å; E708-I712 PolarHBondContact O-N 3.29Å; E708-I712 VanDerWaalsContact O-N 3.15Å; I709-I712 PolarHBondContact O-N 3.03Å; Q710-I712 PolarHBondContact O-N 3.44Å; I712-N716 PolarHBondContact O-N 3.47Å; I712-N716 PolarHBondContact O-ND2 2.75Å; I712-L752 HydrophobicContact CG2-CD1 3.67Å; I712-E755 HydrophobicContact CD1-CG 3.98Å; I712-E755 HydrophobicContact CG1-CG 4.19Å; I712-E755 HydrophobicContact CG2-CG 4.17Å; I712-L756 HydrophobicContact CB-CD2 4.25Å; I712-L756 HydrophobicContact CG2-CD2 3.78Å; I712-L756 HydrophobicContact CG2-CG 4.11Å; I712-A759 HydrophobicContact CD1-CB 3.44Å; I712-A759 VanDerWaalsContact CD1-CB 3.44Å
713	I	88.7	Confident	83.8	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-64.1	-41.4	177.4	-65.9	172	0	0	0	110.9	L705 I709 Q710 N716 Q717 L720 L756 F777 L784 M786	L705-I713 HydrophobicContact CD2-CD1 3.87Å; I709-I713 HydrophobicContact CG2-CD1 3.87Å; I709-I713 HydrophobicContact CG2-CG1 4.39Å; I709-I713 WeakPolarHBondContact O-CG1 3.22Å; I709-I713 PolarHBondContact O-N 3.33Å; Q710-I713 PolarHBondContact O-N 2.8Å; I713-N716 CarbonylContact O-C 3.49Å; I713-N716 PolarHBondContact O-N 3.33Å; I713-Q717 PolarHBondContact O-N 2.86Å; I713-L720 HydrophobicContact CB-CD1 4.28Å; I713-L720 HydrophobicContact CG2-CD1 3.59Å; I713-L756 HydrophobicContact CG1-CD2 4.47Å; I713-F777 HydrophobicContact CD1-CD1 4.42Å; I713-F777 HydrophobicContact CD1-CE1 4.02Å; I713-F777 HydrophobicContact CG1-CE1 4.29Å; I713-L784 HydrophobicContact CB-CD2 3.83Å; I713-L784 HydrophobicContact CG2-CD2 3.68Å; I713-M786 HydrophobicContact CD1-CG 4.18Å; I713-M786 HydrophobicContact CD1-SD 3.81Å
714	E	84.6	Confident	82.6	Confident	79 Å²	79	45.1 Å²	45.1	37%	0.369	22%	0.218	S	C	.	.	H	α-helix	trans	-62.4	-47.1	179.2	-169.8	158.2	-150.2	0	0	111.7	Q710 Q711 N716 Q717 L784 R840	Q710-E714 WeakPolarHBondContact O-CB 3.45Å; Q710-E714 PolarHBondContact O-N 3.39Å; Q711-E714 PolarHBondContact O-N 3.42Å; E714-N716 PolarHBondContact O-N 3.4Å; E714-Q717 WeakPolarHBondContact O-CB 3.29Å; E714-Q717 PolarHBondContact O-N 3.19Å; E714-L784 HydrophobicContact CB-CD2 3.94Å; E714-R840 IonicContact OE1-CZ 3.74Å; E714-R840 IonicContact OE1-NH1 2.6Å; E714-R840 IonicContact OE1-NH2 2.68Å; E714-R840 PolarHBondContact OE1-NH2 3.08Å; E714-R840 IonicContact OE2-NH2 2.75Å; E714-R840 PolarHBondContact OE2-NH2 3.12Å
715	R	82.5	Confident	81.2	Confident	176 Å²	176	45.2 Å²	45.2	66%	0.664	22%	0.219	S	C	*	.	H	α-helix	trans	-59.8	-33.5	176.9	-70.9	171.1	-170.5	168.9	4.6	112.7	Q711	Q711-R715 VanDerWaalsContact O-CG 3.26Å; Q711-R715 WeakPolarHBondContact O-CG 3.31Å; Q711-R715 PolarHBondContact O-N 2.59Å
716	N	82.7	Confident	79.5	Confident	29 Å²	29	47.5 Å²	47.5	16%	0.155	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	16	-174.9	-66.9	-73.3	0	0	0	113.7	I712 I713 E714 D718 L719 L720 L752	I712-N716 PolarHBondContact O-N 3.47Å; I712-N716 PolarHBondContact O-ND2 2.75Å; I713-N716 CarbonylContact O-C 3.49Å; I713-N716 PolarHBondContact O-N 3.33Å; E714-N716 PolarHBondContact O-N 3.4Å; N716-D718 VanDerWaalsContact C-N 3.26Å; N716-D718 PolarHBondContact O-N 3.14Å; N716-L719 HydrophobicContact CB-CD1 4.49Å; N716-L719 WeakPolarHBondContact O-CB 3.4Å; N716-L719 PolarHBondContact O-N 3.37Å; N716-L720 PolarHBondContact O-N 2.93Å; N716-L720 VanDerWaalsContact O-N 3.07Å; N716-L752 HydrophobicContact CB-CD1 3.87Å; N716-L752 HydrophobicContact CB-CD2 4.09Å
717	Q	79.1	Confident	78.1	Confident	58 Å²	58	50.2 Å²	50.2	27%	0.271	25%	0.251	S	S	.	.	H	α-helix	trans	-56.7	-37.5	-176.8	-177.3	-179.2	0.7	0	0	112.9	I713 E714 L719 L720 N721 K780 S783	I713-Q717 PolarHBondContact O-N 2.86Å; E714-Q717 WeakPolarHBondContact O-CB 3.29Å; E714-Q717 PolarHBondContact O-N 3.19Å; Q717-L719 VanDerWaalsContact C-N 3.31Å; Q717-L719 PolarHBondContact O-N 3.12Å; Q717-L720 PolarHBondContact O-N 3.34Å; Q717-N721 VanDerWaalsContact O-CB 3.3Å; Q717-N721 WeakPolarHBondContact O-CB 3.34Å; Q717-N721 PolarHBondContact O-N 3.27Å; Q717-N721 PolarHBondContact O-ND2 3.13Å; Q717-N721 VanDerWaalsContact O-ND2 3.1Å; Q717-K780 PolarHBondContact NE2-O 3.3Å; Q717-S783 VanDerWaalsContact CD-OG 3.3Å; Q717-S783 WeakPolarHBondContact CG-OG 3.4Å; Q717-S783 PolarHBondContact NE2-OG 3.49Å
718	D	71.3	Confident	76.8	Confident	100 Å²	100	45.7 Å²	45.7	54%	0.535	23%	0.228	S	C	.	.	H	α-helix	trans	-59.5	-41.1	177.5	-76.7	-18	0	0	0	111.8	K577 N716 M722	K577-D718 IonicContact NZ-OD2 3.41Å; K577-D718 PolarHBondContact NZ-OD2 3.37Å; N716-D718 VanDerWaalsContact C-N 3.26Å; N716-D718 PolarHBondContact O-N 3.14Å; D718-M722 WeakPolarHBondContact O-CG 3.42Å
719	L	75.2	Confident	75.5	Confident	3 Å²	3	51 Å²	51	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-69.4	-49.2	176.3	-70	173.6	0	0	0	111	N716 Q717 N721 M722 R748 F749	N716-L719 HydrophobicContact CB-CD1 4.49Å; N716-L719 WeakPolarHBondContact O-CB 3.4Å; N716-L719 PolarHBondContact O-N 3.37Å; Q717-L719 VanDerWaalsContact C-N 3.31Å; Q717-L719 PolarHBondContact O-N 3.12Å; L719-N721 PolarHBondContact O-N 3.4Å; L719-M722 HydrophobicContact CD2-CE 4.44Å; L719-M722 HydrophobicContact CD2-SD 4.34Å; L719-M722 VanDerWaalsContact O-CB 3.25Å; L719-M722 WeakPolarHBondContact O-CB 3.48Å; L719-M722 WeakPolarHBondContact O-CG 3.42Å; L719-M722 PolarHBondContact O-N 3.13Å; L719-R748 HydrophobicContact CD1-CB 4.04Å; L719-R748 HydrophobicContact CD2-CB 4.41Å; L719-F749 HydrophobicContact CB-CE1 4.35Å; L719-F749 HydrophobicContact CB-CZ 4.25Å; L719-F749 VanDerWaalsContact O-CZ 3.31Å; L719-F749 WeakPolarHBondContact O-CZ 3.47Å
720	L	78.5	Confident	74.1	Confident	11 Å²	11	52 Å²	52	6%	0.058	25%	0.25	C	C	.	.	H	α-helix	trans	-60.1	-33.8	-178.5	-67.2	175.2	0	0	0	112.3	I713 N716 Q717 M722 I723 F749 L752 F777	I713-L720 HydrophobicContact CB-CD1 4.28Å; I713-L720 HydrophobicContact CG2-CD1 3.59Å; N716-L720 PolarHBondContact O-N 2.93Å; N716-L720 VanDerWaalsContact O-N 3.07Å; Q717-L720 PolarHBondContact O-N 3.34Å; L720-M722 PolarHBondContact O-N 3.13Å; L720-I723 HydrophobicContact CD2-CD1 4.21Å; L720-I723 WeakPolarHBondContact O-CB 3.46Å; L720-I723 PolarHBondContact O-N 2.9Å; L720-F749 HydrophobicContact CD2-CE1 4.44Å; L720-L752 HydrophobicContact CD2-CD2 3.81Å; L720-L752 HydrophobicContact CG-CD2 4.26Å; L720-F777 HydrophobicContact CD1-CD1 4.29Å; L720-F777 HydrophobicContact CD1-CE1 4.38Å; L720-F777 HydrophobicContact CD1-CG 4.49Å; L720-F777 HydrophobicContact CD2-CD2 3.8Å; L720-F777 HydrophobicContact CD2-CE1 4.45Å; L720-F777 HydrophobicContact CD2-CE2 3.62Å; L720-F777 HydrophobicContact CD2-CG 4.3Å; L720-F777 HydrophobicContact CD2-CZ 3.97Å
721	N	72.1	Confident	72.5	Confident	39 Å²	39	54.5 Å²	54.5	21%	0.209	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-13.6	176.1	-74.6	-27.5	0	0	0	114.4	Q717 L719 I723	Q717-N721 VanDerWaalsContact O-CB 3.3Å; Q717-N721 WeakPolarHBondContact O-CB 3.34Å; Q717-N721 PolarHBondContact O-N 3.27Å; Q717-N721 PolarHBondContact O-ND2 3.13Å; Q717-N721 VanDerWaalsContact O-ND2 3.1Å; L719-N721 PolarHBondContact O-N 3.4Å; N721-I723 VanDerWaalsContact C-N 3.35Å
722	M	69.7	Low	70.5	Confident	47 Å²	47	55.4 Å²	55.4	23%	0.232	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-20	176	-58.5	180	-179.8	0	0	112.5	D718 L719 L720 D724 L730 K731	D718-M722 WeakPolarHBondContact O-CG 3.42Å; L719-M722 HydrophobicContact CD2-CE 4.44Å; L719-M722 HydrophobicContact CD2-SD 4.34Å; L719-M722 VanDerWaalsContact O-CB 3.25Å; L719-M722 WeakPolarHBondContact O-CB 3.48Å; L719-M722 WeakPolarHBondContact O-CG 3.42Å; L719-M722 PolarHBondContact O-N 3.13Å; L720-M722 PolarHBondContact O-N 3.13Å; M722-D724 PolarHBondContact O-N 3.28Å; M722-L730 HydrophobicContact CB-CD2 4.39Å; M722-K731 PolarHBondContact O-N 3.09Å
723	I	70.7	Confident	68.3	Low	17 Å²	17	60.7 Å²	60.7	9%	0.087	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-72.7	126.7	179.1	-62.4	164.8	0	0	0	108.7	L720 N721 P725 L730 F749 V799 I802	L720-I723 HydrophobicContact CD2-CD1 4.21Å; L720-I723 WeakPolarHBondContact O-CB 3.46Å; L720-I723 PolarHBondContact O-N 2.9Å; N721-I723 VanDerWaalsContact C-N 3.35Å; I723-P725 WeakPolarHBondContact O-CD 3.29Å; I723-L730 HydrophobicContact CG1-CD2 4.41Å; I723-F749 HydrophobicContact CD1-CD1 4.47Å; I723-F749 HydrophobicContact CD1-CE1 3.53Å; I723-F749 HydrophobicContact CD1-CZ 3.85Å; I723-F749 HydrophobicContact CG1-CE1 3.98Å; I723-F749 HydrophobicContact CG1-CZ 3.74Å; I723-V799 HydrophobicContact CD1-CG1 3.66Å; I723-V799 HydrophobicContact CG2-CG1 4.29Å; I723-I802 HydrophobicContact CB-CD1 4.37Å; I723-I802 HydrophobicContact CD1-CD1 4.42Å; I723-I802 HydrophobicContact CG1-CD1 3.83Å; I723-I802 HydrophobicContact CG2-CD1 3.87Å
724	D	66.5	Low	66.1	Low	30 Å²	30	63.3 Å²	63.3	16%	0.16	33%	0.327	C	S	.	.			trans	-71.7	115	166.4	-164.5	-17.6	0	0	0	109.3	M722 C726 T727 N728 R729 K731	M722-D724 PolarHBondContact O-N 3.28Å; D724-C726 PolarHBondContact O-N 3.43Å; D724-C726 VanDerWaalsContact O-N 3.14Å; D724-C726 PolarHBondContact OD1-N 3.26Å; D724-T727 VanDerWaalsContact CB-OG1 3.25Å; D724-T727 WeakPolarHBondContact CB-OG1 3.22Å; D724-T727 PolarHBondContact O-N 3.11Å; D724-T727 PolarHBondContact OD2-OG1 3.14Å; D724-N728 WeakPolarHBondContact O-CA 3.37Å; D724-N728 PolarHBondContact O-N 3.02Å; D724-R729 WeakPolarHBondContact CA-O 3.48Å; D724-R729 WeakPolarHBondContact CB-O 3.49Å; D724-R729 PolarHBondContact N-O 3.2Å; D724-K731 HydrophobicContact CB-CD 4.27Å; D724-K731 HydrophobicContact CB-CG 3.57Å; D724-K731 WeakPolarHBondContact OD1-CE 3.29Å; D724-K731 IonicContact OD1-NZ 3.29Å; D724-K731 VanDerWaalsContact OD2-CE 3.29Å; D724-K731 WeakPolarHBondContact OD2-CE 3.26Å
725	P	62.6	Low	64.3	Low	33 Å²	33	60.8 Å²	60.8	21%	0.214	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-21	178.5	26.9	-36.9	0	0	0	113.3	I723 V822 H826	I723-P725 WeakPolarHBondContact O-CD 3.29Å; P725-V822 HydrophobicContact CB-CG1 3.88Å; P725-H826 WeakPolarHBondContact CB-CE1 3.39Å
726	C	57.8	Low	62.2	Low	53 Å²	53	53 Å²	53	36%	0.358	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-37	-176.5	-62.2	0	0	0	0	113.1	D724	D724-C726 PolarHBondContact O-N 3.43Å; D724-C726 VanDerWaalsContact O-N 3.14Å; D724-C726 PolarHBondContact OD1-N 3.26Å
727	T	60.4	Low	60	Low	75 Å²	75	52.5 Å²	52.5	46%	0.46	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-7.7	-172.4	56.5	0	0	0	0	113.4	D724 R729	D724-T727 VanDerWaalsContact CB-OG1 3.25Å; D724-T727 WeakPolarHBondContact CB-OG1 3.22Å; D724-T727 PolarHBondContact O-N 3.11Å; D724-T727 PolarHBondContact OD2-OG1 3.14Å; T727-R729 PolarHBondContact O-N 3.48Å; T727-R729 WeakPolarHBondContact OG1-CB 3.38Å; T727-R729 PolarHBondContact OG1-N 3.32Å
728	N	61.6	Low	58	Low	21 Å²	21	57 Å²	57	11%	0.112	31%	0.307	C	S	.	.	S	Bend	trans	44.3	39.8	-162.1	-68.3	5.4	0	0	0	110.2	D724 R796 S798 I802	D724-N728 WeakPolarHBondContact O-CA 3.37Å; D724-N728 PolarHBondContact O-N 3.02Å; N728-R796 PolarHBondContact ND2-NH1 2.85Å; N728-R796 PolarHBondContact ND2-NH2 2.99Å; N728-R796 PolarHBondContact OD1-NH2 3.03Å; N728-S798 PolarHBondContact ND2-O 3.2Å; N728-I802 WeakPolarHBondContact O-CG1 3.49Å
729	R	62	Low	56.7	Low	183 Å²	183	54.2 Å²	54.2	69%	0.691	30%	0.302	S	S	*	.	S	Bend	trans	-117.2	151	172.8	-66.3	-174.9	175.1	-169.9	-2.9	108.1	D724 T727 K731	D724-R729 WeakPolarHBondContact CA-O 3.48Å; D724-R729 WeakPolarHBondContact CB-O 3.49Å; D724-R729 PolarHBondContact N-O 3.2Å; T727-R729 PolarHBondContact O-N 3.48Å; T727-R729 WeakPolarHBondContact OG1-CB 3.38Å; T727-R729 PolarHBondContact OG1-N 3.32Å; R729-K731 PolarHBondContact O-N 2.72Å
730	L	62.4	Low	55.3	Low	21 Å²	21	55 Å²	55	11%	0.11	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-66	125.6	171.5	-60.1	165.6	0	0	0	107.5	M722 I723 V732 F735 V745 F749 I802	M722-L730 HydrophobicContact CB-CD2 4.39Å; I723-L730 HydrophobicContact CG1-CD2 4.41Å; L730-V732 VanDerWaalsContact C-N 3.33Å; L730-V732 PolarHBondContact O-N 3Å; L730-F735 HydrophobicContact CB-CE2 3.51Å; L730-F735 HydrophobicContact CB-CZ 3.48Å; L730-F735 VanDerWaalsContact CB-CZ 3.48Å; L730-F735 HydrophobicContact CD1-CZ 3.88Å; L730-F735 HydrophobicContact CG-CZ 4.17Å; L730-V745 HydrophobicContact CD1-CG1 4.02Å; L730-V745 HydrophobicContact CD2-CG1 4.37Å; L730-F749 HydrophobicContact CD2-CD2 4.39Å; L730-F749 HydrophobicContact CD2-CE2 3.54Å; L730-F749 HydrophobicContact CD2-CZ 4.05Å; L730-I802 HydrophobicContact CD1-CG2 3.71Å; L730-I802 HydrophobicContact CD2-CD1 4.34Å; L730-I802 HydrophobicContact CD2-CG2 4.08Å; L730-I802 HydrophobicContact CG-CG2 3.61Å
731	K	56	Low	54.1	Low	82 Å²	82	58.2 Å²	58.2	36%	0.357	32%	0.324	S	S	.	.			trans	-65.8	96.5	175.7	-76.5	-169.3	174.5	176.2	0	108.2	M722 D724 R729 S733 S734 F735	M722-K731 PolarHBondContact O-N 3.09Å; D724-K731 HydrophobicContact CB-CD 4.27Å; D724-K731 HydrophobicContact CB-CG 3.57Å; D724-K731 WeakPolarHBondContact OD1-CE 3.29Å; D724-K731 IonicContact OD1-NZ 3.29Å; D724-K731 VanDerWaalsContact OD2-CE 3.29Å; D724-K731 WeakPolarHBondContact OD2-CE 3.26Å; R729-K731 PolarHBondContact O-N 2.72Å; K731-S733 PolarHBondContact O-N 3.46Å; K731-S734 WeakPolarHBondContact CB-OG 3.43Å; K731-S734 WeakPolarHBondContact O-CA 3.42Å; K731-S734 PolarHBondContact O-N 3.22Å; K731-S734 PolarHBondContact O-OG 3.39Å; K731-F735 WeakPolarHBondContact O-CD2 3.42Å; K731-F735 WeakPolarHBondContact O-CE2 3.36Å; K731-F735 PolarHBondContact O-N 3.32Å
732	V	46.7	Very low	53.3	Low	102 Å²	102	59.6 Å²	59.6	62%	0.618	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-51.3	-32.2	177.7	-174.2	0	0	0	0	111.1	L730 S734 F735	L730-V732 VanDerWaalsContact C-N 3.33Å; L730-V732 PolarHBondContact O-N 3Å; V732-S734 VanDerWaalsContact C-N 3.32Å; V732-S734 PolarHBondContact O-N 3.05Å; V732-F735 HydrophobicContact CB-CD2 4.46Å; V732-F735 WeakPolarHBondContact O-CB 3.37Å; V732-F735 WeakPolarHBondContact O-CD2 3.38Å; V732-F735 PolarHBondContact O-N 2.9Å; V732-F735 VanDerWaalsContact O-N 3.16Å
733	S	43.1	Very low	52.8	Low	116 Å²	116	61.1 Å²	61.1	81%	0.811	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-72	-17.7	176.7	67.3	0	0	0	0	115.6	K731	K731-S733 PolarHBondContact O-N 3.46Å
734	S	43.2	Very low	52.3	Low	55 Å²	55	63.2 Å²	63.2	39%	0.385	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-93.4	-5.3	172.6	65.8	0	0	0	0	112.6	K731 V732	K731-S734 WeakPolarHBondContact CB-OG 3.43Å; K731-S734 WeakPolarHBondContact O-CA 3.42Å; K731-S734 PolarHBondContact O-N 3.22Å; K731-S734 PolarHBondContact O-OG 3.39Å; V732-S734 VanDerWaalsContact C-N 3.32Å; V732-S734 PolarHBondContact O-N 3.05Å
735	F	46.3	Very low	52.3	Low	26 Å²	26	62.2 Å²	62.2	11%	0.114	35%	0.353	C	S	.	.	S	Bend	trans	-71.3	138.8	167.4	-69.5	-102.6	0	0	0	108.2	L730 K731 V732 S737 V745	L730-F735 HydrophobicContact CB-CE2 3.51Å; L730-F735 HydrophobicContact CB-CZ 3.48Å; L730-F735 VanDerWaalsContact CB-CZ 3.48Å; L730-F735 HydrophobicContact CD1-CZ 3.88Å; L730-F735 HydrophobicContact CG-CZ 4.17Å; K731-F735 WeakPolarHBondContact O-CD2 3.42Å; K731-F735 WeakPolarHBondContact O-CE2 3.36Å; K731-F735 PolarHBondContact O-N 3.32Å; V732-F735 HydrophobicContact CB-CD2 4.46Å; V732-F735 WeakPolarHBondContact O-CB 3.37Å; V732-F735 WeakPolarHBondContact O-CD2 3.38Å; V732-F735 PolarHBondContact O-N 2.9Å; V732-F735 VanDerWaalsContact O-N 3.16Å; F735-S737 PolarHBondContact O-N 2.8Å; F735-V745 HydrophobicContact CE1-CG2 4.13Å
736	P	38.3	Very low	52.5	Low	13 Å²	13	63.5 Å²	63.5	8%	0.084	35%	0.353	C	S	.	.	S	Bend	trans	-69.1	87.9	159.1	26.9	-19.2	0	0	0	108	S416 S510 N512	S416-P736 VanDerWaalsContact CB-CG 3.47Å; S510-P736 VanDerWaalsContact C-CB 3.48Å; S510-P736 CarbonylContact O-C 3.59Å; S510-P736 WeakPolarHBondContact O-CA 3.17Å; S510-P736 WeakPolarHBondContact O-CB 3.35Å; N512-P736 PolarHBondContact ND2-O 2.83Å
737	S	37.2	Very low	53.2	Low	18 Å²	18	65.2 Å²	65.2	13%	0.126	36%	0.356	C	S	.	.	S	Bend	trans	60.5	151.2	173.5	55.4	0	0	0	0	118.3	S510 N512 T514 F735 G739	S510-S737 PolarHBondContact O-N 3.3Å; S510-S737 PolarHBondContact O-OG 2.84Å; N512-S737 WeakPolarHBondContact CB-OG 3.48Å; N512-S737 PolarHBondContact N-OG 3.46Å; T514-S737 WeakPolarHBondContact OG1-CB 3.5Å; T514-S737 PolarHBondContact OG1-OG 2.93Å; F735-S737 PolarHBondContact O-N 2.8Å; S737-G739 PolarHBondContact O-N 2.7Å; S737-G739 VanDerWaalsContact O-N 3.07Å
738	E	37.3	Very low	53.8	Low	152 Å²	152	66.6 Å²	66.6	71%	0.71	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	107.7	165.9	-66.7	176.3	156.2	0	0	108.9	T514	T514-E738 PolarHBondContact OG1-O 2.96Å
739	G	42.5	Very low	54.6	Low	42 Å²	42	65.8 Å²	65.8	43%	0.433	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	150.8	-16.9	-174.2	0	0	0	0	0	114.5	S737 D741	S737-G739 PolarHBondContact O-N 2.7Å; S737-G739 VanDerWaalsContact O-N 3.07Å; G739-D741 PolarHBondContact O-N 2.99Å
740	T	46.9	Very low	55.4	Low	20 Å²	20	59.1 Å²	59.1	12%	0.123	33%	0.33	C	S	.	.	S	Bend	trans	-70.4	111.3	162.6	-41.7	0	0	0	0	107.5	N512 V742 V745	N512-T740 PolarHBondContact ND2-OG1 3.16Å; T740-V742 PolarHBondContact O-N 3.38Å; T740-V745 HydrophobicContact CG2-CG2 3.81Å
741	D	52.7	Low	56.3	Low	77 Å²	77	62.2 Å²	62.2	41%	0.412	35%	0.346	S	S	.	.			trans	-56.8	113.1	-178.8	-164.3	-4.2	0	0	0	108.6	L422 G739 C743 Q744 V745	L422-D741 HydrophobicContact CD2-CB 3.73Å; G739-D741 PolarHBondContact O-N 2.99Å; D741-C743 PolarHBondContact O-N 3.09Å; D741-C743 WeakPolarHBondContact OD1-CB 3.47Å; D741-C743 PolarHBondContact OD1-N 2.89Å; D741-C743 PolarHBondContact OD1-SG 2.76Å; D741-C743 VanDerWaalsContact OD1-SG 3.37Å; D741-Q744 HydrophobicContact CB-CG 4.27Å; D741-Q744 PolarHBondContact O-N 2.88Å; D741-V745 PolarHBondContact O-N 2.72Å
742	V	56	Low	57.7	Low	68 Å²	68	58.5 Å²	58.5	41%	0.412	33%	0.33	S	S	.	.	H	α-helix	trans	-52	-31.2	-179.7	175.6	0	0	0	0	109.4	T740 Q744 V745 R746	T740-V742 PolarHBondContact O-N 3.38Å; V742-Q744 PolarHBondContact O-N 3.03Å; V742-V745 PolarHBondContact O-N 2.72Å; V742-R746 HydrophobicContact CG1-CG 4.15Å; V742-R746 VanDerWaalsContact O-CB 3.27Å; V742-R746 WeakPolarHBondContact O-CB 3.44Å; V742-R746 WeakPolarHBondContact O-CG 3.21Å; V742-R746 PolarHBondContact O-N 2.95Å
743	C	58.1	Low	59.5	Low	79 Å²	79	54.8 Å²	54.8	53%	0.534	31%	0.307	S	S	.	.	H	α-helix	trans	-56.6	-42.2	173	-59.3	0	0	0	0	113.7	D741 H747	D741-C743 PolarHBondContact O-N 3.09Å; D741-C743 WeakPolarHBondContact OD1-CB 3.47Å; D741-C743 PolarHBondContact OD1-N 2.89Å; D741-C743 PolarHBondContact OD1-SG 2.76Å; D741-C743 VanDerWaalsContact OD1-SG 3.37Å; C743-H747 VanDerWaalsContact O-CB 3.31Å; C743-H747 WeakPolarHBondContact O-CB 3.49Å; C743-H747 PolarHBondContact O-N 2.8Å
744	Q	61.7	Low	61.6	Low	61 Å²	61	53 Å²	53	29%	0.285	29%	0.288	S	S	.	.	H	α-helix	trans	-74.3	-39.4	-179	-70.2	-160.5	17.8	0	0	112.7	S418 L422 D741 V742 R746 H747 R748	S418-Q744 PolarHBondContact OG-OE1 2.98Å; L422-Q744 HydrophobicContact CD1-CG 4.48Å; L422-Q744 HydrophobicContact CD2-CG 4.27Å; L422-Q744 VanDerWaalsContact CG-NE2 3.28Å; D741-Q744 HydrophobicContact CB-CG 4.27Å; D741-Q744 PolarHBondContact O-N 2.88Å; V742-Q744 PolarHBondContact O-N 3.03Å; Q744-R746 VanDerWaalsContact C-N 3.34Å; Q744-H747 PolarHBondContact O-N 3.1Å; Q744-R748 WeakPolarHBondContact O-CG 3.11Å; Q744-R748 PolarHBondContact O-N 3.04Å
745	V	64.7	Low	63.7	Low	10 Å²	10	53.6 Å²	53.6	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-64.5	-44.5	174.4	175.6	0	0	0	0	109.4	L730 F735 T740 D741 V742 H747 R748 F749	L730-V745 HydrophobicContact CD1-CG1 4.02Å; L730-V745 HydrophobicContact CD2-CG1 4.37Å; F735-V745 HydrophobicContact CE1-CG2 4.13Å; T740-V745 HydrophobicContact CG2-CG2 3.81Å; D741-V745 PolarHBondContact O-N 2.72Å; V742-V745 PolarHBondContact O-N 2.72Å; V745-H747 VanDerWaalsContact C-N 3.34Å; V745-H747 PolarHBondContact O-N 3.46Å; V745-R748 PolarHBondContact O-N 2.76Å; V745-F749 HydrophobicContact CG1-CD2 3.69Å; V745-F749 HydrophobicContact CG1-CE2 3.53Å; V745-F749 WeakPolarHBondContact O-CD2 3.47Å; V745-F749 PolarHBondContact O-N 3.02Å
746	R	68.6	Low	65.6	Low	60 Å²	60	52.5 Å²	52.5	23%	0.226	28%	0.28	C	S	.	.	H	α-helix	trans	-57.2	-44.5	171.6	-76.4	-178.9	168.6	170.5	-4.4	112	V742 Q744 R748 F749 S750 I802 L803 E805	V742-R746 HydrophobicContact CG1-CG 4.15Å; V742-R746 VanDerWaalsContact O-CB 3.27Å; V742-R746 WeakPolarHBondContact O-CB 3.44Å; V742-R746 WeakPolarHBondContact O-CG 3.21Å; V742-R746 PolarHBondContact O-N 2.95Å; Q744-R746 VanDerWaalsContact C-N 3.34Å; R746-R748 PolarHBondContact O-N 2.7Å; R746-F749 PolarHBondContact O-N 3.27Å; R746-S750 PolarHBondContact O-N 3.22Å; R746-I802 PolarHBondContact NE-O 2.83Å; R746-L803 HydrophobicContact CB-CD2 3.74Å; R746-L803 HydrophobicContact CG-CD2 3.93Å; R746-L803 VanDerWaalsContact O-CD2 3.24Å; R746-L803 WeakPolarHBondContact O-CD2 3.12Å; R746-E805 IonicContact CZ-OE1 2.86Å; R746-E805 IonicContact NH1-OE1 3.82Å; R746-E805 PolarHBondContact NH1-OE1 3.28Å; R746-E805 IonicContact NH2-OE1 3.73Å
747	H	71.3	Confident	68	Low	88 Å²	88	54.6 Å²	54.6	41%	0.407	29%	0.288	S	S	.	.	H	α-helix	trans	-61.3	-44.8	177.3	-177.9	68.8	0	0	0	112.1	C743 Q744 V745 F749 S750 L751	C743-H747 VanDerWaalsContact O-CB 3.31Å; C743-H747 WeakPolarHBondContact O-CB 3.49Å; C743-H747 PolarHBondContact O-N 2.8Å; Q744-H747 PolarHBondContact O-N 3.1Å; V745-H747 VanDerWaalsContact C-N 3.34Å; V745-H747 PolarHBondContact O-N 3.46Å; H747-F749 VanDerWaalsContact C-N 3.34Å; H747-F749 PolarHBondContact O-N 3.34Å; H747-S750 WeakPolarHBondContact O-CA 3.44Å; H747-S750 WeakPolarHBondContact O-CB 3.42Å; H747-S750 PolarHBondContact O-N 3.36Å; H747-S750 VanDerWaalsContact O-N 3.09Å; H747-L751 WeakPolarHBondContact O-CG 3.25Å; H747-L751 PolarHBondContact O-N 2.87Å
748	R	72.4	Confident	70.5	Confident	105 Å²	105	59.2 Å²	59.2	40%	0.396	31%	0.307	S	S	.	.	H	α-helix	trans	-62.9	-39.4	175.4	-70.2	-178.9	71.3	-174.9	-0.5	112.4	L719 Q744 V745 R746 S750 L751 L752	L719-R748 HydrophobicContact CD1-CB 4.04Å; L719-R748 HydrophobicContact CD2-CB 4.41Å; Q744-R748 WeakPolarHBondContact O-CG 3.11Å; Q744-R748 PolarHBondContact O-N 3.04Å; V745-R748 PolarHBondContact O-N 2.76Å; R746-R748 PolarHBondContact O-N 2.7Å; R748-S750 VanDerWaalsContact C-N 3.32Å; R748-L751 PolarHBondContact O-N 2.98Å; R748-L752 WeakPolarHBondContact O-CB 3.31Å; R748-L752 PolarHBondContact O-N 3.29Å
749	F	78.8	Confident	73	Confident	3 Å²	3	52 Å²	52	1%	0.013	27%	0.273	C	S	.	.	H	α-helix	trans	-64.5	-36.1	172.1	-84.2	-66.4	0	0	0	112.4	L719 L720 I723 L730 V745 R746 H747 L752 L753 F800 L803	L719-F749 HydrophobicContact CB-CE1 4.35Å; L719-F749 HydrophobicContact CB-CZ 4.25Å; L719-F749 VanDerWaalsContact O-CZ 3.31Å; L719-F749 WeakPolarHBondContact O-CZ 3.47Å; L720-F749 HydrophobicContact CD2-CE1 4.44Å; I723-F749 HydrophobicContact CD1-CD1 4.47Å; I723-F749 HydrophobicContact CD1-CE1 3.53Å; I723-F749 HydrophobicContact CD1-CZ 3.85Å; I723-F749 HydrophobicContact CG1-CE1 3.98Å; I723-F749 HydrophobicContact CG1-CZ 3.74Å; L730-F749 HydrophobicContact CD2-CD2 4.39Å; L730-F749 HydrophobicContact CD2-CE2 3.54Å; L730-F749 HydrophobicContact CD2-CZ 4.05Å; V745-F749 HydrophobicContact CG1-CD2 3.69Å; V745-F749 HydrophobicContact CG1-CE2 3.53Å; V745-F749 WeakPolarHBondContact O-CD2 3.47Å; V745-F749 PolarHBondContact O-N 3.02Å; R746-F749 PolarHBondContact O-N 3.27Å; H747-F749 VanDerWaalsContact C-N 3.34Å; H747-F749 PolarHBondContact O-N 3.34Å; F749-L752 HydrophobicContact CD1-CD2 4.33Å; F749-L752 PolarHBondContact O-N 3.23Å; F749-L753 WeakPolarHBondContact O-CB 3.19Å; F749-L753 PolarHBondContact O-N 2.94Å; F749-F800 HydrophobicContact CD1-CD1 4.44Å; F749-F800 HydrophobicContact CD1-CE1 4.25Å; F749-L803 HydrophobicContact CB-CD2 3.92Å
750	S	78.5	Confident	75.2	Confident	44 Å²	44	50 Å²	50	31%	0.308	25%	0.253	S	S	.	.	H	α-helix	trans	-65.6	-41.5	174.3	-173.5	0	0	0	0	112.1	R746 H747 R748 L753 N754	R746-S750 PolarHBondContact O-N 3.22Å; H747-S750 WeakPolarHBondContact O-CA 3.44Å; H747-S750 WeakPolarHBondContact O-CB 3.42Å; H747-S750 PolarHBondContact O-N 3.36Å; H747-S750 VanDerWaalsContact O-N 3.09Å; R748-S750 VanDerWaalsContact C-N 3.32Å; S750-L753 PolarHBondContact O-N 3.37Å; S750-N754 VanDerWaalsContact O-CG 3.27Å; S750-N754 PolarHBondContact O-N 3.07Å; S750-N754 PolarHBondContact O-ND2 3.02Å
751	L	82.7	Confident	77.2	Confident	86 Å²	86	54.6 Å²	54.6	45%	0.45	27%	0.274	S	S	.	.	H	α-helix	trans	-63.2	-46.3	174.8	-69.5	175.6	0	0	0	111.1	H747 R748 L753 N754 E755	H747-L751 WeakPolarHBondContact O-CG 3.25Å; H747-L751 PolarHBondContact O-N 2.87Å; R748-L751 PolarHBondContact O-N 2.98Å; L751-L753 VanDerWaalsContact C-N 3.32Å; L751-L753 PolarHBondContact O-N 3.47Å; L751-N754 PolarHBondContact O-N 3.3Å; L751-E755 PolarHBondContact O-N 3.05Å
752	L	84.6	Confident	78.9	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-58.7	-43.8	175.1	174.7	61.3	0	0	0	111.8	I712 N716 L720 R748 F749 N754 E755 L756 F800	I712-L752 HydrophobicContact CG2-CD1 3.67Å; N716-L752 HydrophobicContact CB-CD1 3.87Å; N716-L752 HydrophobicContact CB-CD2 4.09Å; L720-L752 HydrophobicContact CD2-CD2 3.81Å; L720-L752 HydrophobicContact CG-CD2 4.26Å; R748-L752 WeakPolarHBondContact O-CB 3.31Å; R748-L752 PolarHBondContact O-N 3.29Å; F749-L752 HydrophobicContact CD1-CD2 4.33Å; F749-L752 PolarHBondContact O-N 3.23Å; L752-N754 VanDerWaalsContact C-N 3.33Å; L752-N754 PolarHBondContact O-N 2.92Å; L752-E755 PolarHBondContact O-N 3.22Å; L752-L756 HydrophobicContact CD1-CD1 4.17Å; L752-L756 HydrophobicContact CD1-CG 4.21Å; L752-L756 HydrophobicContact CG-CD1 4.15Å; L752-L756 WeakPolarHBondContact O-CB 2.92Å; L752-L756 WeakPolarHBondContact O-CG 3.37Å; L752-L756 PolarHBondContact O-N 3.05Å; L752-F800 HydrophobicContact CD2-CE1 4.47Å
753	L	85.5	Confident	80.4	Confident	25 Å²	25	56.9 Å²	56.9	13%	0.131	27%	0.272	C	S	.	.	H	α-helix	trans	-62	-42.6	177.9	179.8	60	0	0	0	111.1	F749 S750 L751 L756 K757 E771 F800 L803	F749-L753 WeakPolarHBondContact O-CB 3.19Å; F749-L753 PolarHBondContact O-N 2.94Å; S750-L753 PolarHBondContact O-N 3.37Å; L751-L753 VanDerWaalsContact C-N 3.32Å; L751-L753 PolarHBondContact O-N 3.47Å; L753-L756 PolarHBondContact O-N 2.79Å; L753-K757 HydrophobicContact CG-CD 4.45Å; L753-K757 WeakPolarHBondContact O-CB 3.49Å; L753-K757 VanDerWaalsContact O-CG 3.29Å; L753-K757 WeakPolarHBondContact O-CG 3.27Å; L753-K757 PolarHBondContact O-N 2.94Å; L753-E771 HydrophobicContact CD1-CB 4.07Å; L753-E771 HydrophobicContact CD1-CG 4.17Å; L753-F800 HydrophobicContact CB-CD1 4.37Å; L753-F800 HydrophobicContact CB-CE1 4.49Å; L753-F800 HydrophobicContact CD1-CD1 4.43Å; L753-F800 HydrophobicContact CD1-CD2 3.69Å; L753-F800 HydrophobicContact CD1-CE2 3.9Å; L753-F800 HydrophobicContact CD1-CG 3.97Å; L753-F800 HydrophobicContact CD1-CZ 4.37Å; L753-F800 HydrophobicContact CD2-CB 4.17Å; L753-F800 HydrophobicContact CD2-CG 4.36Å; L753-L803 HydrophobicContact CD2-CD1 4.26Å
754	N	85.6	Confident	81.6	Confident	77 Å²	77	58.6 Å²	58.6	41%	0.412	28%	0.276	S	S	.	.	H	α-helix	trans	-64.8	-43.6	176.6	-69.9	-16.1	0	0	0	112	S750 L751 L752 L756 K757 E758	S750-N754 VanDerWaalsContact O-CG 3.27Å; S750-N754 PolarHBondContact O-N 3.07Å; S750-N754 PolarHBondContact O-ND2 3.02Å; L751-N754 PolarHBondContact O-N 3.3Å; L752-N754 VanDerWaalsContact C-N 3.33Å; L752-N754 PolarHBondContact O-N 2.92Å; N754-L756 VanDerWaalsContact C-N 3.33Å; N754-L756 PolarHBondContact O-N 3.17Å; N754-K757 WeakPolarHBondContact O-CB 3.38Å; N754-K757 PolarHBondContact O-N 3.25Å; N754-E758 WeakPolarHBondContact O-CG 3.5Å; N754-E758 PolarHBondContact O-N 3.44Å
755	E	87.6	Confident	82.5	Confident	69 Å²	69	60.8 Å²	60.8	32%	0.322	30%	0.298	S	S	.	.	H	α-helix	trans	-61	-42.6	176.5	-167.2	-176.9	-176.3	0	0	111.2	I712 L751 L752 A759	I712-E755 HydrophobicContact CD1-CG 3.98Å; I712-E755 HydrophobicContact CG1-CG 4.19Å; I712-E755 HydrophobicContact CG2-CG 4.17Å; L751-E755 PolarHBondContact O-N 3.05Å; L752-E755 PolarHBondContact O-N 3.22Å; E755-A759 VanDerWaalsContact O-CB 3.28Å; E755-A759 WeakPolarHBondContact O-CB 3.44Å; E755-A759 PolarHBondContact O-N 3.14Å
756	L	87.7	Confident	83.5	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-64.7	-42.5	174.6	-73.8	173.4	0	0	0	112.2	I709 I712 I713 L752 L753 N754 A759 F760 F800	I709-L756 HydrophobicContact CD1-CD2 4.3Å; I709-L756 HydrophobicContact CG2-CD2 4Å; I712-L756 HydrophobicContact CB-CD2 4.25Å; I712-L756 HydrophobicContact CG2-CD2 3.78Å; I712-L756 HydrophobicContact CG2-CG 4.11Å; I713-L756 HydrophobicContact CG1-CD2 4.47Å; L752-L756 HydrophobicContact CD1-CD1 4.17Å; L752-L756 HydrophobicContact CD1-CG 4.21Å; L752-L756 HydrophobicContact CG-CD1 4.15Å; L752-L756 WeakPolarHBondContact O-CB 2.92Å; L752-L756 WeakPolarHBondContact O-CG 3.37Å; L752-L756 PolarHBondContact O-N 3.05Å; L753-L756 PolarHBondContact O-N 2.79Å; N754-L756 VanDerWaalsContact C-N 3.33Å; N754-L756 PolarHBondContact O-N 3.17Å; L756-A759 PolarHBondContact O-N 2.84Å; L756-F760 HydrophobicContact CB-CD2 4.35Å; L756-F760 HydrophobicContact CB-CE2 4.32Å; L756-F760 HydrophobicContact CD2-CE2 4.36Å; L756-F760 WeakPolarHBondContact O-CB 3.34Å; L756-F760 WeakPolarHBondContact O-CD2 3.5Å; L756-F760 PolarHBondContact O-N 3.09Å; L756-F800 HydrophobicContact CD1-CE2 4.46Å; L756-F800 HydrophobicContact CD1-CZ 3.89Å
757	K	88.3	Confident	84.3	Confident	57 Å²	57	62.3 Å²	62.3	25%	0.248	31%	0.308	C	S	.	.	H	α-helix	trans	-55.3	-52.8	175.8	-81.9	-177.4	171.1	-164.8	0	111.3	L753 N754 A759 F760 M761 E771 E772	L753-K757 HydrophobicContact CG-CD 4.45Å; L753-K757 WeakPolarHBondContact O-CB 3.49Å; L753-K757 VanDerWaalsContact O-CG 3.29Å; L753-K757 WeakPolarHBondContact O-CG 3.27Å; L753-K757 PolarHBondContact O-N 2.94Å; N754-K757 WeakPolarHBondContact O-CB 3.38Å; N754-K757 PolarHBondContact O-N 3.25Å; K757-A759 VanDerWaalsContact C-N 3.34Å; K757-A759 PolarHBondContact O-N 3.44Å; K757-F760 PolarHBondContact O-N 3.39Å; K757-M761 WeakPolarHBondContact O-CG 3.24Å; K757-M761 PolarHBondContact O-N 2.91Å; K757-E771 HydrophobicContact CD-CG 4.18Å; K757-E771 VanDerWaalsContact CE-CG 3.49Å; K757-E771 WeakPolarHBondContact CE-OE1 3.4Å; K757-E771 HydrophobicContact CG-CB 4.35Å; K757-E771 HydrophobicContact CG-CG 3.48Å; K757-E771 VanDerWaalsContact CG-CG 3.48Å; K757-E771 WeakPolarHBondContact CG-OE1 3.47Å; K757-E772 IonicContact NZ-OE1 3.67Å
758	E	89.5	Confident	85	Confident	115 Å²	115	63 Å²	63	54%	0.537	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-42.9	179.7	-69.6	-178.7	-172.1	0	0	112	N754 M761 R762	N754-E758 WeakPolarHBondContact O-CG 3.5Å; N754-E758 PolarHBondContact O-N 3.44Å; E758-M761 PolarHBondContact O-N 2.97Å; E758-R762 WeakPolarHBondContact O-CG 3.36Å; E758-R762 PolarHBondContact O-N 3.27Å; E758-R762 PolarHBondContact O-NE 2.77Å; E758-R762 IonicContact OE2-NH2 3.42Å
759	A	89.1	Confident	85.5	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.6	-41.2	179.8	0	0	0	0	0	111.8	E708 I709 I712 E755 L756 K757 R762 Q763	E708-A759 HydrophobicContact CG-CB 4.28Å; I709-A759 HydrophobicContact CD1-CB 3.37Å; I712-A759 HydrophobicContact CD1-CB 3.44Å; I712-A759 VanDerWaalsContact CD1-CB 3.44Å; E755-A759 VanDerWaalsContact O-CB 3.28Å; E755-A759 WeakPolarHBondContact O-CB 3.44Å; E755-A759 PolarHBondContact O-N 3.14Å; L756-A759 PolarHBondContact O-N 2.84Å; K757-A759 VanDerWaalsContact C-N 3.34Å; K757-A759 PolarHBondContact O-N 3.44Å; A759-R762 PolarHBondContact O-N 2.97Å; A759-Q763 WeakPolarHBondContact O-CG 3.34Å
760	F	90.1	Very high	85.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-67.8	-37.7	175.8	-79.1	-56.5	0	0	0	112.9	L705 I709 L756 K757 R762 Q763 W767 I770 E771 M786	L705-F760 HydrophobicContact CD1-CE1 4.46Å; I709-F760 HydrophobicContact CB-CE1 4.47Å; I709-F760 HydrophobicContact CD1-CD1 3.71Å; I709-F760 HydrophobicContact CD1-CD2 4.06Å; I709-F760 HydrophobicContact CD1-CE1 3.79Å; I709-F760 HydrophobicContact CD1-CE2 4.11Å; I709-F760 HydrophobicContact CD1-CG 3.86Å; I709-F760 HydrophobicContact CD1-CZ 3.99Å; I709-F760 HydrophobicContact CG1-CD1 3.94Å; I709-F760 HydrophobicContact CG1-CE1 3.71Å; I709-F760 HydrophobicContact CG1-CZ 4.16Å; I709-F760 HydrophobicContact CG2-CE1 4.06Å; I709-F760 HydrophobicContact CG2-CE2 4.4Å; I709-F760 HydrophobicContact CG2-CZ 3.74Å; L756-F760 HydrophobicContact CB-CD2 4.35Å; L756-F760 HydrophobicContact CB-CE2 4.32Å; L756-F760 HydrophobicContact CD2-CE2 4.36Å; L756-F760 WeakPolarHBondContact O-CB 3.34Å; L756-F760 WeakPolarHBondContact O-CD2 3.5Å; L756-F760 PolarHBondContact O-N 3.09Å; K757-F760 PolarHBondContact O-N 3.39Å; F760-R762 PolarHBondContact O-N 3.48Å; F760-Q763 PolarHBondContact O-N 3.45Å; F760-Q763 VanDerWaalsContact O-N 3.12Å; F760-W767 HydrophobicContact CD1-CB 3.99Å; F760-W767 HydrophobicContact CD1-CD2 4.45Å; F760-W767 AromaticContact CD1-CE3 3.97Å; F760-W767 HydrophobicContact CD1-CE3 3.97Å; F760-W767 HydrophobicContact CD1-CG 4.48Å; F760-W767 HydrophobicContact CE1-CD2 4.45Å; F760-W767 AromaticContact CE1-CE3 3.6Å; F760-W767 HydrophobicContact CE1-CE3 3.6Å; F760-W767 HydrophobicContact CE1-CZ3 4.21Å; F760-I770 HydrophobicContact CE1-CG2 4.5Å; F760-I770 HydrophobicContact CZ-CG2 4.31Å; F760-E771 HydrophobicContact CD2-CB 4.3Å; F760-M786 HydrophobicContact CE2-CE 4.42Å; F760-M786 HydrophobicContact CZ-CE 4.02Å; F760-M786 HydrophobicContact CZ-SD 4.12Å
761	M	88.4	Confident	85.9	Confident	117 Å²	117	57.9 Å²	57.9	58%	0.576	30%	0.295	S	S	*	.	H	α-helix	trans	-63.1	-27.2	174.9	-75.7	-174.4	-172.3	0	0	113.1	K757 E758 Q763 H768	K757-M761 WeakPolarHBondContact O-CG 3.24Å; K757-M761 PolarHBondContact O-N 2.91Å; E758-M761 PolarHBondContact O-N 2.97Å; M761-Q763 VanDerWaalsContact C-N 3.29Å; M761-H768 PolarHBondContact O-CE1 2.86Å; M761-H768 PolarHBondContact O-NE2 3.37Å
762	R	88.1	Confident	85.8	Confident	136 Å²	136	59.8 Å²	59.8	51%	0.513	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-9.8	176.5	-73.3	-176.9	-108.1	119.4	-10.3	113.8	E708 E758 A759 F760	E708-R762 IonicContact OE1-CZ 3.66Å; E708-R762 IonicContact OE1-NH1 3.59Å; E708-R762 PolarHBondContact OE1-NH1 2.96Å; E708-R762 IonicContact OE2-NH1 3.23Å; E708-R762 PolarHBondContact OE2-NH1 3.33Å; E758-R762 WeakPolarHBondContact O-CG 3.36Å; E758-R762 PolarHBondContact O-N 3.27Å; E758-R762 PolarHBondContact O-NE 2.77Å; E758-R762 IonicContact OE2-NH2 3.42Å; A759-R762 PolarHBondContact O-N 2.97Å; F760-R762 PolarHBondContact O-N 3.48Å
763	Q	87.6	Confident	85.8	Confident	57 Å²	57	65.1 Å²	65.1	27%	0.266	33%	0.325	S	S	.	.	S	Bend	trans	-91.5	-175.4	177.2	-54.6	-56.4	-49.4	0	0	111.5	P706 E708 A759 F760 M761 W767 H768	P706-Q763 HydrophobicContact CB-CG 4.12Å; P706-Q763 HydrophobicContact CG-CG 4.02Å; E708-Q763 PolarHBondContact OE2-NE2 3.35Å; A759-Q763 WeakPolarHBondContact O-CG 3.34Å; F760-Q763 PolarHBondContact O-N 3.45Å; F760-Q763 VanDerWaalsContact O-N 3.12Å; M761-Q763 VanDerWaalsContact C-N 3.29Å; Q763-W767 HydrophobicContact CB-CB 3.99Å; Q763-W767 HydrophobicContact CB-CG 4.04Å; Q763-H768 PolarHBondContact O-CE1 3.47Å; Q763-H768 VanDerWaalsContact O-CE1 3.27Å
764	D	82.3	Confident	85.9	Confident	115 Å²	115	64 Å²	64	62%	0.615	32%	0.319	S	S	*	.			trans	-56.3	156.6	176.2	-67.6	-35.6	0	0	0	113.2	M766 W767 H768	D764-M766 HydrophobicContact CB-CG 3.89Å; D764-M766 PolarHBondContact O-N 2.86Å; D764-W767 PolarHBondContact O-N 3.46Å; D764-H768 PolarHBondContact O-ND1 3.31Å
765	S	82.1	Confident	85.9	Confident	107 Å²	107	60.5 Å²	60.5	75%	0.748	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-52.2	-28.3	179.7	59.8	0	0	0	0	113.8	W767 H768	S765-W767 PolarHBondContact O-N 3.09Å; S765-H768 VanDerWaalsContact CA-ND1 3.33Å; S765-H768 WeakPolarHBondContact CA-ND1 3.38Å; S765-H768 PolarHBondContact O-N 3.4Å
766	M	84.8	Confident	85.9	Confident	91 Å²	91	57.3 Å²	57.3	45%	0.448	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-62.3	-25.2	175.8	62.8	172	-80.2	0	0	114.2	L703 D764 I770	L703-M766 HydrophobicContact CD1-CE 3.56Å; D764-M766 HydrophobicContact CB-CG 3.89Å; D764-M766 PolarHBondContact O-N 2.86Å; M766-I770 WeakPolarHBondContact O-CD1 3.36Å
767	W	86.1	Confident	85.9	Confident	11 Å²	11	58.1 Å²	58.1	4%	0.042	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-92.2	-8.3	-176.3	-66.1	101.3	0	0	0	114.2	P704 L705 P706 F760 Q763 D764 S765 G769 I770 A843 F845	P704-W767 VanDerWaalsContact O-CZ2 3.3Å; P704-W767 WeakPolarHBondContact O-CZ2 3.39Å; L705-W767 HydrophobicContact CD1-CH2 4.1Å; L705-W767 HydrophobicContact CD1-CZ3 3.8Å; P706-W767 HydrophobicContact CG-CD2 4.12Å; P706-W767 HydrophobicContact CG-CZ2 4.07Å; F760-W767 HydrophobicContact CD1-CB 3.99Å; F760-W767 HydrophobicContact CD1-CD2 4.45Å; F760-W767 AromaticContact CD1-CE3 3.97Å; F760-W767 HydrophobicContact CD1-CE3 3.97Å; F760-W767 HydrophobicContact CD1-CG 4.48Å; F760-W767 HydrophobicContact CE1-CD2 4.45Å; F760-W767 AromaticContact CE1-CE3 3.6Å; F760-W767 HydrophobicContact CE1-CE3 3.6Å; F760-W767 HydrophobicContact CE1-CZ3 4.21Å; Q763-W767 HydrophobicContact CB-CB 3.99Å; Q763-W767 HydrophobicContact CB-CG 4.04Å; D764-W767 PolarHBondContact O-N 3.46Å; S765-W767 PolarHBondContact O-N 3.09Å; W767-G769 PolarHBondContact O-N 3.01Å; W767-I770 HydrophobicContact CB-CD1 4.42Å; W767-I770 HydrophobicContact CD2-CD1 4.17Å; W767-I770 HydrophobicContact CE3-CD1 3.52Å; W767-I770 HydrophobicContact CZ3-CD1 4.07Å; W767-I770 WeakPolarHBondContact O-CB 3.47Å; W767-I770 WeakPolarHBondContact O-CG1 3.44Å; W767-I770 PolarHBondContact O-N 2.58Å; W767-A843 HydrophobicContact CH2-CB 3.85Å; W767-A843 HydrophobicContact CZ3-CB 4.05Å; W767-F845 HydrophobicContact CZ3-CZ 4.39Å
768	H	85.7	Confident	85.8	Confident	101 Å²	101	55.8 Å²	55.8	47%	0.468	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	129.9	-176.4	-71.1	55.3	0	0	0	111.2	M761 Q763 D764 S765 I770	M761-H768 PolarHBondContact O-CE1 2.86Å; M761-H768 PolarHBondContact O-NE2 3.37Å; Q763-H768 PolarHBondContact O-CE1 3.47Å; Q763-H768 VanDerWaalsContact O-CE1 3.27Å; D764-H768 PolarHBondContact O-ND1 3.31Å; S765-H768 VanDerWaalsContact CA-ND1 3.33Å; S765-H768 WeakPolarHBondContact CA-ND1 3.38Å; S765-H768 PolarHBondContact O-N 3.4Å; H768-I770 VanDerWaalsContact C-N 3.26Å; H768-I770 PolarHBondContact O-N 3.27Å
769	G	81.5	Confident	85.6	Confident	30 Å²	30	50.8 Å²	50.8	31%	0.309	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	12.7	178.4	0	0	0	0	0	114.6	W767 E771	W767-G769 PolarHBondContact O-N 3.01Å; G769-E771 VanDerWaalsContact C-N 3.27Å; G769-E771 VanDerWaalsContact C-OE2 3.23Å; G769-E771 VanDerWaalsContact CA-OE2 3.23Å; G769-E771 WeakPolarHBondContact CA-OE2 3.22Å; G769-E771 PolarHBondContact N-OE2 3.34Å; G769-E771 PolarHBondContact O-N 2.76Å
770	I	85.5	Confident	84.9	Confident	7 Å²	7	57.8 Å²	57.8	4%	0.036	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-69.1	-27.6	178.2	-74.6	-170	0	0	0	112	F760 M766 W767 H768 E772 K773 V774 I788 F845	F760-I770 HydrophobicContact CE1-CG2 4.5Å; F760-I770 HydrophobicContact CZ-CG2 4.31Å; M766-I770 WeakPolarHBondContact O-CD1 3.36Å; W767-I770 HydrophobicContact CB-CD1 4.42Å; W767-I770 HydrophobicContact CD2-CD1 4.17Å; W767-I770 HydrophobicContact CE3-CD1 3.52Å; W767-I770 HydrophobicContact CZ3-CD1 4.07Å; W767-I770 WeakPolarHBondContact O-CB 3.47Å; W767-I770 WeakPolarHBondContact O-CG1 3.44Å; W767-I770 PolarHBondContact O-N 2.58Å; H768-I770 VanDerWaalsContact C-N 3.26Å; H768-I770 PolarHBondContact O-N 3.27Å; I770-E772 PolarHBondContact O-N 3.38Å; I770-K773 CarbonylContact O-C 3.3Å; I770-K773 WeakPolarHBondContact O-CA 3.47Å; I770-K773 PolarHBondContact O-N 3.1Å; I770-V774 WeakPolarHBondContact O-CG2 3.41Å; I770-V774 PolarHBondContact O-N 3.33Å; I770-I788 HydrophobicContact CD1-CD1 4.35Å; I770-I788 HydrophobicContact CG2-CD1 3.66Å; I770-I788 HydrophobicContact CG2-CG1 4.11Å; I770-I788 HydrophobicContact CG2-CG2 4.38Å; I770-F845 HydrophobicContact CD1-CE1 3.94Å; I770-F845 HydrophobicContact CD1-CZ 3.89Å
771	E	81.9	Confident	84.1	Confident	9 Å²	9	66 Å²	66	4%	0.042	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-57.9	-31	-179.3	70	-81.4	-173.9	0	0	113.3	L753 K757 F760 G769 K773 V774	L753-E771 HydrophobicContact CD1-CB 4.07Å; L753-E771 HydrophobicContact CD1-CG 4.17Å; K757-E771 HydrophobicContact CD-CG 4.18Å; K757-E771 VanDerWaalsContact CE-CG 3.49Å; K757-E771 WeakPolarHBondContact CE-OE1 3.4Å; K757-E771 HydrophobicContact CG-CB 4.35Å; K757-E771 HydrophobicContact CG-CG 3.48Å; K757-E771 VanDerWaalsContact CG-CG 3.48Å; K757-E771 WeakPolarHBondContact CG-OE1 3.47Å; F760-E771 HydrophobicContact CD2-CB 4.3Å; G769-E771 VanDerWaalsContact C-N 3.27Å; G769-E771 VanDerWaalsContact C-OE2 3.23Å; G769-E771 VanDerWaalsContact CA-OE2 3.23Å; G769-E771 WeakPolarHBondContact CA-OE2 3.22Å; G769-E771 PolarHBondContact N-OE2 3.34Å; G769-E771 PolarHBondContact O-N 2.76Å; E771-K773 VanDerWaalsContact C-N 3.32Å; E771-V774 WeakPolarHBondContact O-CG2 3.27Å
772	E	79.6	Confident	83.6	Confident	125 Å²	125	60.8 Å²	60.8	58%	0.584	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-80.2	-19.1	178	-56.5	-170.1	161.9	0	0	111.5	K757 I770 S798	K757-E772 IonicContact NZ-OE1 3.67Å; I770-E772 PolarHBondContact O-N 3.38Å; E772-S798 VanDerWaalsContact O-CB 3.23Å; E772-S798 WeakPolarHBondContact O-CB 3.33Å
773	K	85.3	Confident	83.4	Confident	116 Å²	116	54.6 Å²	54.6	50%	0.504	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-97.5	2.6	-178	-63.8	-175.9	-179.6	-176.9	0	113.7	I770 E771 W775 I788 N789	I770-K773 CarbonylContact O-C 3.3Å; I770-K773 WeakPolarHBondContact O-CA 3.47Å; I770-K773 PolarHBondContact O-N 3.1Å; E771-K773 VanDerWaalsContact C-N 3.32Å; K773-W775 PolarHBondContact O-N 3.15Å; K773-I788 HydrophobicContact CB-CG2 3.93Å; K773-N789 WeakPolarHBondContact CB-O 3.49Å; K773-N789 PolarHBondContact O-N 3.28Å
774	V	86.9	Confident	83.5	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	115.4	-178.6	-176.1	0	0	0	0	110.1	I770 E771 F777 M786 V799	I770-V774 WeakPolarHBondContact O-CG2 3.41Å; I770-V774 PolarHBondContact O-N 3.33Å; E771-V774 WeakPolarHBondContact O-CG2 3.27Å; V774-F777 HydrophobicContact CG1-CE1 4.48Å; V774-F777 HydrophobicContact CG1-CE2 4.05Å; V774-F777 HydrophobicContact CG1-CZ 4.03Å; V774-M786 HydrophobicContact CB-CE 4.24Å; V774-M786 HydrophobicContact CG1-CE 3.87Å; V774-M786 HydrophobicContact CG2-CE 3.29Å; V774-V799 HydrophobicContact CG1-CB 4.5Å; V774-V799 HydrophobicContact CG1-CG2 4.38Å; V774-V799 PolarHBondContact O-N 2.87Å
775	W	86	Confident	84	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.008	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	-45.9	179.9	-163.5	-22.1	0	0	0	112.1	K773 L787 N789 Y794 R796 V799 D818 L821 V846 W849	K773-W775 PolarHBondContact O-N 3.15Å; W775-L787 WeakPolarHBondContact CA-O 3.15Å; W775-L787 HydrophobicContact CB-CB 4.28Å; W775-L787 HydrophobicContact CB-CD2 4.14Å; W775-L787 HydrophobicContact CB-CG 4.06Å; W775-L787 WeakPolarHBondContact CB-O 3.34Å; W775-L787 HydrophobicContact CD2-CD2 4.02Å; W775-L787 HydrophobicContact CE3-CD2 4.11Å; W775-L787 HydrophobicContact CE3-CG 4.31Å; W775-L787 HydrophobicContact CG-CD2 4.01Å; W775-L787 HydrophobicContact CG-CG 4.42Å; W775-L787 PolarHBondContact N-O 3.48Å; W775-N789 HydrophobicContact CE3-CB 3.98Å; W775-Y794 HydrophobicContact CH2-CE1 4.04Å; W775-Y794 HydrophobicContact CZ2-CE1 4.13Å; W775-R796 PolarHBondContact O-NH1 3.31Å; W775-V799 VanDerWaalsContact C-CG2 3.42Å; W775-V799 WeakPolarHBondContact O-CG2 3.37Å; W775-D818 HydrophobicContact CZ2-CB 4.41Å; W775-D818 WeakPolarHBondContact CZ2-OD1 3.47Å; W775-L821 HydrophobicContact CH2-CD1 3.52Å; W775-L821 HydrophobicContact CZ2-CB 4.45Å; W775-L821 HydrophobicContact CZ2-CD1 3.92Å; W775-L821 HydrophobicContact CZ3-CD1 4.35Å; W775-V846 HydrophobicContact CE3-CG2 4.21Å; W775-V846 HydrophobicContact CZ3-CB 4.2Å; W775-V846 HydrophobicContact CZ3-CG1 4.4Å; W775-V846 HydrophobicContact CZ3-CG2 3.96Å; W775-W849 HydrophobicContact CH2-CE3 4.35Å; W775-W849 HydrophobicContact CH2-CZ3 4.06Å
776	A	87.3	Confident	84.5	Confident	3 Å²	3	41.6 Å²	41.6	3%	0.025	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159	148.3	179.5	0	0	0	0	0	111.7	L787 V822 F825	A776-L787 HydrophobicContact CB-CB 4.28Å; A776-L787 PolarHBondContact N-O 2.89Å; A776-L787 PolarHBondContact O-N 3.4Å; A776-V822 HydrophobicContact CB-CG1 4.11Å; A776-V822 HydrophobicContact CB-CG2 4.16Å; A776-F825 HydrophobicContact CB-CD1 4.44Å; A776-F825 HydrophobicContact CB-CE1 4.35Å
777	F	88.5	Confident	84.9	Confident	19 Å²	19	37.4 Å²	37.4	8%	0.083	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	157.1	164.2	-67.5	-81.7	0	0	0	110.7	I713 L720 V774 N785 M786 V799 F800 H826	I713-F777 HydrophobicContact CD1-CD1 4.42Å; I713-F777 HydrophobicContact CD1-CE1 4.02Å; I713-F777 HydrophobicContact CG1-CE1 4.29Å; L720-F777 HydrophobicContact CD1-CD1 4.29Å; L720-F777 HydrophobicContact CD1-CE1 4.38Å; L720-F777 HydrophobicContact CD1-CG 4.49Å; L720-F777 HydrophobicContact CD2-CD2 3.8Å; L720-F777 HydrophobicContact CD2-CE1 4.45Å; L720-F777 HydrophobicContact CD2-CE2 3.62Å; L720-F777 HydrophobicContact CD2-CG 4.3Å; L720-F777 HydrophobicContact CD2-CZ 3.97Å; V774-F777 HydrophobicContact CG1-CE1 4.48Å; V774-F777 HydrophobicContact CG1-CE2 4.05Å; V774-F777 HydrophobicContact CG1-CZ 4.03Å; F777-N785 CarbonylContact C-O 3.58Å; F777-N785 WeakPolarHBondContact CA-O 3.48Å; F777-M786 HydrophobicContact CD1-CG 4Å; F777-M786 HydrophobicContact CE1-CE 4.05Å; F777-M786 HydrophobicContact CE1-CG 3.97Å; F777-M786 HydrophobicContact CE1-SD 4.23Å; F777-M786 HydrophobicContact CZ-CE 4.44Å; F777-V799 HydrophobicContact CD2-CG1 4.12Å; F777-V799 HydrophobicContact CE2-CG1 3.93Å; F777-F800 HydrophobicContact CE2-CE2 4.34Å; F777-F800 HydrophobicContact CE2-CZ 4.02Å; F777-F800 HydrophobicContact CZ-CE2 4.3Å; F777-F800 AromaticContact CZ-CZ 3.97Å; F777-F800 HydrophobicContact CZ-CZ 3.97Å; F777-H826 PolarHBondContact O-NE2 2.83Å
778	G	86	Confident	85.1	Confident	8 Å²	8	36.9 Å²	36.9	8%	0.082	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-64.1	163.6	176.5	0	0	0	0	0	113.1	A782 N785	G778-A782 CarbonylContact C-O 3.13Å; G778-A782 VanDerWaalsContact CA-O 3.31Å; G778-A782 WeakPolarHBondContact CA-O 3.23Å; G778-N785 PolarHBondContact N-O 3.33Å
779	P	83.9	Confident	85.3	Confident	10 Å²	10	32.9 Å²	32.9	7%	0.065	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-68.9	167.4	-177.6	28	-32.7	0	0	0	112	K781 A782 S783 H826 C829 R830	P779-K781 VanDerWaalsContact C-N 3.26Å; P779-K781 PolarHBondContact O-N 2.91Å; P779-A782 HydrophobicContact CG-CB 4.19Å; P779-A782 CarbonylContact O-C 3.56Å; P779-A782 WeakPolarHBondContact O-CA 3.43Å; P779-A782 PolarHBondContact O-N 3.31Å; P779-S783 WeakPolarHBondContact O-CA 3.05Å; P779-S783 PolarHBondContact O-N 3.17Å; P779-H826 HydrophobicContact CG-CB 4.38Å; P779-C829 HydrophobicContact CG-CB 4.28Å; P779-R830 HydrophobicContact CB-CG 4.45Å; P779-R830 HydrophobicContact CG-CG 3.72Å
780	K	75	Confident	85.5	Confident	148 Å²	148	33.2 Å²	33.2	64%	0.643	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-44	-40.1	-175.6	-64.6	-169.5	173.7	-174.4	0	116.1	Q717	Q717-K780 PolarHBondContact NE2-O 3.3Å
781	K	73.1	Confident	85.5	Confident	173 Å²	173	33.7 Å²	33.7	75%	0.752	16%	0.164	S	C	*	.	G	3₁₀ helix	trans	-82.1	-9.5	179.8	-68.9	-174.8	178.4	178.8	0	114.3	P779	P779-K781 VanDerWaalsContact C-N 3.26Å; P779-K781 PolarHBondContact O-N 2.91Å
782	A	79.6	Confident	85.1	Confident	6 Å²	6	42.3 Å²	42.3	5%	0.05	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-146.5	42.7	-172.1	0	0	0	0	0	110.2	G778 P779 L784 N785 C829 P838	G778-A782 CarbonylContact C-O 3.13Å; G778-A782 VanDerWaalsContact CA-O 3.31Å; G778-A782 WeakPolarHBondContact CA-O 3.23Å; P779-A782 HydrophobicContact CG-CB 4.19Å; P779-A782 CarbonylContact O-C 3.56Å; P779-A782 WeakPolarHBondContact O-CA 3.43Å; P779-A782 PolarHBondContact O-N 3.31Å; A782-L784 PolarHBondContact O-N 2.81Å; A782-N785 PolarHBondContact O-ND2 3.16Å; A782-C829 HydrophobicContact CB-CB 4.02Å; A782-C829 WeakPolarHBondContact CB-O 3.21Å; A782-P838 HydrophobicContact CB-CB 4.22Å
783	S	83.2	Confident	84.7	Confident	7 Å²	7	43.5 Å²	43.5	5%	0.049	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-20	-171.2	51.6	0	0	0	0	113.7	Q717 P779 N785	Q717-S783 VanDerWaalsContact CD-OG 3.3Å; Q717-S783 WeakPolarHBondContact CG-OG 3.4Å; Q717-S783 PolarHBondContact NE2-OG 3.49Å; P779-S783 WeakPolarHBondContact O-CA 3.05Å; P779-S783 PolarHBondContact O-N 3.17Å; S783-N785 PolarHBondContact O-N 2.93Å
784	L	89.6	Confident	84.1	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.026	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	22.7	-179.1	-64	169.7	0	0	0	114.1	Q710 I713 E714 A782 R840 G841	Q710-L784 HydrophobicContact CB-CD2 4.35Å; Q710-L784 WeakPolarHBondContact O-CD2 3.48Å; I713-L784 HydrophobicContact CB-CD2 3.83Å; I713-L784 HydrophobicContact CG2-CD2 3.68Å; E714-L784 HydrophobicContact CB-CD2 3.94Å; A782-L784 PolarHBondContact O-N 2.81Å; L784-R840 HydrophobicContact CB-CG 4.22Å; L784-R840 HydrophobicContact CD1-CG 3.72Å; L784-R840 VanDerWaalsContact CD1-NE 3.28Å; L784-R840 VanDerWaalsContact CD1-NH2 3.25Å; L784-G841 VanDerWaalsContact O-CA 3.26Å; L784-G841 WeakPolarHBondContact O-CA 3.44Å; L784-G841 PolarHBondContact O-N 3.16Å; L784-G841 VanDerWaalsContact O-N 3.12Å
785	N	93.2	Very high	83	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.223	C	C	.	.			trans	-119.6	146.4	177.9	-54.9	-55.4	0	0	0	109.2	F777 G778 A782 S783 F825 I839 G841 V842	F777-N785 CarbonylContact C-O 3.58Å; F777-N785 WeakPolarHBondContact CA-O 3.48Å; G778-N785 PolarHBondContact N-O 3.33Å; A782-N785 PolarHBondContact O-ND2 3.16Å; S783-N785 PolarHBondContact O-N 2.93Å; N785-F825 HydrophobicContact CB-CE2 4.36Å; N785-F825 HydrophobicContact CB-CZ 4.07Å; N785-I839 PolarHBondContact ND2-O 3.42Å; N785-G841 PolarHBondContact OD1-N 2.91Å; N785-V842 VanDerWaalsContact CA-O 3.23Å; N785-V842 WeakPolarHBondContact CA-O 3.3Å; N785-V842 WeakPolarHBondContact CB-O 3.29Å; N785-V842 PolarHBondContact OD1-N 3.46Å; N785-V842 VanDerWaalsContact OD1-N 3.14Å
786	M	92.2	Very high	82.2	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	137	-178.8	-63.6	177.6	69.3	0	0	109.8	L705 I709 I713 F760 V774 F777 I788 V842 A843 F844	L705-M786 HydrophobicContact CD1-SD 3.83Å; L705-M786 HydrophobicContact CD2-CG 4.4Å; L705-M786 HydrophobicContact CD2-SD 4.05Å; I709-M786 HydrophobicContact CG2-SD 4.43Å; I713-M786 HydrophobicContact CD1-CG 4.18Å; I713-M786 HydrophobicContact CD1-SD 3.81Å; F760-M786 HydrophobicContact CE2-CE 4.42Å; F760-M786 HydrophobicContact CZ-CE 4.02Å; F760-M786 HydrophobicContact CZ-SD 4.12Å; V774-M786 HydrophobicContact CB-CE 4.24Å; V774-M786 HydrophobicContact CG1-CE 3.87Å; V774-M786 HydrophobicContact CG2-CE 3.29Å; F777-M786 HydrophobicContact CD1-CG 4Å; F777-M786 HydrophobicContact CE1-CE 4.05Å; F777-M786 HydrophobicContact CE1-CG 3.97Å; F777-M786 HydrophobicContact CE1-SD 4.23Å; F777-M786 HydrophobicContact CZ-CE 4.44Å; M786-I788 HydrophobicContact CB-CG1 4.46Å; M786-V842 PolarHBondContact N-O 3.34Å; M786-A843 CarbonylContact O-C 3.55Å; M786-A843 WeakPolarHBondContact O-CA 3.44Å; M786-F844 PolarHBondContact O-N 3.41Å
787	L	92.4	Very high	81	Confident	2 Å²	2	47 Å²	47	1%	0.01	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.9	165.8	-175.1	68	0	0	0	107.9	W775 A776 F825 F844 V846	W775-L787 WeakPolarHBondContact CA-O 3.15Å; W775-L787 HydrophobicContact CB-CB 4.28Å; W775-L787 HydrophobicContact CB-CD2 4.14Å; W775-L787 HydrophobicContact CB-CG 4.06Å; W775-L787 WeakPolarHBondContact CB-O 3.34Å; W775-L787 HydrophobicContact CD2-CD2 4.02Å; W775-L787 HydrophobicContact CE3-CD2 4.11Å; W775-L787 HydrophobicContact CE3-CG 4.31Å; W775-L787 HydrophobicContact CG-CD2 4.01Å; W775-L787 HydrophobicContact CG-CG 4.42Å; W775-L787 PolarHBondContact N-O 3.48Å; A776-L787 HydrophobicContact CB-CB 4.28Å; A776-L787 PolarHBondContact N-O 2.89Å; A776-L787 PolarHBondContact O-N 3.4Å; L787-F825 HydrophobicContact CB-CD1 3.96Å; L787-F825 HydrophobicContact CB-CD2 4.21Å; L787-F825 HydrophobicContact CB-CE1 3.92Å; L787-F825 HydrophobicContact CB-CE2 4.16Å; L787-F825 HydrophobicContact CB-CG 4.12Å; L787-F825 HydrophobicContact CB-CZ 4.03Å; L787-F825 HydrophobicContact CD1-CB 4.49Å; L787-F825 HydrophobicContact CD1-CD2 4.18Å; L787-F825 HydrophobicContact CD1-CG 4.3Å; L787-F825 HydrophobicContact CD2-CB 4.2Å; L787-F825 HydrophobicContact CD2-CD1 4.28Å; L787-F825 HydrophobicContact CD2-CG 4.22Å; L787-F825 HydrophobicContact CG-CG 4.46Å; L787-F844 CarbonylContact C-O 3.56Å; L787-F844 WeakPolarHBondContact CA-O 3.22Å; L787-F844 HydrophobicContact CD1-CB 4.16Å; L787-V846 HydrophobicContact CD1-CG2 3.94Å
788	I	91.3	Very high	80.1	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	130.2	-174	-60	166.4	0	0	0	108.6	I770 K773 M786 A843 F844 F845 V846	I770-I788 HydrophobicContact CD1-CD1 4.35Å; I770-I788 HydrophobicContact CG2-CD1 3.66Å; I770-I788 HydrophobicContact CG2-CG1 4.11Å; I770-I788 HydrophobicContact CG2-CG2 4.38Å; K773-I788 HydrophobicContact CB-CG2 3.93Å; M786-I788 HydrophobicContact CB-CG1 4.46Å; I788-A843 HydrophobicContact CD1-CB 3.9Å; I788-F844 PolarHBondContact N-O 2.92Å; I788-F845 HydrophobicContact CB-CD1 3.89Å; I788-F845 HydrophobicContact CB-CE1 4.08Å; I788-F845 HydrophobicContact CB-CG 4.31Å; I788-F845 HydrophobicContact CD1-CD1 4.16Å; I788-F845 HydrophobicContact CD1-CD2 4.34Å; I788-F845 HydrophobicContact CD1-CE1 3.58Å; I788-F845 HydrophobicContact CD1-CE2 3.75Å; I788-F845 HydrophobicContact CD1-CZ 3.35Å; I788-F845 HydrophobicContact CG1-CE1 4.44Å; I788-F845 HydrophobicContact CG2-CD1 3.74Å; I788-F845 HydrophobicContact CG2-CE1 3.76Å; I788-V846 PolarHBondContact O-N 3.46Å
789	N	89.2	Confident	79.5	Confident	17 Å²	17	46.6 Å²	46.6	9%	0.091	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	113.2	173.5	-178.6	21.7	0	0	0	109.9	K773 W775 V791 Y794	K773-N789 WeakPolarHBondContact CB-O 3.49Å; K773-N789 PolarHBondContact O-N 3.28Å; W775-N789 HydrophobicContact CE3-CB 3.98Å; N789-V791 PolarHBondContact OD1-N 3.41Å; N789-Y794 PolarHBondContact ND2-O 3.24Å
790	A	86.3	Confident	78.9	Confident	36 Å²	36	46.4 Å²	46.4	30%	0.298	23%	0.234	S	C	.	.			trans	-121	17.5	177.5	0	0	0	0	0	112.4	F845 V846	A790-F845 HydrophobicContact CB-CD1 4.3Å; A790-V846 CarbonylContact C-O 3.48Å; A790-V846 VanDerWaalsContact C-O 3.3Å; A790-V846 VanDerWaalsContact CA-O 3.3Å; A790-V846 WeakPolarHBondContact CA-O 3.41Å; A790-V846 WeakPolarHBondContact CB-O 3.26Å; A790-V846 PolarHBondContact N-O 3.43Å
791	V	84.4	Confident	78.4	Confident	17 Å²	17	42 Å²	42	10%	0.103	22%	0.217	C	C	.	.			trans	-76.4	122.9	177.4	-177	0	0	0	0	109.2	N789 D793 Y794 V846 W849	N789-V791 PolarHBondContact OD1-N 3.41Å; V791-D793 VanDerWaalsContact C-N 3.33Å; V791-D793 PolarHBondContact O-N 3.39Å; V791-Y794 PolarHBondContact O-N 3.07Å; V791-V846 HydrophobicContact CG2-CB 4.43Å; V791-V846 HydrophobicContact CG2-CG1 3.89Å; V791-V846 WeakPolarHBondContact CG2-O 3.4Å; V791-V846 PolarHBondContact N-O 3.39Å; V791-W849 HydrophobicContact CG2-CB 4.39Å
792	E	74.5	Confident	77.7	Confident	191 Å²	191	34.8 Å²	34.8	89%	0.893	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-37.5	-173	-65.5	-175.7	174.4	0	0	113.1
793	D	70.9	Confident	76.6	Confident	149 Å²	149	36.7 Å²	36.7	80%	0.797	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.6	0.3	-174.1	-68.5	-30	0	0	0	114.7	V791	V791-D793 VanDerWaalsContact C-N 3.33Å; V791-D793 PolarHBondContact O-N 3.39Å
794	Y	72.3	Confident	75.2	Confident	8 Å²	8	40 Å²	40	3%	0.031	22%	0.218	C	C	.	.			trans	-116.8	89.1	-176.9	-173.2	-118.4	0	0	0	111.5	W775 N789 V791 R796 Y812 L814 R815 D818 W849	W775-Y794 HydrophobicContact CH2-CE1 4.04Å; W775-Y794 HydrophobicContact CZ2-CE1 4.13Å; N789-Y794 PolarHBondContact ND2-O 3.24Å; V791-Y794 PolarHBondContact O-N 3.07Å; Y794-R796 HydrophobicContact CD1-CB 4.45Å; Y794-R796 HydrophobicContact CE1-CB 3.96Å; Y794-R796 PolarHBondContact O-N 2.87Å; Y794-Y812 HydrophobicContact CD2-CD1 4.37Å; Y794-Y812 HydrophobicContact CD2-CG 4.12Å; Y794-Y812 HydrophobicContact CE2-CD2 4.34Å; Y794-Y812 HydrophobicContact CE2-CG 4.02Å; Y794-L814 HydrophobicContact CD2-CB 4.33Å; Y794-L814 HydrophobicContact CD2-CD1 4.28Å; Y794-L814 HydrophobicContact CE2-CB 3.97Å; Y794-R815 WeakPolarHBondContact OH-CA 3.31Å; Y794-D818 PolarHBondContact OH-OD1 3.4Å; Y794-D818 PolarHBondContact OH-OD2 3.32Å; Y794-W849 HydrophobicContact CE1-CZ3 4.45Å
795	N	64.9	Low	73	Confident	126 Å²	126	47.2 Å²	47.2	67%	0.674	25%	0.252	S	S	*	.			trans	-89.9	102.6	176.2	-161.6	6.4	0	0	0	110.6	Y812	N795-Y812 WeakPolarHBondContact O-CE2 3.26Å
796	R	67.7	Low	70.5	Confident	28 Å²	28	53.9 Å²	53.9	11%	0.106	29%	0.288	C	S	.	.			trans	-107.6	141.1	176.2	-178.3	-169	-177.3	-110.9	8.4	109.6	N728 W775 Y794 S798 D818	N728-R796 PolarHBondContact ND2-NH1 2.85Å; N728-R796 PolarHBondContact ND2-NH2 2.99Å; N728-R796 PolarHBondContact OD1-NH2 3.03Å; W775-R796 PolarHBondContact O-NH1 3.31Å; Y794-R796 HydrophobicContact CD1-CB 4.45Å; Y794-R796 HydrophobicContact CE1-CB 3.96Å; Y794-R796 PolarHBondContact O-N 2.87Å; R796-S798 PolarHBondContact O-N 3.44Å; R796-D818 WeakPolarHBondContact CD-OD2 3.45Å; R796-D818 IonicContact CZ-OD2 3.42Å; R796-D818 IonicContact NE-OD2 3.13Å; R796-D818 PolarHBondContact NE-OD2 3.49Å; R796-D818 IonicContact NH2-OD2 2.81Å
797	P	63.8	Low	68.1	Low	36 Å²	36	58.4 Å²	58.4	23%	0.234	32%	0.319	C	S	.	.			trans	-35	131.8	159	-40.4	43.3	0	0	0	114.8	D801	P797-D801 WeakPolarHBondContact CA-OD2 3.47Å; P797-D801 HydrophobicContact CB-CB 3.87Å; P797-D801 WeakPolarHBondContact CB-OD2 3.29Å
798	S	69.6	Low	65.9	Low	14 Å²	14	62.4 Å²	62.4	10%	0.098	34%	0.343	C	S	.	.			trans	-64.2	164.6	173.6	80.1	0	0	0	0	110.4	N728 E772 R796 F800 D801	N728-S798 PolarHBondContact ND2-O 3.2Å; E772-S798 VanDerWaalsContact O-CB 3.23Å; E772-S798 WeakPolarHBondContact O-CB 3.33Å; R796-S798 PolarHBondContact O-N 3.44Å; S798-F800 PolarHBondContact O-N 2.86Å; S798-F800 VanDerWaalsContact O-N 3.16Å; S798-F800 PolarHBondContact OG-N 3.1Å; S798-D801 WeakPolarHBondContact CB-OD1 3.34Å; S798-D801 VanDerWaalsContact N-CG 3.34Å; S798-D801 PolarHBondContact N-OD1 3.43Å; S798-D801 WeakPolarHBondContact O-CB 3.42Å; S798-D801 PolarHBondContact O-N 2.83Å; S798-D801 VanDerWaalsContact O-N 3.12Å; S798-D801 PolarHBondContact OG-N 3.09Å; S798-D801 PolarHBondContact OG-OD1 2.88Å
799	V	72.2	Confident	63.5	Low	3 Å²	3	70.7 Å²	70.7	2%	0.018	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-54.2	-29.9	167.5	158.6	0	0	0	0	112.4	I723 V774 W775 F777 D801 I802	I723-V799 HydrophobicContact CD1-CG1 3.66Å; I723-V799 HydrophobicContact CG2-CG1 4.29Å; V774-V799 HydrophobicContact CG1-CB 4.5Å; V774-V799 HydrophobicContact CG1-CG2 4.38Å; V774-V799 PolarHBondContact O-N 2.87Å; W775-V799 VanDerWaalsContact C-CG2 3.42Å; W775-V799 WeakPolarHBondContact O-CG2 3.37Å; F777-V799 HydrophobicContact CD2-CG1 4.12Å; F777-V799 HydrophobicContact CE2-CG1 3.93Å; V799-D801 VanDerWaalsContact C-N 3.29Å; V799-D801 PolarHBondContact O-N 3.31Å; V799-I802 WeakPolarHBondContact O-CD1 3.31Å
800	F	70.9	Confident	61.3	Low	7 Å²	7	71.2 Å²	71.2	3%	0.031	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-83	-1.8	-177.3	-62	-77.5	0	0	0	113.5	F749 L752 L753 L756 F777 S798 I802 L803	F749-F800 HydrophobicContact CD1-CD1 4.44Å; F749-F800 HydrophobicContact CD1-CE1 4.25Å; L752-F800 HydrophobicContact CD2-CE1 4.47Å; L753-F800 HydrophobicContact CB-CD1 4.37Å; L753-F800 HydrophobicContact CB-CE1 4.49Å; L753-F800 HydrophobicContact CD1-CD1 4.43Å; L753-F800 HydrophobicContact CD1-CD2 3.69Å; L753-F800 HydrophobicContact CD1-CE2 3.9Å; L753-F800 HydrophobicContact CD1-CG 3.97Å; L753-F800 HydrophobicContact CD1-CZ 4.37Å; L753-F800 HydrophobicContact CD2-CB 4.17Å; L753-F800 HydrophobicContact CD2-CG 4.36Å; L756-F800 HydrophobicContact CD1-CE2 4.46Å; L756-F800 HydrophobicContact CD1-CZ 3.89Å; F777-F800 HydrophobicContact CE2-CE2 4.34Å; F777-F800 HydrophobicContact CE2-CZ 4.02Å; F777-F800 HydrophobicContact CZ-CE2 4.3Å; F777-F800 AromaticContact CZ-CZ 3.97Å; F777-F800 HydrophobicContact CZ-CZ 3.97Å; S798-F800 PolarHBondContact O-N 2.86Å; S798-F800 VanDerWaalsContact O-N 3.16Å; S798-F800 PolarHBondContact OG-N 3.1Å; F800-I802 PolarHBondContact O-N 2.88Å; F800-L803 HydrophobicContact CB-CD1 4.43Å; F800-L803 VanDerWaalsContact O-CB 3.28Å; F800-L803 WeakPolarHBondContact O-CB 3.28Å; F800-L803 WeakPolarHBondContact O-CG 3.23Å; F800-L803 PolarHBondContact O-N 3.05Å
801	D	65.1	Low	59.4	Low	55 Å²	55	78.8 Å²	78.8	29%	0.294	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-65	-6.2	174.5	-73.2	34.2	0	0	0	112.8	P797 S798 V799 L803 C804	P797-D801 WeakPolarHBondContact CA-OD2 3.47Å; P797-D801 HydrophobicContact CB-CB 3.87Å; P797-D801 WeakPolarHBondContact CB-OD2 3.29Å; S798-D801 WeakPolarHBondContact CB-OD1 3.34Å; S798-D801 VanDerWaalsContact N-CG 3.34Å; S798-D801 PolarHBondContact N-OD1 3.43Å; S798-D801 WeakPolarHBondContact O-CB 3.42Å; S798-D801 PolarHBondContact O-N 2.83Å; S798-D801 VanDerWaalsContact O-N 3.12Å; S798-D801 PolarHBondContact OG-N 3.09Å; S798-D801 PolarHBondContact OG-OD1 2.88Å; V799-D801 VanDerWaalsContact C-N 3.29Å; V799-D801 PolarHBondContact O-N 3.31Å; D801-L803 PolarHBondContact O-N 2.94Å; D801-L803 VanDerWaalsContact O-N 3.12Å; D801-C804 WeakPolarHBondContact O-CB 3.43Å; D801-C804 PolarHBondContact O-N 2.78Å
802	I	59.6	Low	58	Low	21 Å²	21	82.6 Å²	82.6	11%	0.108	43%	0.431	C	S	.	.	G	3₁₀ helix	trans	-50.4	-27.1	161.3	-68.8	167.3	0	0	0	112.4	I723 N728 L730 R746 V799 F800 C804	I723-I802 HydrophobicContact CB-CD1 4.37Å; I723-I802 HydrophobicContact CD1-CD1 4.42Å; I723-I802 HydrophobicContact CG1-CD1 3.83Å; I723-I802 HydrophobicContact CG2-CD1 3.87Å; N728-I802 WeakPolarHBondContact O-CG1 3.49Å; L730-I802 HydrophobicContact CD1-CG2 3.71Å; L730-I802 HydrophobicContact CD2-CD1 4.34Å; L730-I802 HydrophobicContact CD2-CG2 4.08Å; L730-I802 HydrophobicContact CG-CG2 3.61Å; R746-I802 PolarHBondContact NE-O 2.83Å; V799-I802 WeakPolarHBondContact O-CD1 3.31Å; F800-I802 PolarHBondContact O-N 2.88Å; I802-C804 VanDerWaalsContact C-N 3.32Å
803	L	55.9	Low	57.3	Low	46 Å²	46	82.6 Å²	82.6	24%	0.241	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-74.4	-20.9	177	-61.1	176.4	0	0	0	112.8	R746 F749 L753 F800 D801	R746-L803 HydrophobicContact CB-CD2 3.74Å; R746-L803 HydrophobicContact CG-CD2 3.93Å; R746-L803 VanDerWaalsContact O-CD2 3.24Å; R746-L803 WeakPolarHBondContact O-CD2 3.12Å; F749-L803 HydrophobicContact CB-CD2 3.92Å; L753-L803 HydrophobicContact CD2-CD1 4.26Å; F800-L803 HydrophobicContact CB-CD1 4.43Å; F800-L803 VanDerWaalsContact O-CB 3.28Å; F800-L803 WeakPolarHBondContact O-CB 3.28Å; F800-L803 WeakPolarHBondContact O-CG 3.23Å; F800-L803 PolarHBondContact O-N 3.05Å; D801-L803 PolarHBondContact O-N 2.94Å; D801-L803 VanDerWaalsContact O-N 3.12Å
804	C	52.7	Low	57	Low	77 Å²	77	77.2 Å²	77.2	52%	0.52	40%	0.399	S	S	.	.			trans	-93.4	135	-178.3	-61.7	0	0	0	0	110.9	D801 I802	D801-C804 WeakPolarHBondContact O-CB 3.43Å; D801-C804 PolarHBondContact O-N 2.78Å; I802-C804 VanDerWaalsContact C-N 3.32Å
805	E	44.4	Very low	56.9	Low	156 Å²	156	82.2 Å²	82.2	73%	0.729	42%	0.418	S	S	*	.			trans	-82.3	-20.3	175.2	-67.4	-172	164.7	0	0	112.7	R746 S807	R746-E805 IonicContact CZ-OE1 2.86Å; R746-E805 IonicContact NH1-OE1 3.82Å; R746-E805 PolarHBondContact NH1-OE1 3.28Å; R746-E805 IonicContact NH2-OE1 3.73Å; E805-S807 PolarHBondContact O-N 3.01Å
806	D	40.6	Very low	57.1	Low	141 Å²	141	81.7 Å²	81.7	75%	0.754	41%	0.412	S	S	*	.	S	Bend	trans	-83.7	112	-178	-66.9	-36.7	0	0	0	111.2	V808	D806-V808 PolarHBondContact O-N 3.42Å
807	S	42.6	Very low	57.6	Low	95 Å²	95	80.6 Å²	80.6	66%	0.664	41%	0.407	S	S	*	.			trans	-67.1	103.1	169.5	53.7	0	0	0	0	109.7	E805 Q809	E805-S807 PolarHBondContact O-N 3.01Å; S807-Q809 VanDerWaalsContact C-N 3.34Å; S807-Q809 PolarHBondContact O-N 2.7Å
808	V	45.5	Very low	58.3	Low	86 Å²	86	79.5 Å²	79.5	52%	0.521	40%	0.399	S	S	.	.			trans	-67.6	97.1	168.1	-172.7	0	0	0	0	108.2	D806 A810 R815	D806-V808 PolarHBondContact O-N 3.42Å; V808-A810 HydrophobicContact CG1-CB 4.26Å; V808-A810 PolarHBondContact O-N 2.6Å; V808-R815 PolarHBondContact O-NH1 2.92Å
809	Q	41.4	Very low	58.8	Low	176 Å²	176	84.3 Å²	84.3	82%	0.822	42%	0.421	S	S	*	.			trans	-76.7	64.4	170.2	-71.5	-174.3	-14.1	0	0	109.5	S807	S807-Q809 VanDerWaalsContact C-N 3.34Å; S807-Q809 PolarHBondContact O-N 2.7Å
810	A	42.6	Very low	59.5	Low	27 Å²	27	84.4 Å²	84.4	22%	0.223	42%	0.421	C	S	.	.			trans	-84.4	111.1	162.1	0	0	0	0	0	108.2	V808 Y812 R815	V808-A810 HydrophobicContact CG1-CB 4.26Å; V808-A810 PolarHBondContact O-N 2.6Å; A810-Y812 VanDerWaalsContact C-N 3.32Å; A810-Y812 HydrophobicContact CB-CD2 3.62Å; A810-Y812 HydrophobicContact CB-CE2 3.32Å; A810-Y812 PolarHBondContact O-N 2.85Å; A810-Y812 VanDerWaalsContact O-N 3.09Å; A810-R815 PolarHBondContact O-NH1 3.49Å
811	E	45.8	Very low	60.3	Low	196 Å²	196	84 Å²	84	92%	0.916	42%	0.42	S	S	*	.			trans	-75.8	81.2	171.5	-77.5	-174	157.1	0	0	109.6
812	Y	55.6	Low	61.4	Low	96 Å²	96	81.5 Å²	81.5	38%	0.376	41%	0.406	S	S	.	.			trans	-90.4	126.4	167.1	-69	-75.2	0	0	0	109.7	Y794 N795 A810 L814 R815	Y794-Y812 HydrophobicContact CD2-CD1 4.37Å; Y794-Y812 HydrophobicContact CD2-CG 4.12Å; Y794-Y812 HydrophobicContact CE2-CD2 4.34Å; Y794-Y812 HydrophobicContact CE2-CG 4.02Å; N795-Y812 WeakPolarHBondContact O-CE2 3.26Å; A810-Y812 VanDerWaalsContact C-N 3.32Å; A810-Y812 HydrophobicContact CB-CD2 3.62Å; A810-Y812 HydrophobicContact CB-CE2 3.32Å; A810-Y812 PolarHBondContact O-N 2.85Å; A810-Y812 VanDerWaalsContact O-N 3.09Å; Y812-L814 PolarHBondContact O-N 3.5Å; Y812-R815 WeakPolarHBondContact O-CB 3.37Å; Y812-R815 PolarHBondContact O-N 2.93Å
813	K	58.8	Low	62.8	Low	191 Å²	191	82.7 Å²	82.7	83%	0.83	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-52.1	-30.4	177	-71.9	-176.9	177.4	-178.9	0	113.2	Q816	K813-Q816 WeakPolarHBondContact O-CG 3.4Å; K813-Q816 PolarHBondContact O-NE2 3.16Å
814	L	66.2	Low	64.5	Low	36 Å²	36	80.5 Å²	80.5	19%	0.188	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-76.6	-22.9	-178.3	-62.9	177.3	0	0	0	113.4	Y794 Y812 Q816 Y817 W849	Y794-L814 HydrophobicContact CD2-CB 4.33Å; Y794-L814 HydrophobicContact CD2-CD1 4.28Å; Y794-L814 HydrophobicContact CE2-CB 3.97Å; Y812-L814 PolarHBondContact O-N 3.5Å; L814-Q816 PolarHBondContact O-N 3.11Å; L814-Y817 PolarHBondContact O-N 3.49Å; L814-W849 HydrophobicContact CB-CE3 4.09Å; L814-W849 HydrophobicContact CB-CH2 3.68Å; L814-W849 HydrophobicContact CB-CZ2 4.15Å; L814-W849 HydrophobicContact CB-CZ3 3.65Å; L814-W849 HydrophobicContact CD1-CD2 4Å; L814-W849 HydrophobicContact CD1-CE3 3.89Å; L814-W849 HydrophobicContact CD1-CG 4.44Å; L814-W849 HydrophobicContact CD1-CZ3 4.32Å; L814-W849 HydrophobicContact CD2-CD2 4.07Å; L814-W849 HydrophobicContact CD2-CE3 4.46Å; L814-W849 HydrophobicContact CD2-CH2 4.25Å; L814-W849 HydrophobicContact CD2-CZ2 3.81Å; L814-W849 HydrophobicContact CG-CD2 4.43Å; L814-W849 HydrophobicContact CG-CE3 4.36Å; L814-W849 HydrophobicContact CG-CH2 4.44Å; L814-W849 HydrophobicContact CG-CZ2 4.47Å; L814-W849 HydrophobicContact CG-CZ3 4.37Å; L814-W849 VanDerWaalsContact O-CH2 3.23Å; L814-W849 WeakPolarHBondContact O-CH2 3.26Å
815	R	69.3	Low	66.4	Low	114 Å²	114	76.9 Å²	76.9	43%	0.43	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-57.8	-28	-175	-168.6	176.1	-178.9	170.1	2.7	113.1	Y794 V808 A810 Y812 Y817 D818	Y794-R815 WeakPolarHBondContact OH-CA 3.31Å; V808-R815 PolarHBondContact O-NH1 2.92Å; A810-R815 PolarHBondContact O-NH1 3.49Å; Y812-R815 WeakPolarHBondContact O-CB 3.37Å; Y812-R815 PolarHBondContact O-N 2.93Å; R815-Y817 PolarHBondContact O-N 2.96Å; R815-D818 PolarHBondContact O-N 3.41Å
816	Q	69.4	Low	68.7	Low	115 Å²	115	70.5 Å²	70.5	54%	0.537	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-62.3	-23.6	176.4	70.3	-172.4	-12.8	0	0	113.6	K813 L814	K813-Q816 WeakPolarHBondContact O-CG 3.4Å; K813-Q816 PolarHBondContact O-NE2 3.16Å; L814-Q816 PolarHBondContact O-N 3.11Å
817	Y	77.2	Confident	71.1	Confident	5 Å²	5	67 Å²	67	2%	0.02	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-103.1	1.5	-178.7	-54.2	-65.9	0	0	0	114	Y696 L814 R815 Q819 S820 L821 W849 H866 I867 I870	Y696-Y817 HydrophobicContact CE1-CE2 4.43Å; Y696-Y817 HydrophobicContact CE2-CE2 4.35Å; Y696-Y817 AromaticContact CZ-CE2 3.8Å; Y696-Y817 WeakPolarHBondContact OH-CE2 3.32Å; Y696-Y817 PolarHBondContact OH-OH 3.24Å; L814-Y817 PolarHBondContact O-N 3.49Å; R815-Y817 PolarHBondContact O-N 2.96Å; Y817-Q819 PolarHBondContact O-N 2.88Å; Y817-S820 WeakPolarHBondContact O-CA 3.43Å; Y817-S820 VanDerWaalsContact O-CB 3.23Å; Y817-S820 WeakPolarHBondContact O-CB 3.34Å; Y817-S820 PolarHBondContact O-N 2.78Å; Y817-L821 PolarHBondContact O-N 3.02Å; Y817-W849 HydrophobicContact CD2-CZ2 4.1Å; Y817-W849 HydrophobicContact CG-CZ2 4.43Å; Y817-H866 HydrophobicContact CE1-CB 4Å; Y817-H866 PolarHBondContact OH-ND1 2.76Å; Y817-I867 HydrophobicContact CD1-CG1 4.42Å; Y817-I870 HydrophobicContact CD1-CD1 3.55Å; Y817-I870 HydrophobicContact CD2-CD1 4.13Å; Y817-I870 HydrophobicContact CE1-CD1 4.02Å; Y817-I870 HydrophobicContact CG-CD1 3.6Å
818	D	79	Confident	73.5	Confident	12 Å²	12	63.1 Å²	63.1	6%	0.064	30%	0.3	C	S	.	.	H	α-helix	trans	-50.2	-43.7	177.3	-83.5	8	0	0	0	111.9	W775 Y794 R796 R815 S820 L821 V822	W775-D818 HydrophobicContact CZ2-CB 4.41Å; W775-D818 WeakPolarHBondContact CZ2-OD1 3.47Å; Y794-D818 PolarHBondContact OH-OD1 3.4Å; Y794-D818 PolarHBondContact OH-OD2 3.32Å; R796-D818 WeakPolarHBondContact CD-OD2 3.45Å; R796-D818 IonicContact CZ-OD2 3.42Å; R796-D818 IonicContact NE-OD2 3.13Å; R796-D818 PolarHBondContact NE-OD2 3.49Å; R796-D818 IonicContact NH2-OD2 2.81Å; R815-D818 PolarHBondContact O-N 3.41Å; D818-S820 PolarHBondContact O-N 2.85Å; D818-L821 PolarHBondContact O-N 3.42Å; D818-V822 WeakPolarHBondContact O-CG2 3Å; D818-V822 PolarHBondContact O-N 3.1Å
819	Q	80.7	Confident	75.8	Confident	116 Å²	116	59 Å²	59	54%	0.542	28%	0.275	S	S	.	.	H	α-helix	trans	-61.6	-34.4	179.8	-174.5	176.5	3.7	0	0	112.1	Y817 T823	Y817-Q819 PolarHBondContact O-N 2.88Å; Q819-T823 VanDerWaalsContact O-CB 3.23Å; Q819-T823 WeakPolarHBondContact O-CB 3.34Å; Q819-T823 PolarHBondContact O-N 3.39Å; Q819-T823 PolarHBondContact O-OG1 3.32Å
820	S	86.8	Confident	78.1	Confident	4 Å²	4	57.2 Å²	57.2	3%	0.028	26%	0.261	C	S	.	.	H	α-helix	trans	-68.2	-42.9	178.8	-55.3	0	0	0	0	111	Y817 D818 T823 G824 I867 I871	Y817-S820 WeakPolarHBondContact O-CA 3.43Å; Y817-S820 VanDerWaalsContact O-CB 3.23Å; Y817-S820 WeakPolarHBondContact O-CB 3.34Å; Y817-S820 PolarHBondContact O-N 2.78Å; D818-S820 PolarHBondContact O-N 2.85Å; S820-T823 PolarHBondContact O-N 2.94Å; S820-G824 PolarHBondContact O-N 2.87Å; S820-I867 WeakPolarHBondContact OG-CG2 3.23Å; S820-I871 WeakPolarHBondContact O-CG1 3.4Å
821	L	87.8	Confident	80.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-49.9	175.9	-84.8	151.9	0	0	0	111.9	F698 W775 Y817 D818 T823 G824 F825 W849 I870 V874	F698-L821 HydrophobicContact CD1-CD2 4.26Å; F698-L821 HydrophobicContact CE1-CD1 4.35Å; F698-L821 HydrophobicContact CE1-CD2 4Å; F698-L821 HydrophobicContact CE1-CG 4.45Å; W775-L821 HydrophobicContact CH2-CD1 3.52Å; W775-L821 HydrophobicContact CZ2-CB 4.45Å; W775-L821 HydrophobicContact CZ2-CD1 3.92Å; W775-L821 HydrophobicContact CZ3-CD1 4.35Å; Y817-L821 PolarHBondContact O-N 3.02Å; D818-L821 PolarHBondContact O-N 3.42Å; L821-T823 VanDerWaalsContact C-N 3.31Å; L821-T823 PolarHBondContact O-N 3.25Å; L821-G824 PolarHBondContact O-N 3.47Å; L821-F825 WeakPolarHBondContact O-CB 3.45Å; L821-F825 PolarHBondContact O-N 3.4Å; L821-W849 HydrophobicContact CD1-CD2 4.35Å; L821-W849 HydrophobicContact CD1-CE3 3.87Å; L821-W849 HydrophobicContact CD1-CH2 3.48Å; L821-W849 VanDerWaalsContact CD1-CH2 3.48Å; L821-W849 HydrophobicContact CD1-CZ2 4.01Å; L821-W849 HydrophobicContact CD1-CZ3 3.41Å; L821-W849 VanDerWaalsContact CD1-CZ3 3.41Å; L821-I870 HydrophobicContact CG-CG2 4.4Å; L821-V874 HydrophobicContact CD2-CB 4.3Å; L821-V874 HydrophobicContact CD2-CG1 3.95Å; L821-V874 HydrophobicContact CD2-CG2 3.35Å; L821-V874 HydrophobicContact CG-CG2 4.08Å
822	V	88	Confident	82.5	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.012	22%	0.217	C	C	.	.	H	α-helix	trans	-62.7	-39.2	178.9	177.3	0	0	0	0	111.2	P725 A776 D818 F825 H826	P725-V822 HydrophobicContact CB-CG1 3.88Å; A776-V822 HydrophobicContact CB-CG1 4.11Å; A776-V822 HydrophobicContact CB-CG2 4.16Å; D818-V822 WeakPolarHBondContact O-CG2 3Å; D818-V822 PolarHBondContact O-N 3.1Å; V822-F825 PolarHBondContact O-N 3.43Å; V822-H826 WeakPolarHBondContact O-CB 3.44Å; V822-H826 PolarHBondContact O-N 3.47Å
823	T	89	Confident	84.2	Confident	46 Å²	46	44 Å²	44	28%	0.282	20%	0.204	S	C	.	.	H	α-helix	trans	-64.5	-45.7	175.9	-59.2	0	0	0	0	111.4	Q819 S820 L821 F825 H826 L827 I871	Q819-T823 VanDerWaalsContact O-CB 3.23Å; Q819-T823 WeakPolarHBondContact O-CB 3.34Å; Q819-T823 PolarHBondContact O-N 3.39Å; Q819-T823 PolarHBondContact O-OG1 3.32Å; S820-T823 PolarHBondContact O-N 2.94Å; L821-T823 VanDerWaalsContact C-N 3.31Å; L821-T823 PolarHBondContact O-N 3.25Å; T823-F825 VanDerWaalsContact C-N 3.35Å; T823-F825 PolarHBondContact O-N 2.68Å; T823-H826 PolarHBondContact O-N 2.95Å; T823-L827 HydrophobicContact CG2-CD1 4.18Å; T823-L827 HydrophobicContact CG2-CG 4.49Å; T823-L827 VanDerWaalsContact O-CG 3.29Å; T823-L827 WeakPolarHBondContact O-CG 3.28Å; T823-L827 PolarHBondContact O-N 3.03Å; T823-I871 HydrophobicContact CG2-CD1 4.2Å; T823-I871 HydrophobicContact CG2-CG1 4.46Å; T823-I871 HydrophobicContact CG2-CG2 4.45Å
824	G	91.4	Very high	85.7	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59	-44.2	175	0	0	0	0	0	112.6	S820 L821 L827 R828	S820-G824 PolarHBondContact O-N 2.87Å; L821-G824 PolarHBondContact O-N 3.47Å; G824-L827 PolarHBondContact O-N 3.31Å; G824-R828 PolarHBondContact O-N 2.9Å; G824-R828 VanDerWaalsContact O-N 3.11Å
825	F	93.2	Very high	86.7	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.5	-50	173.6	166.2	-113.6	0	0	0	112.3	A776 N785 L787 L821 V822 T823 L827 R828 C829 F844 L878	A776-F825 HydrophobicContact CB-CD1 4.44Å; A776-F825 HydrophobicContact CB-CE1 4.35Å; N785-F825 HydrophobicContact CB-CE2 4.36Å; N785-F825 HydrophobicContact CB-CZ 4.07Å; L787-F825 HydrophobicContact CB-CD1 3.96Å; L787-F825 HydrophobicContact CB-CD2 4.21Å; L787-F825 HydrophobicContact CB-CE1 3.92Å; L787-F825 HydrophobicContact CB-CE2 4.16Å; L787-F825 HydrophobicContact CB-CG 4.12Å; L787-F825 HydrophobicContact CB-CZ 4.03Å; L787-F825 HydrophobicContact CD1-CB 4.49Å; L787-F825 HydrophobicContact CD1-CD2 4.18Å; L787-F825 HydrophobicContact CD1-CG 4.3Å; L787-F825 HydrophobicContact CD2-CB 4.2Å; L787-F825 HydrophobicContact CD2-CD1 4.28Å; L787-F825 HydrophobicContact CD2-CG 4.22Å; L787-F825 HydrophobicContact CG-CG 4.46Å; L821-F825 WeakPolarHBondContact O-CB 3.45Å; L821-F825 PolarHBondContact O-N 3.4Å; V822-F825 PolarHBondContact O-N 3.43Å; T823-F825 VanDerWaalsContact C-N 3.35Å; T823-F825 PolarHBondContact O-N 2.68Å; F825-L827 PolarHBondContact O-N 3.38Å; F825-R828 PolarHBondContact O-N 3.23Å; F825-R828 VanDerWaalsContact O-N 3.16Å; F825-C829 WeakPolarHBondContact CE2-SG 3.34Å; F825-C829 PolarHBondContact O-N 3.38Å; F825-F844 HydrophobicContact CD2-CD2 4.11Å; F825-F844 AromaticContact CE2-CD2 3.64Å; F825-F844 HydrophobicContact CE2-CD2 3.64Å; F825-F844 HydrophobicContact CE2-CE2 4.21Å; F825-F844 HydrophobicContact CE2-CG 4.42Å; F825-L878 HydrophobicContact CB-CD1 3.99Å; F825-L878 HydrophobicContact CD2-CD1 4.18Å
826	H	91.6	Very high	87.7	Confident	22 Å²	22	31 Å²	31	10%	0.102	15%	0.152	C	C	.	.	H	α-helix	trans	-62.3	-40.3	179.4	-78.1	-167.7	0	0	0	113.2	P725 F777 P779 V822 T823 R828 C829 R830	P725-H826 WeakPolarHBondContact CB-CE1 3.39Å; F777-H826 PolarHBondContact O-NE2 2.83Å; P779-H826 HydrophobicContact CG-CB 4.38Å; V822-H826 WeakPolarHBondContact O-CB 3.44Å; V822-H826 PolarHBondContact O-N 3.47Å; T823-H826 PolarHBondContact O-N 2.95Å; H826-R828 VanDerWaalsContact C-N 3.31Å; H826-R828 PolarHBondContact O-N 3Å; H826-C829 PolarHBondContact O-N 3.41Å; H826-R830 WeakPolarHBondContact O-CG 3.28Å; H826-R830 PolarHBondContact O-N 2.92Å; H826-R830 VanDerWaalsContact O-N 3.1Å
827	L	91.5	Very high	88.6	Confident	68 Å²	68	25.9 Å²	25.9	36%	0.356	13%	0.128	S	C	.	.	H	α-helix	trans	-61.6	-41	175.1	-71.6	173	0	0	0	111.2	T823 G824 F825 A831 I871 K875	T823-L827 HydrophobicContact CG2-CD1 4.18Å; T823-L827 HydrophobicContact CG2-CG 4.49Å; T823-L827 VanDerWaalsContact O-CG 3.29Å; T823-L827 WeakPolarHBondContact O-CG 3.28Å; T823-L827 PolarHBondContact O-N 3.03Å; G824-L827 PolarHBondContact O-N 3.31Å; F825-L827 PolarHBondContact O-N 3.38Å; L827-A831 PolarHBondContact O-N 3.49Å; L827-I871 HydrophobicContact CD1-CG2 3.89Å; L827-K875 HydrophobicContact CB-CD 4.47Å
828	R	93.3	Very high	89.3	Confident	13 Å²	13	27.1 Å²	27.1	5%	0.049	14%	0.137	C	C	.	.	H	α-helix	trans	-71.8	-35.9	177.1	-171	70.9	-83.3	173.1	-9.3	113.1	G824 F825 H826 R830 A831 G832 D836 I839 K875 L878	G824-R828 PolarHBondContact O-N 2.9Å; G824-R828 VanDerWaalsContact O-N 3.11Å; F825-R828 PolarHBondContact O-N 3.23Å; F825-R828 VanDerWaalsContact O-N 3.16Å; H826-R828 VanDerWaalsContact C-N 3.31Å; H826-R828 PolarHBondContact O-N 3Å; R828-R830 VanDerWaalsContact C-N 3.32Å; R828-R830 PolarHBondContact O-N 3.38Å; R828-A831 CarbonylContact C-O 3.49Å; R828-A831 PolarHBondContact NE-O 2.97Å; R828-A831 PolarHBondContact NH2-O 3.3Å; R828-A831 CarbonylContact O-C 3.58Å; R828-G832 PolarHBondContact NH2-O 2.98Å; R828-D836 IonicContact NH2-OD1 3.59Å; R828-I839 HydrophobicContact CG-CD1 4.22Å; R828-I839 VanDerWaalsContact O-CD1 3.3Å; R828-I839 WeakPolarHBondContact O-CD1 3.41Å; R828-K875 HydrophobicContact CB-CG 4.49Å; R828-L878 HydrophobicContact CB-CB 4.44Å; R828-L878 HydrophobicContact CB-CD1 4.4Å; R828-L878 HydrophobicContact CG-CB 4Å
829	C	93.2	Very high	90.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-68.6	-30.6	176.2	-73.2	0	0	0	0	113.1	P779 A782 F825 H826 P838 I839	P779-C829 HydrophobicContact CG-CB 4.28Å; A782-C829 HydrophobicContact CB-CB 4.02Å; A782-C829 WeakPolarHBondContact CB-O 3.21Å; F825-C829 WeakPolarHBondContact CE2-SG 3.34Å; F825-C829 PolarHBondContact O-N 3.38Å; H826-C829 PolarHBondContact O-N 3.41Å; C829-P838 WeakPolarHBondContact O-CA 3.31Å; C829-I839 PolarHBondContact O-N 3.49Å
830	R	89.8	Confident	90.7	Very high	138 Å²	138	23.1 Å²	23.1	52%	0.521	12%	0.116	S	C	.	.	H	α-helix	trans	-69.3	-36.8	178.4	-77.5	175.9	-175.9	167	4.5	113.3	P779 H826 R828 P838	P779-R830 HydrophobicContact CB-CG 4.45Å; P779-R830 HydrophobicContact CG-CG 3.72Å; H826-R830 WeakPolarHBondContact O-CG 3.28Å; H826-R830 PolarHBondContact O-N 2.92Å; H826-R830 VanDerWaalsContact O-N 3.1Å; R828-R830 VanDerWaalsContact C-N 3.32Å; R828-R830 PolarHBondContact O-N 3.38Å; R830-P838 WeakPolarHBondContact O-CA 3.46Å
831	A	89.7	Confident	91	Very high	27 Å²	27	22.9 Å²	22.9	22%	0.223	12%	0.115	C	C	.	.	S	Bend	trans	-129.3	115.2	180	0	0	0	0	0	107.9	L827 R828 D836	L827-A831 PolarHBondContact O-N 3.49Å; R828-A831 CarbonylContact C-O 3.49Å; R828-A831 PolarHBondContact NE-O 2.97Å; R828-A831 PolarHBondContact NH2-O 3.3Å; R828-A831 CarbonylContact O-C 3.58Å; A831-D836 HydrophobicContact CB-CB 3.94Å
832	G	90.9	Very high	91.3	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.115	C	C	.	.			trans	-81.2	164	177.4	0	0	0	0	0	113	E661 R828 M834 D836 E837	E661-G832 VanDerWaalsContact OE2-CA 3.31Å; E661-G832 WeakPolarHBondContact OE2-CA 3.43Å; R828-G832 PolarHBondContact NH2-O 2.98Å; G832-M834 VanDerWaalsContact C-N 3.35Å; G832-M834 PolarHBondContact O-N 3.29Å; G832-D836 VanDerWaalsContact O-CA 3.23Å; G832-D836 WeakPolarHBondContact O-CA 3.46Å; G832-D836 PolarHBondContact O-N 3.02Å; G832-D836 VanDerWaalsContact O-N 3.09Å; G832-E837 WeakPolarHBondContact CA-O 3.32Å; G832-E837 PolarHBondContact N-O 3.19Å
833	P	91.3	Very high	91.6	Very high	16 Å²	16	22.8 Å²	22.8	10%	0.104	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-24	-174.1	23.8	-30.8	0	0	0	115.3	E661 R879 F882 E883	E661-P833 VanDerWaalsContact OE2-CD 3.26Å; E661-P833 WeakPolarHBondContact OE2-CD 3.47Å; E661-P833 VanDerWaalsContact OE2-N 3.11Å; P833-R879 HydrophobicContact CB-CG 3.97Å; P833-F882 HydrophobicContact CG-CB 4.32Å; P833-F882 HydrophobicContact CG-CD1 3.18Å; P833-F882 HydrophobicContact CG-CE1 3.54Å; P833-F882 HydrophobicContact CG-CG 3.89Å; P833-F882 HydrophobicContact CG-CZ 4.5Å; P833-E883 HydrophobicContact CB-CG 3.92Å; P833-E883 HydrophobicContact CG-CG 4.23Å
834	M	89.5	Confident	91.9	Very high	2 Å²	2	20.6 Å²	20.6	1%	0.01	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-47	-173.9	-63.2	-170.8	-77.3	0	0	112.7	E661 G832 Q887 R888 L889 P973 F974 R1004	E661-M834 HydrophobicContact CB-CE 3.66Å; E661-M834 HydrophobicContact CG-CB 4.48Å; E661-M834 HydrophobicContact CG-CE 3.68Å; E661-M834 VanDerWaalsContact OE2-CB 3.31Å; E661-M834 WeakPolarHBondContact OE2-CB 3.36Å; E661-M834 PolarHBondContact OE2-N 2.94Å; G832-M834 VanDerWaalsContact C-N 3.35Å; G832-M834 PolarHBondContact O-N 3.29Å; M834-Q887 HydrophobicContact CE-CB 4.14Å; M834-Q887 HydrophobicContact CG-CB 4.49Å; M834-Q887 HydrophobicContact SD-CB 3.67Å; M834-R888 WeakPolarHBondContact CE-O 3.4Å; M834-L889 HydrophobicContact CE-CD2 4.03Å; M834-P973 HydrophobicContact SD-CG 4.02Å; M834-F974 HydrophobicContact CG-CE2 3.98Å; M834-F974 HydrophobicContact CG-CZ 3.97Å; M834-F974 HydrophobicContact SD-CE2 3.74Å; M834-F974 HydrophobicContact SD-CZ 4.2Å; M834-R1004 WeakPolarHBondContact O-CD 3.28Å; M834-R1004 PolarHBondContact O-NH1 3.07Å
835	C	88.1	Confident	92	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-140.7	12.5	-168.2	-63.7	0	0	0	0	112.7	E661 E837 V1003 K1007	E661-C835 WeakPolarHBondContact OE1-CA 3.35Å; E661-C835 PolarHBondContact OE1-N 2.9Å; C835-E837 HydrophobicContact CB-CB 4.43Å; C835-E837 HydrophobicContact CB-CG 3.9Å; C835-E837 PolarHBondContact O-N 3.29Å; C835-E837 VanDerWaalsContact O-N 3.1Å; C835-V1003 HydrophobicContact CB-CB 4.19Å; C835-V1003 HydrophobicContact CB-CG1 3.7Å; C835-K1007 VanDerWaalsContact O-CD 3.22Å; C835-K1007 WeakPolarHBondContact O-CD 3.48Å; C835-K1007 PolarHBondContact O-NZ 2.85Å
836	D	89.2	Confident	91.9	Very high	64 Å²	64	21.7 Å²	21.7	34%	0.342	11%	0.105	S	C	.	.	S	Bend	trans	51.3	27.9	-168	-73.9	-24.7	0	0	0	112.7	E661 R828 A831 G832 K1007 L1009	E661-D836 PolarHBondContact OE1-N 3.17Å; R828-D836 IonicContact NH2-OD1 3.59Å; A831-D836 HydrophobicContact CB-CB 3.94Å; G832-D836 VanDerWaalsContact O-CA 3.23Å; G832-D836 WeakPolarHBondContact O-CA 3.46Å; G832-D836 PolarHBondContact O-N 3.02Å; G832-D836 VanDerWaalsContact O-N 3.09Å; D836-K1007 HydrophobicContact CB-CD 4.17Å; D836-K1007 PolarHBondContact O-NZ 3.23Å; D836-L1009 HydrophobicContact CB-CD1 4.19Å; D836-L1009 WeakPolarHBondContact OD2-CD2 3.3Å
837	E	89.8	Confident	91.8	Very high	9 Å²	9	22.8 Å²	22.8	4%	0.042	11%	0.111	C	C	.	.	P	Polyproline II helix	trans	-92	152.7	175.5	-68.9	-67.9	-172.8	0	0	110.3	F659 E661 G832 C835 I839 V1003 R1006 K1007	F659-E837 HydrophobicContact CB-CG 4.28Å; F659-E837 WeakPolarHBondContact O-CB 3.5Å; E661-E837 HydrophobicContact CG-CB 4.1Å; E661-E837 PolarHBondContact OE1-N 3.26Å; G832-E837 WeakPolarHBondContact CA-O 3.32Å; G832-E837 PolarHBondContact N-O 3.19Å; C835-E837 HydrophobicContact CB-CB 4.43Å; C835-E837 HydrophobicContact CB-CG 3.9Å; C835-E837 PolarHBondContact O-N 3.29Å; C835-E837 VanDerWaalsContact O-N 3.1Å; E837-I839 PolarHBondContact O-N 2.93Å; E837-V1003 HydrophobicContact CG-CG1 3.93Å; E837-V1003 WeakPolarHBondContact OE1-CG1 3.45Å; E837-R1006 IonicContact OE1-CZ 2.83Å; E837-R1006 IonicContact OE1-NH2 3.69Å; E837-R1006 PolarHBondContact OE1-NH2 3.26Å; E837-K1007 IonicContact OE1-NZ 2.96Å; E837-K1007 PolarHBondContact OE1-NZ 3.33Å; E837-K1007 IonicContact OE2-NZ 2.57Å; E837-K1007 PolarHBondContact OE2-NZ 2.92Å
838	P	92.4	Very high	91.7	Very high	30 Å²	30	22.2 Å²	22.2	20%	0.195	11%	0.108	C	C	.	.	P	Polyproline II helix	trans	-55.7	137.9	-176	-25.9	34.8	0	0	0	112.9	A660 E661 A782 C829 R830	A660-P838 CarbonylContact C-O 3.55Å; A660-P838 VanDerWaalsContact CA-O 3.26Å; A660-P838 WeakPolarHBondContact CA-O 3.26Å; A660-P838 VanDerWaalsContact CB-O 3.31Å; A660-P838 WeakPolarHBondContact CB-O 3.31Å; E661-P838 PolarHBondContact N-O 3.37Å; A782-P838 HydrophobicContact CB-CB 4.22Å; C829-P838 WeakPolarHBondContact O-CA 3.31Å; R830-P838 WeakPolarHBondContact O-CA 3.46Å
839	I	94.7	Very high	91.3	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	11%	0.107	C	C	.	.	B	Isolated β-bridge	trans	-75.2	141.8	173.4	-59.8	179.2	0	0	0	108.9	E661 N785 R828 C829 E837 V842 F844 F882	E661-I839 CarbonylContact O-C 3.49Å; E661-I839 VanDerWaalsContact O-CA 3.3Å; E661-I839 WeakPolarHBondContact O-CA 3.42Å; N785-I839 PolarHBondContact ND2-O 3.42Å; R828-I839 HydrophobicContact CG-CD1 4.22Å; R828-I839 VanDerWaalsContact O-CD1 3.3Å; R828-I839 WeakPolarHBondContact O-CD1 3.41Å; C829-I839 PolarHBondContact O-N 3.49Å; E837-I839 PolarHBondContact O-N 2.93Å; I839-V842 HydrophobicContact CG2-CB 3.84Å; I839-V842 HydrophobicContact CG2-CG2 3.44Å; I839-V842 VanDerWaalsContact CG2-CG2 3.44Å; I839-F844 HydrophobicContact CD1-CZ 4.08Å; I839-F882 HydrophobicContact CD1-CD2 3.98Å; I839-F882 HydrophobicContact CD1-CE2 4.04Å; I839-F882 HydrophobicContact CG1-CE2 4.19Å; I839-F882 HydrophobicContact CG2-CD2 4.33Å; I839-F882 HydrophobicContact CG2-CE2 3.74Å
840	R	93.2	Very high	90.9	Very high	43 Å²	43	25 Å²	25	16%	0.162	12%	0.123	C	C	.	.			trans	-135.2	131.2	178.7	-172.8	173.2	179	115.6	0.7	111.1	A660 E661 T662 E714 L784	A660-R840 HydrophobicContact CB-CB 3.98Å; E661-R840 PolarHBondContact O-N 2.85Å; T662-R840 VanDerWaalsContact CB-O 3.29Å; T662-R840 WeakPolarHBondContact CB-O 3.33Å; T662-R840 PolarHBondContact OG1-O 3.19Å; E714-R840 IonicContact OE1-CZ 3.74Å; E714-R840 IonicContact OE1-NH1 2.6Å; E714-R840 IonicContact OE1-NH2 2.68Å; E714-R840 PolarHBondContact OE1-NH2 3.08Å; E714-R840 IonicContact OE2-NH2 2.75Å; E714-R840 PolarHBondContact OE2-NH2 3.12Å; L784-R840 HydrophobicContact CB-CG 4.22Å; L784-R840 HydrophobicContact CD1-CG 3.72Å; L784-R840 VanDerWaalsContact CD1-NE 3.28Å; L784-R840 VanDerWaalsContact CD1-NH2 3.25Å
841	G	93.3	Very high	90.4	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	76.1	37.6	170.8	0	0	0	0	0	114.1	L705 L784 N785	L705-G841 WeakPolarHBondContact CB-O 3.3Å; L705-G841 PolarHBondContact N-O 2.98Å; L784-G841 VanDerWaalsContact O-CA 3.26Å; L784-G841 WeakPolarHBondContact O-CA 3.44Å; L784-G841 PolarHBondContact O-N 3.16Å; L784-G841 VanDerWaalsContact O-N 3.12Å; N785-G841 PolarHBondContact OD1-N 2.91Å
842	V	95	Very high	89.8	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	130.5	-177.1	-175.5	0	0	0	0	112.1	I663 A702 N785 M786 I839 F844 F882	I663-V842 HydrophobicContact CD1-CG1 3.89Å; I663-V842 HydrophobicContact CD1-CG2 4.46Å; I663-V842 HydrophobicContact CG1-CG1 4.15Å; I663-V842 HydrophobicContact CG1-CG2 3.8Å; A702-V842 HydrophobicContact CB-CG1 4.23Å; N785-V842 VanDerWaalsContact CA-O 3.23Å; N785-V842 WeakPolarHBondContact CA-O 3.3Å; N785-V842 WeakPolarHBondContact CB-O 3.29Å; N785-V842 PolarHBondContact OD1-N 3.46Å; N785-V842 VanDerWaalsContact OD1-N 3.14Å; M786-V842 PolarHBondContact N-O 3.34Å; I839-V842 HydrophobicContact CG2-CB 3.84Å; I839-V842 HydrophobicContact CG2-CG2 3.44Å; I839-V842 VanDerWaalsContact CG2-CG2 3.44Å; V842-F844 HydrophobicContact CB-CD2 4.44Å; V842-F844 HydrophobicContact CB-CE2 3.9Å; V842-F844 HydrophobicContact CB-CZ 4.34Å; V842-F844 HydrophobicContact CG1-CD1 4.46Å; V842-F844 HydrophobicContact CG1-CD2 3.89Å; V842-F844 HydrophobicContact CG1-CE1 4.12Å; V842-F844 HydrophobicContact CG1-CE2 3.52Å; V842-F844 HydrophobicContact CG1-CG 4.39Å; V842-F844 HydrophobicContact CG1-CZ 3.66Å; V842-F882 HydrophobicContact CG2-CD2 4.45Å; V842-F882 HydrophobicContact CG2-CE2 4.01Å
843	A	94.3	Very high	88.8	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	119.1	170.9	0	0	0	0	0	110	A702 L703 L705 W767 M786 I788 F845	A702-A843 WeakPolarHBondContact CA-O 3.25Å; L703-A843 PolarHBondContact N-O 3.44Å; L703-A843 PolarHBondContact O-N 3.42Å; L705-A843 HydrophobicContact CD1-CB 4.22Å; W767-A843 HydrophobicContact CH2-CB 3.85Å; W767-A843 HydrophobicContact CZ3-CB 4.05Å; M786-A843 CarbonylContact O-C 3.55Å; M786-A843 WeakPolarHBondContact O-CA 3.44Å; I788-A843 HydrophobicContact CD1-CB 3.9Å; A843-F845 HydrophobicContact CB-CE2 3.83Å
844	F	94.9	Very high	87.4	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	124.9	176	-67	-86.4	0	0	0	110	K701 A702 M786 L787 I788 F825 I839 V842 L878 F882	K701-F844 CarbonylContact O-C 3.59Å; K701-F844 WeakPolarHBondContact O-CA 3.21Å; A702-F844 HydrophobicContact CB-CD1 3.82Å; A702-F844 HydrophobicContact CB-CE1 3.82Å; M786-F844 PolarHBondContact O-N 3.41Å; L787-F844 CarbonylContact C-O 3.56Å; L787-F844 WeakPolarHBondContact CA-O 3.22Å; L787-F844 HydrophobicContact CD1-CB 4.16Å; I788-F844 PolarHBondContact N-O 2.92Å; F825-F844 HydrophobicContact CD2-CD2 4.11Å; F825-F844 AromaticContact CE2-CD2 3.64Å; F825-F844 HydrophobicContact CE2-CD2 3.64Å; F825-F844 HydrophobicContact CE2-CE2 4.21Å; F825-F844 HydrophobicContact CE2-CG 4.42Å; I839-F844 HydrophobicContact CD1-CZ 4.08Å; V842-F844 HydrophobicContact CB-CD2 4.44Å; V842-F844 HydrophobicContact CB-CE2 3.9Å; V842-F844 HydrophobicContact CB-CZ 4.34Å; V842-F844 HydrophobicContact CG1-CD1 4.46Å; V842-F844 HydrophobicContact CG1-CD2 3.89Å; V842-F844 HydrophobicContact CG1-CE1 4.12Å; V842-F844 HydrophobicContact CG1-CE2 3.52Å; V842-F844 HydrophobicContact CG1-CG 4.39Å; V842-F844 HydrophobicContact CG1-CZ 3.66Å; F844-L878 HydrophobicContact CB-CD2 3.81Å; F844-L878 HydrophobicContact CD1-CB 4.21Å; F844-L878 HydrophobicContact CD1-CD2 3.45Å; F844-L878 VanDerWaalsContact CD1-CD2 3.45Å; F844-L878 HydrophobicContact CD1-CG 4.33Å; F844-L878 HydrophobicContact CE1-CB 4.09Å; F844-L878 HydrophobicContact CE1-CD2 4.2Å; F844-L878 HydrophobicContact CG-CD2 3.83Å; F844-F882 HydrophobicContact CE1-CB 4.43Å; F844-F882 HydrophobicContact CZ-CD2 4.22Å
845	F	93.3	Very high	85.7	Confident	22 Å²	22	38 Å²	38	10%	0.096	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	131.8	-179.8	-66.8	-103.6	0	0	0	109.7	L700 K701 L703 W767 I770 I788 A790 A843 E847	L700-F845 WeakPolarHBondContact CA-O 3.28Å; K701-F845 HydrophobicContact CB-CB 4.28Å; K701-F845 PolarHBondContact N-O 2.87Å; K701-F845 PolarHBondContact O-N 3.06Å; L703-F845 HydrophobicContact CB-CE2 4.02Å; L703-F845 HydrophobicContact CD1-CD2 3.98Å; L703-F845 HydrophobicContact CD1-CE2 3.49Å; L703-F845 VanDerWaalsContact CD1-CE2 3.49Å; L703-F845 HydrophobicContact CD1-CZ 4.04Å; L703-F845 HydrophobicContact CG-CD2 4.44Å; L703-F845 HydrophobicContact CG-CE2 4.14Å; W767-F845 HydrophobicContact CZ3-CZ 4.39Å; I770-F845 HydrophobicContact CD1-CE1 3.94Å; I770-F845 HydrophobicContact CD1-CZ 3.89Å; I788-F845 HydrophobicContact CB-CD1 3.89Å; I788-F845 HydrophobicContact CB-CE1 4.08Å; I788-F845 HydrophobicContact CB-CG 4.31Å; I788-F845 HydrophobicContact CD1-CD1 4.16Å; I788-F845 HydrophobicContact CD1-CD2 4.34Å; I788-F845 HydrophobicContact CD1-CE1 3.58Å; I788-F845 HydrophobicContact CD1-CE2 3.75Å; I788-F845 HydrophobicContact CD1-CZ 3.35Å; I788-F845 HydrophobicContact CG1-CE1 4.44Å; I788-F845 HydrophobicContact CG2-CD1 3.74Å; I788-F845 HydrophobicContact CG2-CE1 3.76Å; A790-F845 HydrophobicContact CB-CD1 4.3Å; A843-F845 HydrophobicContact CB-CE2 3.83Å; F845-E847 HydrophobicContact CB-CG 4.49Å
846	V	91.7	Very high	83.9	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.006	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	100.7	165	-172.3	0	0	0	0	106.9	L700 W775 L787 I788 A790 V791	L700-V846 HydrophobicContact CD2-CB 4.21Å; L700-V846 HydrophobicContact CD2-CG1 4.12Å; L700-V846 HydrophobicContact CD2-CG2 3.81Å; W775-V846 HydrophobicContact CE3-CG2 4.21Å; W775-V846 HydrophobicContact CZ3-CB 4.2Å; W775-V846 HydrophobicContact CZ3-CG1 4.4Å; W775-V846 HydrophobicContact CZ3-CG2 3.96Å; L787-V846 HydrophobicContact CD1-CG2 3.94Å; I788-V846 PolarHBondContact O-N 3.46Å; A790-V846 CarbonylContact C-O 3.48Å; A790-V846 VanDerWaalsContact C-O 3.3Å; A790-V846 VanDerWaalsContact CA-O 3.3Å; A790-V846 WeakPolarHBondContact CA-O 3.41Å; A790-V846 WeakPolarHBondContact CB-O 3.26Å; A790-V846 PolarHBondContact N-O 3.43Å; V791-V846 HydrophobicContact CG2-CB 4.43Å; V791-V846 HydrophobicContact CG2-CG1 3.89Å; V791-V846 WeakPolarHBondContact CG2-O 3.4Å; V791-V846 PolarHBondContact N-O 3.39Å
847	E	89.8	Confident	82.1	Confident	45 Å²	45	40.3 Å²	40.3	21%	0.21	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	-33.1	-176.8	-66.5	-174	163.4	0	0	112.3	S686 K699 K701 F845	S686-E847 VanDerWaalsContact CB-OE2 3.3Å; S686-E847 WeakPolarHBondContact CB-OE2 3.37Å; S686-E847 VanDerWaalsContact OG-CD 3.27Å; S686-E847 PolarHBondContact OG-OE1 3.22Å; S686-E847 PolarHBondContact OG-OE2 3Å; K699-E847 HydrophobicContact CB-CB 4.28Å; K699-E847 HydrophobicContact CD-CB 4.04Å; K699-E847 WeakPolarHBondContact CD-OE2 3.31Å; K699-E847 WeakPolarHBondContact CE-OE2 3.4Å; K699-E847 HydrophobicContact CG-CB 4.14Å; K699-E847 IonicContact NZ-OE2 3.52Å; K699-E847 PolarHBondContact NZ-OE2 2.88Å; K699-E847 PolarHBondContact O-N 2.86Å; K701-E847 WeakPolarHBondContact CD-OE1 3.3Å; F845-E847 HydrophobicContact CB-CG 4.49Å
848	D	88.1	Confident	80	Confident	56 Å²	56	44.2 Å²	44.2	30%	0.299	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150	145.5	-177.5	-159.7	0.2	0	0	0	111.3	F698 K699 N850	F698-D848 WeakPolarHBondContact CA-O 3.46Å; K699-D848 HydrophobicContact CB-CB 3.58Å; K699-D848 HydrophobicContact CD-CB 4.23Å; K699-D848 PolarHBondContact N-O 3.05Å; K699-D848 PolarHBondContact O-N 3.27Å; D848-N850 VanDerWaalsContact CG-ND2 3.3Å; D848-N850 PolarHBondContact OD1-ND2 2.91Å; D848-N850 PolarHBondContact OD1-OD1 3.05Å; D848-N850 PolarHBondContact OD2-ND2 3.12Å
849	W	85.5	Confident	77.6	Confident	10 Å²	10	50 Å²	50	4%	0.038	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	97.1	177.7	-178	7	0	0	0	110.6	Y696 E697 F698 W775 V791 Y794 L814 Y817 L821	Y696-W849 AromaticContact CD1-NE1 3.65Å; E697-W849 WeakPolarHBondContact O-CA 3.2Å; F698-W849 HydrophobicContact CD1-CB 4.35Å; F698-W849 AromaticContact CD1-CD1 3.78Å; F698-W849 HydrophobicContact CD1-CD2 4.49Å; F698-W849 AromaticContact CD1-CG 3.96Å; F698-W849 HydrophobicContact CD1-CG 3.96Å; F698-W849 AromaticContact CE1-CD1 3.33Å; F698-W849 AromaticContact CE1-CD2 3.85Å; F698-W849 HydrophobicContact CE1-CD2 3.85Å; F698-W849 AromaticContact CE1-CE2 3.61Å; F698-W849 AromaticContact CE1-CG 3.69Å; F698-W849 HydrophobicContact CE1-CG 3.69Å; F698-W849 HydrophobicContact CE1-CZ2 4.34Å; F698-W849 AromaticContact CE1-NE1 3.31Å; F698-W849 VanDerWaalsContact CE1-NE1 3.31Å; F698-W849 AromaticContact CZ-CD1 3.94Å; F698-W849 AromaticContact CZ-NE1 3.6Å; W775-W849 HydrophobicContact CH2-CE3 4.35Å; W775-W849 HydrophobicContact CH2-CZ3 4.06Å; V791-W849 HydrophobicContact CG2-CB 4.39Å; Y794-W849 HydrophobicContact CE1-CZ3 4.45Å; L814-W849 HydrophobicContact CB-CE3 4.09Å; L814-W849 HydrophobicContact CB-CH2 3.68Å; L814-W849 HydrophobicContact CB-CZ2 4.15Å; L814-W849 HydrophobicContact CB-CZ3 3.65Å; L814-W849 HydrophobicContact CD1-CD2 4Å; L814-W849 HydrophobicContact CD1-CE3 3.89Å; L814-W849 HydrophobicContact CD1-CG 4.44Å; L814-W849 HydrophobicContact CD1-CZ3 4.32Å; L814-W849 HydrophobicContact CD2-CD2 4.07Å; L814-W849 HydrophobicContact CD2-CE3 4.46Å; L814-W849 HydrophobicContact CD2-CH2 4.25Å; L814-W849 HydrophobicContact CD2-CZ2 3.81Å; L814-W849 HydrophobicContact CG-CD2 4.43Å; L814-W849 HydrophobicContact CG-CE3 4.36Å; L814-W849 HydrophobicContact CG-CH2 4.44Å; L814-W849 HydrophobicContact CG-CZ2 4.47Å; L814-W849 HydrophobicContact CG-CZ3 4.37Å; L814-W849 VanDerWaalsContact O-CH2 3.23Å; L814-W849 WeakPolarHBondContact O-CH2 3.26Å; Y817-W849 HydrophobicContact CD2-CZ2 4.1Å; Y817-W849 HydrophobicContact CG-CZ2 4.43Å; L821-W849 HydrophobicContact CD1-CD2 4.35Å; L821-W849 HydrophobicContact CD1-CE3 3.87Å; L821-W849 HydrophobicContact CD1-CH2 3.48Å; L821-W849 VanDerWaalsContact CD1-CH2 3.48Å; L821-W849 HydrophobicContact CD1-CZ2 4.01Å; L821-W849 HydrophobicContact CD1-CZ3 3.41Å; L821-W849 VanDerWaalsContact CD1-CZ3 3.41Å
850	N	83.9	Confident	75.4	Confident	60 Å²	60	53.7 Å²	53.7	32%	0.321	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	131.6	-176	-64.3	-46.5	0	0	0	111.5	Y696 E697 D848	Y696-N850 WeakPolarHBondContact CA-O 3.43Å; E697-N850 HydrophobicContact CB-CB 4.39Å; E697-N850 PolarHBondContact N-O 2.91Å; E697-N850 PolarHBondContact O-N 3.46Å; D848-N850 VanDerWaalsContact CG-ND2 3.3Å; D848-N850 PolarHBondContact OD1-ND2 2.91Å; D848-N850 PolarHBondContact OD1-OD1 3.05Å; D848-N850 PolarHBondContact OD2-ND2 3.12Å
851	D	79.3	Confident	73.3	Confident	56 Å²	56	57.8 Å²	57.8	30%	0.299	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	110.2	163.6	-168.1	-22.7	0	0	0	108.3	Y696 N853	Y696-D851 HydrophobicContact CD1-CB 4.09Å; Y696-D851 HydrophobicContact CE1-CB 3.8Å; Y696-D851 VanDerWaalsContact CE1-CG 3.48Å; Y696-D851 WeakPolarHBondContact CE1-OD2 3.44Å; Y696-D851 PolarHBondContact OH-OD2 3.09Å; D851-N853 PolarHBondContact OD1-N 2.96Å; D851-N853 VanDerWaalsContact OD1-N 3.1Å
852	L	77.4	Confident	71.3	Confident	67 Å²	67	61.5 Å²	61.5	35%	0.351	36%	0.357	S	S	.	.	S	Bend	trans	-82.5	-16.3	-176.2	-64.6	177.6	0	0	0	112.7	R690 Q694 S695 E697 P854	R690-L852 HydrophobicContact CG-CD1 4.5Å; Q694-L852 WeakPolarHBondContact O-CB 3.4Å; Q694-L852 WeakPolarHBondContact O-CD1 3.48Å; S695-L852 PolarHBondContact O-N 2.9Å; E697-L852 HydrophobicContact CB-CD1 3.95Å; E697-L852 HydrophobicContact CB-CD2 4.41Å; E697-L852 HydrophobicContact CB-CG 4.18Å; L852-P854 VanDerWaalsContact C-CD 3.47Å
853	N	70.7	Confident	69.5	Low	78 Å²	78	64.6 Å²	64.6	42%	0.417	38%	0.377	S	S	.	.			trans	-130.1	66.4	-179.4	-80.1	-27.1	0	0	0	111.5	D851 E855 A856 T857	D851-N853 PolarHBondContact OD1-N 2.96Å; D851-N853 VanDerWaalsContact OD1-N 3.1Å; N853-E855 PolarHBondContact O-N 2.79Å; N853-E855 VanDerWaalsContact O-N 3.17Å; N853-A856 HydrophobicContact CB-CB 4.33Å; N853-A856 PolarHBondContact O-N 2.85Å; N853-T857 PolarHBondContact O-OG1 3.47Å
854	P	61.7	Low	68	Low	91 Å²	91	70.8 Å²	70.8	59%	0.591	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-18.9	-178.6	26.3	-34.3	0	0	0	113.9	L852 T857	L852-P854 VanDerWaalsContact C-CD 3.47Å; P854-T857 PolarHBondContact O-OG1 3.2Å
855	E	52.5	Low	66.7	Low	166 Å²	166	73.1 Å²	73.1	78%	0.776	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-31.2	-178	-63.2	-174.3	171.7	0	0	112.9	N853 S858	N853-E855 PolarHBondContact O-N 2.79Å; N853-E855 VanDerWaalsContact O-N 3.17Å; E855-S858 PolarHBondContact O-OG 2.94Å
856	A	51.8	Low	65.9	Low	49 Å²	49	73.3 Å²	73.3	41%	0.405	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-74.2	-29.1	-177.3	0	0	0	0	0	113.2	N853 S858 H859	N853-A856 HydrophobicContact CB-CB 4.33Å; N853-A856 PolarHBondContact O-N 2.85Å; A856-S858 PolarHBondContact O-N 3.01Å; A856-S858 VanDerWaalsContact O-N 3.13Å; A856-H859 PolarHBondContact O-N 3.42Å
857	T	50.6	Low	65.4	Low	63 Å²	63	76.1 Å²	76.1	39%	0.387	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-68.9	-8	-178.9	16.9	0	0	0	0	114.1	N853 P854 H859	N853-T857 PolarHBondContact O-OG1 3.47Å; P854-T857 PolarHBondContact O-OG1 3.2Å; T857-H859 VanDerWaalsContact C-N 3.32Å
858	S	45.3	Very low	65.2	Low	90 Å²	90	75.6 Å²	75.6	63%	0.629	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-78.1	-12.4	177.4	61.5	0	0	0	0	114.1	E855 A856	E855-S858 PolarHBondContact O-OG 2.94Å; A856-S858 PolarHBondContact O-N 3.01Å; A856-S858 VanDerWaalsContact O-N 3.13Å
859	H	43.5	Very low	65.2	Low	152 Å²	152	75 Å²	75	70%	0.704	45%	0.447	S	S	*	.	S	Bend	trans	-103.9	41	-176	-74.2	-57.7	0	0	0	114.8	A856 T857 E861	A856-H859 PolarHBondContact O-N 3.42Å; T857-H859 VanDerWaalsContact C-N 3.32Å; H859-E861 PolarHBondContact O-N 3.19Å
860	G	47.6	Very low	65.4	Low	78 Å²	78	74.6 Å²	74.6	80%	0.804	45%	0.446	S	S	*	.			trans	52.7	18.2	164.3	0	0	0	0	0	116.8	S862	G860-S862 PolarHBondContact O-N 2.95Å
861	E	48.2	Very low	65.7	Low	130 Å²	130	73.1 Å²	73.1	61%	0.607	44%	0.437	S	S	*	.			trans	-63.9	133	178.2	-72.4	-172.2	158.5	0	0	108.2	H859 C863	H859-E861 PolarHBondContact O-N 3.19Å; E861-C863 PolarHBondContact O-N 3.48Å
862	S	52.1	Low	66.3	Low	78 Å²	78	74.8 Å²	74.8	55%	0.545	45%	0.446	S	S	.	.			trans	-47.4	107.6	-169.3	51.2	0	0	0	0	112.3	G860 D864 A865	G860-S862 PolarHBondContact O-N 2.95Å; S862-D864 PolarHBondContact O-N 3.18Å; S862-A865 PolarHBondContact O-N 3.4Å
863	C	57.3	Low	67	Low	64 Å²	64	72 Å²	72	43%	0.432	43%	0.432	S	S	.	.	H	α-helix	trans	-47.2	-30.1	176.7	-75.8	0	0	0	0	113	E861 A865 H866 I867	E861-C863 PolarHBondContact O-N 3.48Å; C863-A865 VanDerWaalsContact C-N 3.29Å; C863-A865 PolarHBondContact O-N 3.01Å; C863-H866 PolarHBondContact O-N 2.69Å; C863-I867 PolarHBondContact O-N 3.44Å
864	D	61.9	Low	68.1	Low	130 Å²	130	68.3 Å²	68.3	70%	0.695	41%	0.413	S	S	*	.	H	α-helix	trans	-59.7	-32.9	179.5	-64	-21.6	0	0	0	113.8	S862 H866 I867	S862-D864 PolarHBondContact O-N 3.18Å; D864-H866 VanDerWaalsContact C-N 3.31Å; D864-H866 PolarHBondContact O-N 3.24Å; D864-I867 PolarHBondContact O-N 2.9Å
865	A	68.7	Low	69.6	Low	49 Å²	49	67.4 Å²	67.4	41%	0.405	40%	0.4	S	S	.	.	H	α-helix	trans	-69	-30.9	-178.7	0	0	0	0	0	112.4	S862 C863 Q869	S862-A865 PolarHBondContact O-N 3.4Å; C863-A865 VanDerWaalsContact C-N 3.29Å; C863-A865 PolarHBondContact O-N 3.01Å; A865-Q869 WeakPolarHBondContact O-CG 3.46Å; A865-Q869 PolarHBondContact O-NE2 2.92Å
866	H	75.2	Confident	71.5	Confident	26 Å²	26	63.1 Å²	63.1	12%	0.12	38%	0.382	C	S	.	.	H	α-helix	trans	-78.1	-33.2	179.1	-67	178.7	0	0	0	112	Y696 Y817 C863 D864 G868 Q869 I870	Y696-H866 HydrophobicContact CE2-CB 4.43Å; Y696-H866 AromaticContact CE2-ND1 3.89Å; Y817-H866 HydrophobicContact CE1-CB 4Å; Y817-H866 PolarHBondContact OH-ND1 2.76Å; C863-H866 PolarHBondContact O-N 2.69Å; D864-H866 VanDerWaalsContact C-N 3.31Å; D864-H866 PolarHBondContact O-N 3.24Å; H866-G868 PolarHBondContact O-N 2.8Å; H866-Q869 PolarHBondContact O-N 3.04Å; H866-Q869 VanDerWaalsContact O-N 3.16Å; H866-I870 HydrophobicContact CB-CD1 4.48Å; H866-I870 VanDerWaalsContact O-CG1 3.3Å; H866-I870 WeakPolarHBondContact O-CG1 3.48Å; H866-I870 PolarHBondContact O-N 2.68Å
867	I	82.3	Confident	73.4	Confident	60 Å²	60	60.8 Å²	60.8	31%	0.308	36%	0.363	S	S	.	.	H	α-helix	trans	-53.9	-52.8	180	-68.7	174.7	0	0	0	111.1	Y817 S820 C863 D864 Q869 I870 I871	Y817-I867 HydrophobicContact CD1-CG1 4.42Å; S820-I867 WeakPolarHBondContact OG-CG2 3.23Å; C863-I867 PolarHBondContact O-N 3.44Å; D864-I867 PolarHBondContact O-N 2.9Å; I867-Q869 VanDerWaalsContact C-N 3.32Å; I867-Q869 PolarHBondContact O-N 2.78Å; I867-I870 PolarHBondContact O-N 2.81Å; I867-I871 HydrophobicContact CG2-CD1 3.9Å; I867-I871 VanDerWaalsContact O-CG1 3.28Å; I867-I871 WeakPolarHBondContact O-CG1 3.23Å; I867-I871 PolarHBondContact O-N 2.76Å
868	G	85.5	Confident	75.5	Confident	34 Å²	34	57.8 Å²	57.8	35%	0.351	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-36.3	-179.6	0	0	0	0	0	113.4	H866 N872	H866-G868 PolarHBondContact O-N 2.8Å; G868-N872 PolarHBondContact O-N 2.95Å; G868-N872 PolarHBondContact O-ND2 3.44Å
869	Q	88.9	Confident	77.8	Confident	45 Å²	45	58.4 Å²	58.4	21%	0.21	33%	0.333	C	S	.	.	H	α-helix	trans	-70.7	-41.5	179	-63.4	-176.2	40.7	0	0	111.8	T691 T692 S693 A865 H866 I867 N872 S873	T691-Q869 HydrophobicContact CG2-CB 4.46Å; T692-Q869 VanDerWaalsContact OG1-CG 3.3Å; T692-Q869 WeakPolarHBondContact OG1-CG 3.46Å; T692-Q869 PolarHBondContact OG1-OE1 2.97Å; S693-Q869 PolarHBondContact OG-OE1 3.38Å; S693-Q869 VanDerWaalsContact OG-OE1 3.1Å; A865-Q869 WeakPolarHBondContact O-CG 3.46Å; A865-Q869 PolarHBondContact O-NE2 2.92Å; H866-Q869 PolarHBondContact O-N 3.04Å; H866-Q869 VanDerWaalsContact O-N 3.16Å; I867-Q869 VanDerWaalsContact C-N 3.32Å; I867-Q869 PolarHBondContact O-N 2.78Å; Q869-N872 PolarHBondContact O-N 3.24Å; Q869-S873 WeakPolarHBondContact O-CB 3.35Å; Q869-S873 PolarHBondContact O-N 3.33Å; Q869-S873 PolarHBondContact O-OG 3Å
870	I	89.3	Confident	80.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-62	-47.4	175.7	-68	167.9	0	0	0	110	T691 Y696 F698 Y817 L821 H866 I867 N872 S873 V874	T691-I870 HydrophobicContact CG2-CG1 4.21Å; Y696-I870 HydrophobicContact CD2-CD1 4.04Å; Y696-I870 HydrophobicContact CD2-CG1 4.15Å; Y696-I870 HydrophobicContact CE2-CD1 4.13Å; F698-I870 HydrophobicContact CE2-CG2 4.39Å; F698-I870 HydrophobicContact CZ-CG1 4.27Å; F698-I870 HydrophobicContact CZ-CG2 3.83Å; Y817-I870 HydrophobicContact CD1-CD1 3.55Å; Y817-I870 HydrophobicContact CD2-CD1 4.13Å; Y817-I870 HydrophobicContact CE1-CD1 4.02Å; Y817-I870 HydrophobicContact CG-CD1 3.6Å; L821-I870 HydrophobicContact CG-CG2 4.4Å; H866-I870 HydrophobicContact CB-CD1 4.48Å; H866-I870 VanDerWaalsContact O-CG1 3.3Å; H866-I870 WeakPolarHBondContact O-CG1 3.48Å; H866-I870 PolarHBondContact O-N 2.68Å; I867-I870 PolarHBondContact O-N 2.81Å; I870-N872 VanDerWaalsContact C-N 3.32Å; I870-N872 PolarHBondContact O-N 3.4Å; I870-S873 PolarHBondContact O-N 3.32Å; I870-V874 HydrophobicContact CG2-CG2 4.01Å; I870-V874 WeakPolarHBondContact O-CB 3.39Å; I870-V874 WeakPolarHBondContact O-CG2 3.41Å; I870-V874 PolarHBondContact O-N 2.9Å
871	I	90.5	Very high	82.3	Confident	29 Å²	29	51.1 Å²	51.1	15%	0.149	28%	0.28	C	S	.	.	H	α-helix	trans	-54.2	-49.1	178.4	-69.4	165.6	0	0	0	111	S820 T823 L827 I867 K875	S820-I871 WeakPolarHBondContact O-CG1 3.4Å; T823-I871 HydrophobicContact CG2-CD1 4.2Å; T823-I871 HydrophobicContact CG2-CG1 4.46Å; T823-I871 HydrophobicContact CG2-CG2 4.45Å; L827-I871 HydrophobicContact CD1-CG2 3.89Å; I867-I871 HydrophobicContact CG2-CD1 3.9Å; I867-I871 VanDerWaalsContact O-CG1 3.28Å; I867-I871 WeakPolarHBondContact O-CG1 3.23Å; I867-I871 PolarHBondContact O-N 2.76Å; I871-K875 WeakPolarHBondContact O-CB 3.35Å; I871-K875 PolarHBondContact O-N 3.12Å
872	N	91.8	Very high	84.5	Confident	91 Å²	91	44.9 Å²	44.9	49%	0.487	25%	0.251	S	S	.	.	H	α-helix	trans	-67.1	-43.5	-179.2	-73.3	-24.7	0	0	0	112.2	G868 Q869 I870 K875 D876	G868-N872 PolarHBondContact O-N 2.95Å; G868-N872 PolarHBondContact O-ND2 3.44Å; Q869-N872 PolarHBondContact O-N 3.24Å; I870-N872 VanDerWaalsContact C-N 3.32Å; I870-N872 PolarHBondContact O-N 3.4Å; N872-K875 PolarHBondContact O-N 3.14Å; N872-D876 WeakPolarHBondContact O-CB 3.23Å; N872-D876 PolarHBondContact O-N 3.21Å
873	S	92.2	Very high	86.3	Confident	8 Å²	8	44.5 Å²	44.5	6%	0.056	24%	0.241	C	C	.	.	H	α-helix	trans	-66.1	-41.6	-178.1	-52.8	0	0	0	0	112	V689 T691 Q869 I870 D876 G877	V689-S873 WeakPolarHBondContact CG1-O 3.48Å; T691-S873 VanDerWaalsContact CA-OG 3.31Å; T691-S873 WeakPolarHBondContact CA-OG 3.28Å; Q869-S873 WeakPolarHBondContact O-CB 3.35Å; Q869-S873 PolarHBondContact O-N 3.33Å; Q869-S873 PolarHBondContact O-OG 3Å; I870-S873 PolarHBondContact O-N 3.32Å; S873-D876 PolarHBondContact O-N 2.88Å; S873-G877 PolarHBondContact O-N 3.36Å
874	V	92.4	Very high	87.7	Confident	2 Å²	2	42.7 Å²	42.7	1%	0.012	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-47.8	174.6	172.4	0	0	0	0	109.9	F698 L821 I870 D876 G877 L878	F698-V874 HydrophobicContact CD1-CG2 4.46Å; F698-V874 HydrophobicContact CD2-CG2 4.36Å; F698-V874 HydrophobicContact CE1-CG2 4.33Å; F698-V874 HydrophobicContact CE2-CG2 4.24Å; F698-V874 HydrophobicContact CG-CG2 4.48Å; F698-V874 HydrophobicContact CZ-CG2 4.23Å; L821-V874 HydrophobicContact CD2-CB 4.3Å; L821-V874 HydrophobicContact CD2-CG1 3.95Å; L821-V874 HydrophobicContact CD2-CG2 3.35Å; L821-V874 HydrophobicContact CG-CG2 4.08Å; I870-V874 HydrophobicContact CG2-CG2 4.01Å; I870-V874 WeakPolarHBondContact O-CB 3.39Å; I870-V874 WeakPolarHBondContact O-CG2 3.41Å; I870-V874 PolarHBondContact O-N 2.9Å; V874-D876 VanDerWaalsContact C-N 3.29Å; V874-D876 PolarHBondContact O-N 3.12Å; V874-G877 PolarHBondContact O-N 3.26Å; V874-L878 HydrophobicContact CG1-CD1 3.86Å; V874-L878 HydrophobicContact CG1-CG 4.18Å; V874-L878 WeakPolarHBondContact O-CB 3.5Å; V874-L878 VanDerWaalsContact O-CG 3.22Å; V874-L878 WeakPolarHBondContact O-CG 3.36Å; V874-L878 PolarHBondContact O-N 3.37Å
875	K	93.1	Very high	89	Confident	72 Å²	72	37.5 Å²	37.5	31%	0.313	20%	0.202	S	C	.	.	H	α-helix	trans	-55.9	-43.6	177.3	177.8	-172.2	170.1	-170.2	0	112	L827 R828 I871 N872 R879	L827-K875 HydrophobicContact CB-CD 4.47Å; R828-K875 HydrophobicContact CB-CG 4.49Å; I871-K875 WeakPolarHBondContact O-CB 3.35Å; I871-K875 PolarHBondContact O-N 3.12Å; N872-K875 PolarHBondContact O-N 3.14Å; K875-R879 WeakPolarHBondContact O-CB 3.44Å; K875-R879 PolarHBondContact O-N 3.27Å; K875-R879 VanDerWaalsContact O-N 3.12Å
876	D	92.5	Very high	89.9	Confident	76 Å²	76	36.5 Å²	36.5	41%	0.406	19%	0.192	S	C	.	.	H	α-helix	trans	-73.5	-37.5	178.8	-73.6	-21.8	0	0	0	112.4	N872 S873 V874 R879 L880	N872-D876 WeakPolarHBondContact O-CB 3.23Å; N872-D876 PolarHBondContact O-N 3.21Å; S873-D876 PolarHBondContact O-N 2.88Å; V874-D876 VanDerWaalsContact C-N 3.29Å; V874-D876 PolarHBondContact O-N 3.12Å; D876-R879 VanDerWaalsContact O-CB 3.31Å; D876-R879 WeakPolarHBondContact O-CB 3.12Å; D876-R879 PolarHBondContact O-N 2.77Å; D876-L880 WeakPolarHBondContact O-CG 3.45Å; D876-L880 PolarHBondContact O-N 2.81Å
877	G	92.8	Very high	90.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-67.8	-40	175.7	0	0	0	0	0	113.3	S873 V874 R879 L880 A881	S873-G877 PolarHBondContact O-N 3.36Å; V874-G877 PolarHBondContact O-N 3.26Å; G877-R879 VanDerWaalsContact C-N 3.3Å; G877-R879 PolarHBondContact O-N 3.38Å; G877-L880 PolarHBondContact O-N 3.49Å; G877-A881 WeakPolarHBondContact O-CB 3.34Å; G877-A881 PolarHBondContact O-N 3.05Å
878	L	94.4	Very high	91.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-36.2	172.1	-64.7	175.8	0	0	0	111.7	L700 F825 R828 F844 V874 A881 F882	L700-L878 HydrophobicContact CB-CD2 4.43Å; L700-L878 HydrophobicContact CD1-CD2 4.05Å; L700-L878 HydrophobicContact CD1-CG 4.12Å; L700-L878 HydrophobicContact CD2-CD2 4.33Å; F825-L878 HydrophobicContact CB-CD1 3.99Å; F825-L878 HydrophobicContact CD2-CD1 4.18Å; R828-L878 HydrophobicContact CB-CB 4.44Å; R828-L878 HydrophobicContact CB-CD1 4.4Å; R828-L878 HydrophobicContact CG-CB 4Å; F844-L878 HydrophobicContact CB-CD2 3.81Å; F844-L878 HydrophobicContact CD1-CB 4.21Å; F844-L878 HydrophobicContact CD1-CD2 3.45Å; F844-L878 VanDerWaalsContact CD1-CD2 3.45Å; F844-L878 HydrophobicContact CD1-CG 4.33Å; F844-L878 HydrophobicContact CE1-CB 4.09Å; F844-L878 HydrophobicContact CE1-CD2 4.2Å; F844-L878 HydrophobicContact CG-CD2 3.83Å; V874-L878 HydrophobicContact CG1-CD1 3.86Å; V874-L878 HydrophobicContact CG1-CG 4.18Å; V874-L878 WeakPolarHBondContact O-CB 3.5Å; V874-L878 VanDerWaalsContact O-CG 3.22Å; V874-L878 WeakPolarHBondContact O-CG 3.36Å; V874-L878 PolarHBondContact O-N 3.37Å; L878-A881 PolarHBondContact O-N 2.9Å; L878-F882 WeakPolarHBondContact O-CB 2.98Å; L878-F882 PolarHBondContact O-N 3.21Å
879	R	94	Very high	91.6	Very high	102 Å²	102	33.1 Å²	33.1	39%	0.385	16%	0.164	S	C	.	.	H	α-helix	trans	-60.3	-50.9	173.3	-177.1	-162.4	166.2	176.9	-7.6	111.1	P833 K875 D876 G877 A881 F882 E883	P833-R879 HydrophobicContact CB-CG 3.97Å; K875-R879 WeakPolarHBondContact O-CB 3.44Å; K875-R879 PolarHBondContact O-N 3.27Å; K875-R879 VanDerWaalsContact O-N 3.12Å; D876-R879 VanDerWaalsContact O-CB 3.31Å; D876-R879 WeakPolarHBondContact O-CB 3.12Å; D876-R879 PolarHBondContact O-N 2.77Å; G877-R879 VanDerWaalsContact C-N 3.3Å; G877-R879 PolarHBondContact O-N 3.38Å; R879-A881 VanDerWaalsContact C-N 3.34Å; R879-A881 PolarHBondContact O-N 3.16Å; R879-F882 PolarHBondContact O-N 2.91Å; R879-E883 IonicContact CZ-OE1 2.79Å; R879-E883 IonicContact NE-OE1 3.78Å; R879-E883 PolarHBondContact NE-OE1 3.15Å; R879-E883 IonicContact NH2-OE1 3.3Å; R879-E883 PolarHBondContact NH2-OE1 3.32Å; R879-E883 VanDerWaalsContact NH2-OE1 3.13Å; R879-E883 WeakPolarHBondContact O-CB 3.22Å; R879-E883 WeakPolarHBondContact O-CG 3.05Å; R879-E883 PolarHBondContact O-N 3.05Å
880	L	93.3	Very high	91.8	Very high	77 Å²	77	31.3 Å²	31.3	40%	0.403	16%	0.156	S	C	.	.	H	α-helix	trans	-64.8	-38.5	179.1	-69.3	173.2	0	0	0	111.9	I687 V689 D876 G877 F882 E883 A884	I687-L880 HydrophobicContact CB-CB 4.46Å; I687-L880 HydrophobicContact CG1-CB 4.2Å; I687-L880 HydrophobicContact CG2-CB 3.82Å; I687-L880 HydrophobicContact CG2-CD1 4.06Å; V689-L880 HydrophobicContact CG2-CD1 4.16Å; D876-L880 WeakPolarHBondContact O-CG 3.45Å; D876-L880 PolarHBondContact O-N 2.81Å; G877-L880 PolarHBondContact O-N 3.49Å; L880-F882 VanDerWaalsContact C-N 3.34Å; L880-E883 PolarHBondContact O-N 3.18Å; L880-A884 WeakPolarHBondContact O-CB 3.41Å; L880-A884 PolarHBondContact O-N 3.44Å
881	A	92.6	Very high	91.9	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.2	-40.2	175.9	0	0	0	0	0	111.9	I687 A702 G877 L878 R879	I687-A881 HydrophobicContact CG1-CB 4.28Å; A702-A881 HydrophobicContact CB-CB 4.11Å; G877-A881 WeakPolarHBondContact O-CB 3.34Å; G877-A881 PolarHBondContact O-N 3.05Å; L878-A881 PolarHBondContact O-N 2.9Å; R879-A881 VanDerWaalsContact C-N 3.34Å; R879-A881 PolarHBondContact O-N 3.16Å
882	F	93	Very high	92	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.6	-44.9	172.5	-172.3	-76.6	0	0	0	111.5	E661 I663 P833 I839 V842 F844 L878 R879 L880 A884 Q885 Q887	E661-F882 HydrophobicContact CB-CZ 4.03Å; I663-F882 HydrophobicContact CG2-CD1 3.96Å; I663-F882 HydrophobicContact CG2-CD2 3.72Å; I663-F882 HydrophobicContact CG2-CE1 3.87Å; I663-F882 HydrophobicContact CG2-CE2 3.62Å; I663-F882 HydrophobicContact CG2-CG 3.91Å; I663-F882 HydrophobicContact CG2-CZ 3.7Å; P833-F882 HydrophobicContact CG-CB 4.32Å; P833-F882 HydrophobicContact CG-CD1 3.18Å; P833-F882 HydrophobicContact CG-CE1 3.54Å; P833-F882 HydrophobicContact CG-CG 3.89Å; P833-F882 HydrophobicContact CG-CZ 4.5Å; I839-F882 HydrophobicContact CD1-CD2 3.98Å; I839-F882 HydrophobicContact CD1-CE2 4.04Å; I839-F882 HydrophobicContact CG1-CE2 4.19Å; I839-F882 HydrophobicContact CG2-CD2 4.33Å; I839-F882 HydrophobicContact CG2-CE2 3.74Å; V842-F882 HydrophobicContact CG2-CD2 4.45Å; V842-F882 HydrophobicContact CG2-CE2 4.01Å; F844-F882 HydrophobicContact CE1-CB 4.43Å; F844-F882 HydrophobicContact CZ-CD2 4.22Å; L878-F882 WeakPolarHBondContact O-CB 2.98Å; L878-F882 PolarHBondContact O-N 3.21Å; R879-F882 PolarHBondContact O-N 2.91Å; L880-F882 VanDerWaalsContact C-N 3.34Å; F882-A884 PolarHBondContact O-N 3.09Å; F882-Q885 PolarHBondContact O-N 3.45Å; F882-Q885 VanDerWaalsContact O-N 3.15Å; F882-Q887 HydrophobicContact CD1-CG 3.94Å; F882-Q887 HydrophobicContact CE1-CB 4.21Å; F882-Q887 HydrophobicContact CE1-CG 3.67Å
883	E	90.5	Very high	92	Very high	69 Å²	69	26.1 Å²	26.1	32%	0.322	13%	0.129	S	C	.	.	H	α-helix	trans	-65.5	-24.3	-179.6	-75.4	177.2	-174.7	0	0	113.3	P833 R879 L880 Q885 Q887	P833-E883 HydrophobicContact CB-CG 3.92Å; P833-E883 HydrophobicContact CG-CG 4.23Å; R879-E883 IonicContact CZ-OE1 2.79Å; R879-E883 IonicContact NE-OE1 3.78Å; R879-E883 PolarHBondContact NE-OE1 3.15Å; R879-E883 IonicContact NH2-OE1 3.3Å; R879-E883 PolarHBondContact NH2-OE1 3.32Å; R879-E883 VanDerWaalsContact NH2-OE1 3.13Å; R879-E883 WeakPolarHBondContact O-CB 3.22Å; R879-E883 WeakPolarHBondContact O-CG 3.05Å; R879-E883 PolarHBondContact O-N 3.05Å; L880-E883 PolarHBondContact O-N 3.18Å; E883-Q885 VanDerWaalsContact C-N 3.3Å; E883-Q887 PolarHBondContact O-NE2 3.22Å
884	A	87.8	Confident	91.9	Very high	27 Å²	27	26.2 Å²	26.2	22%	0.223	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-22.2	175.9	0	0	0	0	0	113.4	I687 L880 F882	I687-A884 HydrophobicContact CD1-CB 4.31Å; L880-A884 WeakPolarHBondContact O-CB 3.41Å; L880-A884 PolarHBondContact O-N 3.44Å; F882-A884 PolarHBondContact O-N 3.09Å
885	Q	88.2	Confident	91.8	Very high	21 Å²	21	27.8 Å²	27.8	10%	0.098	14%	0.138	C	C	.	.	S	Bend	trans	-91.3	157.9	177	-60.8	-58.5	-37.7	0	0	111.1	I663 A702 F882 E883 Q887	I663-Q885 HydrophobicContact CB-CB 3.91Å; I663-Q885 HydrophobicContact CD1-CB 4.08Å; I663-Q885 HydrophobicContact CD1-CG 3.91Å; I663-Q885 HydrophobicContact CG2-CB 3.76Å; A702-Q885 WeakPolarHBondContact O-CG 3.23Å; F882-Q885 PolarHBondContact O-N 3.45Å; F882-Q885 VanDerWaalsContact O-N 3.15Å; E883-Q885 VanDerWaalsContact C-N 3.3Å; Q885-Q887 WeakPolarHBondContact O-CG 3.29Å; Q885-Q887 PolarHBondContact O-N 3.47Å
886	P	88.5	Confident	91.7	Very high	28 Å²	28	24.4 Å²	24.4	18%	0.182	12%	0.123	C	C	.	.	P	Polyproline II helix	trans	-65	123	171.1	-5.7	15	0	0	0	111	I663 I664 P666	I663-P886 WeakPolarHBondContact CA-O 3.44Å; I664-P886 HydrophobicContact CD1-CB 4.46Å; I664-P886 HydrophobicContact CG1-CB 3.87Å; I664-P886 HydrophobicContact CG1-CG 4.43Å; I664-P886 PolarHBondContact N-O 3.1Å; I664-P886 WeakPolarHBondContact O-CD 3.49Å; P666-P886 HydrophobicContact CB-CG 4.35Å; P666-P886 HydrophobicContact CG-CG 4.33Å
887	Q	91.6	Very high	91.4	Very high	22 Å²	22	21.7 Å²	21.7	10%	0.103	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	143.8	-171.4	-56.6	164.2	51	0	0	110.8	I663 M834 F882 E883 Q885 F974	I663-Q887 HydrophobicContact CG2-CG 4.49Å; M834-Q887 HydrophobicContact CE-CB 4.14Å; M834-Q887 HydrophobicContact CG-CB 4.49Å; M834-Q887 HydrophobicContact SD-CB 3.67Å; F882-Q887 HydrophobicContact CD1-CG 3.94Å; F882-Q887 HydrophobicContact CE1-CB 4.21Å; F882-Q887 HydrophobicContact CE1-CG 3.67Å; E883-Q887 PolarHBondContact O-NE2 3.22Å; Q885-Q887 WeakPolarHBondContact O-CG 3.29Å; Q885-Q887 PolarHBondContact O-N 3.47Å; Q887-F974 HydrophobicContact CB-CE2 4.36Å
888	R	92.9	Very high	91.2	Very high	25 Å²	25	21.7 Å²	21.7	9%	0.094	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	148	175.5	-66	-64.2	-178.6	-91.7	3.3	111.4	T662 I664 M834 I968 F969 P970 D972	T662-R888 HydrophobicContact CG2-CB 4.03Å; T662-R888 PolarHBondContact N-O 3.01Å; T662-R888 PolarHBondContact O-N 3.25Å; I664-R888 HydrophobicContact CD1-CG 3.86Å; I664-R888 HydrophobicContact CG1-CG 4.02Å; I664-R888 HydrophobicContact CG2-CB 4.36Å; I664-R888 HydrophobicContact CG2-CG 3.77Å; M834-R888 WeakPolarHBondContact CE-O 3.4Å; R888-I968 HydrophobicContact CB-CG2 3.57Å; R888-I968 HydrophobicContact CG-CG2 3.97Å; R888-F969 WeakPolarHBondContact CD-O 3.48Å; R888-P970 PolarHBondContact NE-O 3.42Å; R888-D972 IonicContact CZ-OD2 3.56Å; R888-D972 IonicContact NH1-OD1 3.58Å; R888-D972 IonicContact NH1-OD2 3.23Å; R888-D972 PolarHBondContact NH1-OD2 3.46Å; R888-D972 IonicContact NH2-OD2 2.82Å
889	L	92.9	Very high	90.5	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.01	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	143.6	166.7	-72.8	179.8	0	0	0	109.3	M834 F969 V1000	M834-L889 HydrophobicContact CE-CD2 4.03Å; L889-F969 HydrophobicContact CB-CB 4.41Å; L889-F969 WeakPolarHBondContact O-CB 3.5Å; L889-F969 PolarHBondContact O-N 3.37Å; L889-V1000 HydrophobicContact CD1-CG2 3.65Å; L889-V1000 HydrophobicContact CD2-CG2 4.25Å; L889-V1000 HydrophobicContact CG-CG2 4.07Å
890	V	93.1	Very high	90	Very high	6 Å²	6	18.3 Å²	18.3	4%	0.036	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	129.8	169.7	-173.7	0	0	0	0	107.5	A660 T662 W966 E967 I968	A660-V890 HydrophobicContact CB-CB 4.07Å; A660-V890 PolarHBondContact N-O 2.78Å; A660-V890 PolarHBondContact O-N 2.83Å; T662-V890 HydrophobicContact CG2-CG2 3.39Å; V890-W966 HydrophobicContact CG1-CB 3.75Å; V890-W966 HydrophobicContact CG1-CE3 4.21Å; V890-E967 WeakPolarHBondContact CA-O 3.4Å; V890-E967 WeakPolarHBondContact CG1-O 3.49Å; V890-I968 HydrophobicContact CG2-CG1 4.31Å
891	M	91.6	Very high	89.4	Confident	6 Å²	6	16.4 Å²	16.4	3%	0.03	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	146.8	-177.9	55	178.1	44.7	0	0	111.3	F659 M893 P938 W966 E967 F969 Y999	F659-M891 HydrophobicContact CD1-CB 4.17Å; F659-M891 HydrophobicContact CE1-CB 4.12Å; F659-M891 HydrophobicContact CE1-CE 4.26Å; M891-M893 HydrophobicContact CG-SD 4.04Å; M891-M893 HydrophobicContact SD-SD 4.16Å; M891-P938 HydrophobicContact SD-CB 3.83Å; M891-P938 HydrophobicContact SD-CG 4.03Å; M891-W966 WeakPolarHBondContact O-CA 3.46Å; M891-E967 PolarHBondContact N-O 2.84Å; M891-E967 PolarHBondContact O-N 2.6Å; M891-F969 HydrophobicContact CE-CB 3.96Å; M891-F969 HydrophobicContact CE-CD1 4.35Å; M891-F969 HydrophobicContact CE-CD2 3.37Å; M891-F969 HydrophobicContact CE-CE2 3.95Å; M891-F969 HydrophobicContact CE-CG 3.64Å; M891-F969 HydrophobicContact CG-CB 4.47Å; M891-F969 HydrophobicContact SD-CB 4.37Å; M891-F969 HydrophobicContact SD-CD2 3.63Å; M891-F969 HydrophobicContact SD-CE2 4.33Å; M891-F969 HydrophobicContact SD-CG 4.28Å; M891-Y999 HydrophobicContact CE-CD2 4.18Å; M891-Y999 HydrophobicContact CE-CE2 3.81Å
892	P	91.8	Very high	88.9	Confident	1 Å²	1	18.3 Å²	18.3	1%	0.006	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	140.1	172.8	29.5	-29.4	0	0	0	109.6	I583 V657 P658 V939 F963 W966	I583-P892 HydrophobicContact CG2-CB 4.4Å; I583-P892 HydrophobicContact CG2-CG 4.24Å; V657-P892 HydrophobicContact CG1-CG 3.32Å; P658-P892 VanDerWaalsContact O-CD 3.29Å; P658-P892 WeakPolarHBondContact O-CD 3.48Å; P892-V939 HydrophobicContact CB-CG2 3.9Å; P892-V939 HydrophobicContact CG-CB 4.03Å; P892-V939 HydrophobicContact CG-CG2 3.97Å; P892-V939 VanDerWaalsContact O-CG2 3.26Å; P892-V939 WeakPolarHBondContact O-CG2 3.3Å; P892-V939 PolarHBondContact O-N 2.89Å; P892-F963 HydrophobicContact CB-CD2 4.36Å; P892-F963 HydrophobicContact CB-CE2 3.73Å; P892-W966 HydrophobicContact CB-CD2 4.33Å; P892-W966 HydrophobicContact CB-CE3 4.05Å; P892-W966 HydrophobicContact CB-CH2 4.12Å; P892-W966 HydrophobicContact CB-CZ2 4.38Å; P892-W966 HydrophobicContact CB-CZ3 3.96Å; P892-W966 HydrophobicContact CG-CE3 4.46Å; P892-W966 HydrophobicContact CG-CH2 4.22Å; P892-W966 HydrophobicContact CG-CZ3 3.98Å
893	M	92.1	Very high	88.6	Confident	4 Å²	4	26.7 Å²	26.7	2%	0.02	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	135.2	-179.4	-58.9	-60.2	-73.5	0	0	110.6	M891 P938 S964 H965 E967	M891-M893 HydrophobicContact CG-SD 4.04Å; M891-M893 HydrophobicContact SD-SD 4.16Å; M893-P938 HydrophobicContact CE-CG 3.86Å; M893-P938 VanDerWaalsContact SD-CA 3.6Å; M893-P938 HydrophobicContact SD-CB 4.06Å; M893-P938 HydrophobicContact SD-CG 3.96Å; M893-S964 PolarHBondContact O-N 3.33Å; M893-S964 VanDerWaalsContact O-N 3.09Å; M893-H965 PolarHBondContact N-O 2.74Å; M893-E967 WeakPolarHBondContact CE-OE2 3.48Å; M893-E967 HydrophobicContact CG-CB 3.47Å; M893-E967 VanDerWaalsContact CG-CB 3.47Å; M893-E967 HydrophobicContact SD-CB 4.2Å
894	Y	91	Very high	88.5	Confident	10 Å²	10	23.7 Å²	23.7	4%	0.039	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	138	164.6	-70.9	-39.7	0	0	0	110.2	V628 S936 L937 V939 S942 L961 V962 F963	V628-Y894 PolarHBondContact O-OH 3.33Å; Y894-S936 CarbonylContact O-C 3.57Å; Y894-S936 WeakPolarHBondContact O-CA 3.35Å; Y894-L937 PolarHBondContact N-O 3.32Å; Y894-L937 PolarHBondContact O-N 3.48Å; Y894-V939 HydrophobicContact CD1-CG2 3.79Å; Y894-V939 HydrophobicContact CD2-CB 4.25Å; Y894-V939 HydrophobicContact CD2-CG1 4.41Å; Y894-V939 HydrophobicContact CD2-CG2 3.74Å; Y894-V939 HydrophobicContact CE1-CG2 3.72Å; Y894-V939 HydrophobicContact CE2-CB 3.97Å; Y894-V939 HydrophobicContact CE2-CG1 3.64Å; Y894-V939 HydrophobicContact CE2-CG2 3.67Å; Y894-V939 HydrophobicContact CG-CG2 3.8Å; Y894-S942 WeakPolarHBondContact CE2-OG 3.49Å; Y894-L961 HydrophobicContact CD2-CB 4.07Å; Y894-L961 HydrophobicContact CD2-CD1 4.19Å; Y894-L961 HydrophobicContact CD2-CD2 4.44Å; Y894-L961 HydrophobicContact CD2-CG 4.47Å; Y894-L961 HydrophobicContact CG-CB 4.18Å; Y894-V962 CarbonylContact C-O 3.56Å; Y894-V962 VanDerWaalsContact CA-O 3.3Å; Y894-V962 WeakPolarHBondContact CA-O 3.38Å; Y894-F963 HydrophobicContact CD1-CB 4.23Å; Y894-F963 HydrophobicContact CE1-CB 4.13Å
895	T	89.8	Confident	88.6	Confident	36 Å²	36	23.5 Å²	23.5	22%	0.221	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	124.9	154.7	-64	0	0	0	0	107.3	F920 V962 S964	T895-F920 HydrophobicContact CG2-CZ 4.13Å; T895-V962 PolarHBondContact N-O 3.47Å; T895-V962 PolarHBondContact O-N 3Å; T895-S964 WeakPolarHBondContact OG1-CB 3.42Å; T895-S964 PolarHBondContact OG1-OG 3.2Å; T895-S964 VanDerWaalsContact OG1-OG 3.04Å
896	C	90.5	Very high	88.7	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	113.9	176.8	-175.5	0	0	0	0	108.7	I898 C934 A935 L937 F945 Q960 L961	C896-I898 WeakPolarHBondContact SG-CG1 3.36Å; C896-C934 WeakPolarHBondContact O-CA 3.35Å; C896-A935 PolarHBondContact N-O 2.66Å; C896-A935 PolarHBondContact O-N 3.4Å; C896-L937 HydrophobicContact CB-CB 4.48Å; C896-F945 WeakPolarHBondContact SG-CE1 3.46Å; C896-Q960 WeakPolarHBondContact CA-O 3.39Å; C896-L961 HydrophobicContact CB-CD2 3.74Å
897	T	87.3	Confident	88.9	Confident	19 Å²	19	28.3 Å²	28.3	12%	0.117	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	123.5	170.7	-55.3	0	0	0	0	108.7	P164 E932 V933 Q960	P164-T897 HydrophobicContact CG-CG2 3.54Å; T897-E932 HydrophobicContact CG2-CG 3.71Å; T897-V933 WeakPolarHBondContact CA-O 3.35Å; T897-Q960 PolarHBondContact N-O 3.42Å; T897-Q960 PolarHBondContact O-N 2.99Å
898	I	87.8	Confident	88.9	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	127.8	-176.4	-52.5	174.1	0	0	0	108.3	C896 A900 V908 L912 E932 V933 F945 L949 A957 P959	C896-I898 WeakPolarHBondContact SG-CG1 3.36Å; I898-A900 HydrophobicContact CG2-CB 4.48Å; I898-V908 HydrophobicContact CB-CG1 4.45Å; I898-V908 HydrophobicContact CD1-CG1 3.5Å; I898-V908 VanDerWaalsContact CD1-CG1 3.5Å; I898-V908 HydrophobicContact CG2-CG1 4.03Å; I898-V908 HydrophobicContact CG2-CG2 4.44Å; I898-L912 HydrophobicContact CD1-CD1 4Å; I898-L912 HydrophobicContact CD1-CD2 4.18Å; I898-L912 HydrophobicContact CD1-CG 4.25Å; I898-E932 WeakPolarHBondContact O-CA 3.38Å; I898-V933 HydrophobicContact CB-CB 4.37Å; I898-V933 PolarHBondContact N-O 3.24Å; I898-V933 PolarHBondContact O-N 2.92Å; I898-F945 HydrophobicContact CD1-CE1 4.44Å; I898-F945 HydrophobicContact CD1-CZ 3.95Å; I898-L949 HydrophobicContact CD1-CD2 3.96Å; I898-L949 HydrophobicContact CG1-CD2 4.3Å; I898-L949 HydrophobicContact CG2-CD2 3.9Å; I898-A957 HydrophobicContact CG2-CB 4.09Å; I898-P959 HydrophobicContact CG1-CB 4.14Å
899	Q	80.7	Confident	88.9	Confident	31 Å²	31	28.3 Å²	28.3	15%	0.145	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129	168.9	-65.2	-177.8	-9.4	0	0	108.9	C163 K925 F931 E932 A957	C163-Q899 PolarHBondContact SG-NE2 3.05Å; C163-Q899 VanDerWaalsContact SG-NE2 3.43Å; Q899-K925 VanDerWaalsContact NE2-NZ 3.16Å; Q899-F931 WeakPolarHBondContact CA-O 3.33Å; Q899-E932 PolarHBondContact NE2-OE1 2.69Å; Q899-A957 WeakPolarHBondContact O-CA 3.4Å
900	A	82.4	Confident	88.9	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	150.1	-172.6	0	0	0	0	0	111.7	I898 V904 V908 L930 F931 A957	I898-A900 HydrophobicContact CG2-CB 4.48Å; A900-V904 HydrophobicContact CB-CG2 3.83Å; A900-V908 HydrophobicContact CB-CG2 4.02Å; A900-L930 CarbonylContact O-C 3.55Å; A900-L930 WeakPolarHBondContact O-CA 3.44Å; A900-F931 PolarHBondContact N-O 3.32Å; A900-F931 PolarHBondContact O-N 3.39Å; A900-A957 HydrophobicContact CB-CB 4.22Å
901	T	81	Confident	88.9	Confident	37 Å²	37	30.2 Å²	30.2	23%	0.227	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	157.3	168.2	60.4	0	0	0	0	110.7	E903 V904 L905 L930	T901-E903 PolarHBondContact O-N 2.74Å; T901-E903 VanDerWaalsContact O-N 3.13Å; T901-V904 WeakPolarHBondContact O-CG2 3.39Å; T901-V904 PolarHBondContact O-N 2.99Å; T901-V904 VanDerWaalsContact O-N 3.13Å; T901-L905 PolarHBondContact O-N 3.3Å; T901-L930 HydrophobicContact CG2-CD2 3.55Å
902	G	83.2	Confident	89	Confident	41 Å²	41	29.9 Å²	29.9	42%	0.423	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-30.7	178.2	0	0	0	0	0	114.1	V904	G902-V904 VanDerWaalsContact C-N 3.33Å; G902-V904 PolarHBondContact O-N 3.38Å
903	E	85.4	Confident	89	Confident	175 Å²	175	35.1 Å²	35.1	82%	0.818	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-30.6	179.7	-61.8	-177.8	178.1	0	0	113.8	T901	T901-E903 PolarHBondContact O-N 2.74Å; T901-E903 VanDerWaalsContact O-N 3.13Å
904	V	88.1	Confident	88.9	Confident	6 Å²	6	43 Å²	43	4%	0.036	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-8.6	-176.1	-59.4	0	0	0	0	113.2	A900 T901 G902 G906 K907 V908 A953 L956	A900-V904 HydrophobicContact CB-CG2 3.83Å; T901-V904 WeakPolarHBondContact O-CG2 3.39Å; T901-V904 PolarHBondContact O-N 2.99Å; T901-V904 VanDerWaalsContact O-N 3.13Å; G902-V904 VanDerWaalsContact C-N 3.33Å; G902-V904 PolarHBondContact O-N 3.38Å; V904-G906 VanDerWaalsContact C-N 3.34Å; V904-G906 PolarHBondContact O-N 3.09Å; V904-K907 WeakPolarHBondContact O-CA 3.47Å; V904-K907 VanDerWaalsContact O-CB 3.29Å; V904-K907 WeakPolarHBondContact O-CB 3.44Å; V904-K907 PolarHBondContact O-N 3.19Å; V904-V908 PolarHBondContact O-N 3.33Å; V904-V908 VanDerWaalsContact O-N 3.12Å; V904-A953 HydrophobicContact CB-CB 4.29Å; V904-A953 HydrophobicContact CG2-CB 4.48Å; V904-L956 HydrophobicContact CG1-CB 4.24Å; V904-L956 HydrophobicContact CG1-CD1 4.02Å; V904-L956 HydrophobicContact CG2-CB 4.35Å
905	L	89.8	Confident	88.9	Confident	24 Å²	24	44.4 Å²	44.4	13%	0.126	24%	0.242	C	C	.	.	H	α-helix	trans	-52.1	-47.3	-176.5	-173.4	67.9	0	0	0	112.5	T901 K907 V908 H909 E922 F931 V933	T901-L905 PolarHBondContact O-N 3.3Å; L905-K907 PolarHBondContact O-N 3.22Å; L905-V908 WeakPolarHBondContact O-CA 3.47Å; L905-V908 VanDerWaalsContact O-CB 3.29Å; L905-V908 WeakPolarHBondContact O-CB 3.31Å; L905-V908 PolarHBondContact O-N 3.44Å; L905-H909 PolarHBondContact O-CD2 2.99Å; L905-H909 PolarHBondContact O-N 3.42Å; L905-E922 WeakPolarHBondContact CD2-OE1 3.42Å; L905-F931 HydrophobicContact CD1-CB 4.22Å; L905-F931 HydrophobicContact CD2-CD1 4.33Å; L905-F931 HydrophobicContact CD2-CG 4.4Å; L905-V933 HydrophobicContact CD1-CG2 3.44Å; L905-V933 VanDerWaalsContact CD1-CG2 3.44Å
906	G	91.2	Very high	88.8	Confident	56 Å²	56	44.7 Å²	44.7	58%	0.577	25%	0.253	S	S	*	.	H	α-helix	trans	-58.4	-32.5	176.9	0	0	0	0	0	113.8	V904 A910	V904-G906 VanDerWaalsContact C-N 3.34Å; V904-G906 PolarHBondContact O-N 3.09Å; G906-A910 WeakPolarHBondContact O-CB 3.39Å; G906-A910 PolarHBondContact O-N 2.98Å; G906-A910 VanDerWaalsContact O-N 3.15Å
907	K	92.3	Very high	88.7	Confident	94 Å²	94	45 Å²	45	41%	0.409	26%	0.255	S	S	.	.	H	α-helix	trans	-72.1	-36.6	174.1	-55.1	-178	-177	171.4	0	111.4	V904 L905 A910 V911 R952	V904-K907 WeakPolarHBondContact O-CA 3.47Å; V904-K907 VanDerWaalsContact O-CB 3.29Å; V904-K907 WeakPolarHBondContact O-CB 3.44Å; V904-K907 PolarHBondContact O-N 3.19Å; L905-K907 PolarHBondContact O-N 3.22Å; K907-A910 PolarHBondContact O-N 2.88Å; K907-V911 WeakPolarHBondContact O-CG2 3.42Å; K907-V911 PolarHBondContact O-N 2.87Å; K907-V911 VanDerWaalsContact O-N 3.14Å; K907-R952 WeakPolarHBondContact CD-O 3.47Å; K907-R952 PolarHBondContact NZ-O 3.3Å
908	V	91.3	Very high	89	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-60.8	-52.5	175.9	179.8	0	0	0	0	110.2	I898 A900 V904 L905 A910 V911 L912 L949 A957	I898-V908 HydrophobicContact CB-CG1 4.45Å; I898-V908 HydrophobicContact CD1-CG1 3.5Å; I898-V908 VanDerWaalsContact CD1-CG1 3.5Å; I898-V908 HydrophobicContact CG2-CG1 4.03Å; I898-V908 HydrophobicContact CG2-CG2 4.44Å; A900-V908 HydrophobicContact CB-CG2 4.02Å; V904-V908 PolarHBondContact O-N 3.33Å; V904-V908 VanDerWaalsContact O-N 3.12Å; L905-V908 WeakPolarHBondContact O-CA 3.47Å; L905-V908 VanDerWaalsContact O-CB 3.29Å; L905-V908 WeakPolarHBondContact O-CB 3.31Å; L905-V908 PolarHBondContact O-N 3.44Å; V908-A910 VanDerWaalsContact C-N 3.29Å; V908-A910 PolarHBondContact O-N 3.46Å; V908-V911 PolarHBondContact O-N 3Å; V908-V911 VanDerWaalsContact O-N 3.1Å; V908-L912 HydrophobicContact CG1-CD1 4.03Å; V908-L912 PolarHBondContact O-N 3.3Å; V908-L949 HydrophobicContact CB-CD1 4.36Å; V908-L949 HydrophobicContact CG1-CD1 4.29Å; V908-L949 HydrophobicContact CG2-CD1 4.12Å; V908-A957 HydrophobicContact CG2-CB 4.05Å
909	H	93.3	Very high	89.2	Confident	47 Å²	47	51.5 Å²	51.5	22%	0.218	29%	0.286	C	S	.	.	H	α-helix	trans	-59.2	-39.5	176.8	-70.9	-85.8	0	0	0	112.2	L905 V911 L912 N913 E922	L905-H909 PolarHBondContact O-CD2 2.99Å; L905-H909 PolarHBondContact O-N 3.42Å; H909-V911 VanDerWaalsContact C-N 3.29Å; H909-V911 PolarHBondContact O-N 2.65Å; H909-L912 PolarHBondContact O-N 3.32Å; H909-N913 WeakPolarHBondContact O-CB 3.42Å; H909-N913 VanDerWaalsContact O-CG 3.3Å; H909-N913 PolarHBondContact O-N 3Å; H909-E922 IonicContact CE1-OE2 3.23Å; H909-E922 PolarHBondContact CE1-OE2 2.92Å; H909-E922 IonicContact NE2-OE2 2.65Å; H909-E922 PolarHBondContact NE2-OE2 3.05Å
910	A	93.3	Very high	89.8	Confident	47 Å²	47	56 Å²	56	39%	0.388	31%	0.305	S	S	.	.	H	α-helix	trans	-64.2	-30	177.9	0	0	0	0	0	113.7	G906 K907 V908 R914	G906-A910 WeakPolarHBondContact O-CB 3.39Å; G906-A910 PolarHBondContact O-N 2.98Å; G906-A910 VanDerWaalsContact O-N 3.15Å; K907-A910 PolarHBondContact O-N 2.88Å; V908-A910 VanDerWaalsContact C-N 3.29Å; V908-A910 PolarHBondContact O-N 3.46Å; A910-R914 WeakPolarHBondContact O-CB 3.33Å
911	V	93	Very high	90.2	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-78.2	-45.2	173.3	-177.1	0	0	0	0	110.4	K907 V908 H909 R914 R915 F945 E948 L949 R952	K907-V911 WeakPolarHBondContact O-CG2 3.42Å; K907-V911 PolarHBondContact O-N 2.87Å; K907-V911 VanDerWaalsContact O-N 3.14Å; V908-V911 PolarHBondContact O-N 3Å; V908-V911 VanDerWaalsContact O-N 3.1Å; H909-V911 VanDerWaalsContact C-N 3.29Å; H909-V911 PolarHBondContact O-N 2.65Å; V911-R914 PolarHBondContact O-N 3.2Å; V911-R915 PolarHBondContact O-N 3.25Å; V911-F945 HydrophobicContact CB-CE2 4.38Å; V911-F945 HydrophobicContact CG1-CD2 3.72Å; V911-F945 HydrophobicContact CG1-CE2 3.56Å; V911-E948 HydrophobicContact CG1-CG 4.19Å; V911-E948 HydrophobicContact CG2-CG 4.48Å; V911-L949 HydrophobicContact CB-CD1 4.35Å; V911-L949 HydrophobicContact CG2-CD1 4.31Å; V911-R952 HydrophobicContact CG2-CG 4.42Å
912	L	93.4	Very high	90.6	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-58.9	-52.3	179.1	-75.4	172.5	0	0	0	111.8	I898 V908 H909 R914 R915 G916 G917 V919 V933 A935 F945	I898-L912 HydrophobicContact CD1-CD1 4Å; I898-L912 HydrophobicContact CD1-CD2 4.18Å; I898-L912 HydrophobicContact CD1-CG 4.25Å; V908-L912 HydrophobicContact CG1-CD1 4.03Å; V908-L912 PolarHBondContact O-N 3.3Å; H909-L912 PolarHBondContact O-N 3.32Å; L912-R914 VanDerWaalsContact C-N 3.27Å; L912-R914 PolarHBondContact O-N 2.88Å; L912-R915 CarbonylContact O-C 3.6Å; L912-R915 PolarHBondContact O-N 3.34Å; L912-R915 VanDerWaalsContact O-N 3.07Å; L912-G916 PolarHBondContact O-N 3.26Å; L912-G917 PolarHBondContact O-N 3.09Å; L912-V919 HydrophobicContact CD1-CG2 3.83Å; L912-V933 HydrophobicContact CD1-CG1 4.25Å; L912-A935 HydrophobicContact CD1-CB 3.91Å; L912-A935 HydrophobicContact CD2-CB 4.04Å; L912-F945 HydrophobicContact CD2-CE2 3.94Å; L912-F945 HydrophobicContact CD2-CZ 3.67Å; L912-F945 HydrophobicContact CG-CE2 4.49Å; L912-F945 HydrophobicContact CG-CZ 4.38Å
913	N	92.1	Very high	90.8	Very high	110 Å²	110	66.1 Å²	66.1	59%	0.588	33%	0.334	S	S	*	.	H	α-helix	trans	-61.2	-36.1	-178.2	-71.2	-10.6	0	0	0	112.2	H909 R915 G916	H909-N913 WeakPolarHBondContact O-CB 3.42Å; H909-N913 VanDerWaalsContact O-CG 3.3Å; H909-N913 PolarHBondContact O-N 3Å; N913-R915 VanDerWaalsContact C-N 3.28Å; N913-R915 PolarHBondContact O-N 2.98Å; N913-G916 PolarHBondContact O-N 3.32Å
914	R	90.5	Very high	90.7	Very high	169 Å²	169	61.2 Å²	61.2	64%	0.638	31%	0.313	S	S	*	.	H	α-helix	trans	-63.9	-34.5	177.9	-175.4	-177.4	-60.8	-161.2	-1.1	112.5	A910 V911 L912 G916	A910-R914 WeakPolarHBondContact O-CB 3.33Å; V911-R914 PolarHBondContact O-N 3.2Å; L912-R914 VanDerWaalsContact C-N 3.27Å; L912-R914 PolarHBondContact O-N 2.88Å; R914-G916 VanDerWaalsContact C-N 3.35Å
915	R	90.3	Very high	89.9	Confident	40 Å²	40	62.2 Å²	62.2	15%	0.151	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	14.8	-178.8	-72.7	173.5	175.2	-102.3	6.2	112.7	V911 L912 N913 G917 L937 E941 F943 E948	V911-R915 PolarHBondContact O-N 3.25Å; L912-R915 CarbonylContact O-C 3.6Å; L912-R915 PolarHBondContact O-N 3.34Å; L912-R915 VanDerWaalsContact O-N 3.07Å; N913-R915 VanDerWaalsContact C-N 3.28Å; N913-R915 PolarHBondContact O-N 2.98Å; R915-G917 VanDerWaalsContact C-N 3.29Å; R915-G917 PolarHBondContact O-N 3.02Å; R915-L937 HydrophobicContact CB-CD1 3.85Å; R915-E941 HydrophobicContact CB-CB 4.1Å; R915-E941 WeakPolarHBondContact CD-O 3.41Å; R915-E941 PolarHBondContact NH1-O 2.85Å; R915-E941 WeakPolarHBondContact O-CB 3.34Å; R915-F943 PolarHBondContact NH1-O 3.11Å; R915-F943 PolarHBondContact NH2-O 2.77Å; R915-E948 IonicContact CZ-OE2 3.2Å; R915-E948 VanDerWaalsContact CZ-OE2 3.23Å; R915-E948 IonicContact NE-OE2 3.13Å; R915-E948 PolarHBondContact NE-OE2 2.75Å; R915-E948 IonicContact NH2-OE2 3.18Å; R915-E948 PolarHBondContact NH2-OE2 3.29Å
916	G	87.3	Confident	88.4	Confident	43 Å²	43	67.3 Å²	67.3	44%	0.443	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.2	20.3	178.3	0	0	0	0	0	114.4	L912 N913 R914	L912-G916 PolarHBondContact O-N 3.26Å; N913-G916 PolarHBondContact O-N 3.32Å; R914-G916 VanDerWaalsContact C-N 3.35Å
917	G	89.1	Confident	86.7	Confident	5 Å²	5	66.4 Å²	66.4	5%	0.052	33%	0.329	C	S	.	.			trans	-75	140.8	177	0	0	0	0	0	112.5	L912 R915 S936	L912-G917 PolarHBondContact O-N 3.09Å; R915-G917 VanDerWaalsContact C-N 3.29Å; R915-G917 PolarHBondContact O-N 3.02Å; G917-S936 CarbonylContact C-O 3.53Å; G917-S936 WeakPolarHBondContact CA-O 3.44Å
918	K	92.4	Very high	85.3	Confident	107 Å²	107	62.6 Å²	62.6	47%	0.465	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	116.7	178.2	-59.3	174.2	-176.3	170.8	0	109.8	A935 S936 E967	K918-A935 CarbonylContact O-C 3.54Å; K918-A935 WeakPolarHBondContact O-CA 3.3Å; K918-A935 WeakPolarHBondContact O-CB 3.34Å; K918-S936 PolarHBondContact N-O 3.23Å; K918-S936 PolarHBondContact O-N 2.84Å; K918-E967 IonicContact NZ-OE1 2.74Å; K918-E967 PolarHBondContact NZ-OE1 3.43Å
919	V	93.7	Very high	84.2	Confident	49 Å²	49	68.2 Å²	68.2	30%	0.297	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	127.4	174.9	-178.1	0	0	0	0	108.8	L912 V933 A935	L912-V919 HydrophobicContact CD1-CG2 3.83Å; V919-V933 HydrophobicContact CG1-CG1 3.81Å; V919-V933 HydrophobicContact CG2-CG1 3.98Å; V919-A935 HydrophobicContact CG2-CB 4.05Å
920	F	92.6	Very high	83.4	Confident	126 Å²	126	67.6 Å²	67.6	55%	0.553	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.1	-14.7	178.7	60.6	-99.8	0	0	0	113.4	T895 C934 A935	T895-F920 HydrophobicContact CG2-CZ 4.13Å; F920-C934 HydrophobicContact CD2-CB 4.45Å; F920-C934 HydrophobicContact CE1-CB 4.49Å; F920-C934 HydrophobicContact CE2-CB 3.79Å; F920-C934 HydrophobicContact CZ-CB 3.82Å; F920-C934 PolarHBondContact N-O 3.32Å; F920-A935 VanDerWaalsContact CE1-C 3.49Å
921	R	90.4	Very high	82.9	Confident	119 Å²	119	67.8 Å²	67.8	45%	0.449	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	134.1	175.1	173.7	-178.2	-175.3	-165.1	-2.7	109.8	E923 C934	R921-E923 HydrophobicContact CG-CG 4.26Å; R921-E923 IonicContact CZ-OE1 3.63Å; R921-E923 VanDerWaalsContact CZ-OE1 3.24Å; R921-E923 IonicContact CZ-OE2 3.93Å; R921-E923 IonicContact NE-OE1 3.6Å; R921-E923 PolarHBondContact NE-OE1 3.13Å; R921-E923 IonicContact NE-OE2 2.67Å; R921-E923 PolarHBondContact NE-OE2 2.79Å; R921-E923 IonicContact NH2-OE1 3.53Å; R921-E923 PolarHBondContact NH2-OE1 3.37Å; R921-E923 IonicContact NH2-OE2 3.57Å; R921-E923 PolarHBondContact NH2-OE2 2.88Å; R921-C934 HydrophobicContact CB-CB 4.04Å; R921-C934 PolarHBondContact N-O 2.76Å; R921-C934 PolarHBondContact O-N 2.96Å
922	E	90	Very high	82.5	Confident	84 Å²	84	69.1 Å²	69.1	39%	0.393	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	117.9	176.4	-177.4	179.7	153.5	0	0	107.8	L905 H909 F931 E932 V933	L905-E922 WeakPolarHBondContact CD2-OE1 3.42Å; H909-E922 IonicContact CE1-OE2 3.23Å; H909-E922 PolarHBondContact CE1-OE2 2.92Å; H909-E922 IonicContact NE2-OE2 2.65Å; H909-E922 PolarHBondContact NE2-OE2 3.05Å; E922-F931 HydrophobicContact CG-CD1 4.46Å; E922-E932 WeakPolarHBondContact CA-O 3.48Å; E922-V933 HydrophobicContact CG-CG2 4.3Å
923	E	86.8	Confident	82.4	Confident	87 Å²	87	69.1 Å²	69.1	41%	0.407	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	136.6	-176.7	-73.8	179.8	-168.4	0	0	111	R921 F931 E932	R921-E923 HydrophobicContact CG-CG 4.26Å; R921-E923 IonicContact CZ-OE1 3.63Å; R921-E923 VanDerWaalsContact CZ-OE1 3.24Å; R921-E923 IonicContact CZ-OE2 3.93Å; R921-E923 IonicContact NE-OE1 3.6Å; R921-E923 PolarHBondContact NE-OE1 3.13Å; R921-E923 IonicContact NE-OE2 2.67Å; R921-E923 PolarHBondContact NE-OE2 2.79Å; R921-E923 IonicContact NH2-OE1 3.53Å; R921-E923 PolarHBondContact NH2-OE1 3.37Å; R921-E923 IonicContact NH2-OE2 3.57Å; R921-E923 PolarHBondContact NH2-OE2 2.88Å; E923-F931 WeakPolarHBondContact O-CA 3.33Å; E923-E932 PolarHBondContact N-O 3.15Å; E923-E932 PolarHBondContact O-N 3.28Å
924	L	83.6	Confident	82.4	Confident	72 Å²	72	64.4 Å²	64.4	38%	0.377	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	121.8	168.9	-179.3	63.4	0	0	0	108.6	D926 F931	L924-D926 PolarHBondContact O-N 3.5Å; L924-D926 VanDerWaalsContact O-N 3.1Å; L924-F931 HydrophobicContact CB-CD1 4.36Å; L924-F931 HydrophobicContact CB-CE1 4.13Å; L924-F931 HydrophobicContact CD1-CD1 4.28Å; L924-F931 HydrophobicContact CD1-CD2 4.03Å; L924-F931 HydrophobicContact CD1-CE1 4.03Å; L924-F931 HydrophobicContact CD1-CE2 3.76Å; L924-F931 HydrophobicContact CD1-CG 4.29Å; L924-F931 HydrophobicContact CD1-CZ 3.77Å
925	K	70.8	Confident	82.6	Confident	27 Å²	27	56.3 Å²	56.3	12%	0.117	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	95.5	167.5	-67.2	-171.8	177.2	177.3	0	107.9	V162 Q899 S927 I928 L930 E932	V162-K925 PolarHBondContact O-NZ 3.34Å; Q899-K925 VanDerWaalsContact NE2-NZ 3.16Å; K925-S927 PolarHBondContact O-N 2.96Å; K925-I928 PolarHBondContact O-N 3.31Å; K925-I928 VanDerWaalsContact O-N 3.1Å; K925-L930 WeakPolarHBondContact CB-O 3.31Å; K925-L930 PolarHBondContact N-O 3.29Å; K925-E932 VanDerWaalsContact CE-CD 3.47Å; K925-E932 WeakPolarHBondContact CE-OE1 3.22Å; K925-E932 WeakPolarHBondContact CE-OE2 3.44Å; K925-E932 IonicContact NZ-OE1 3.02Å; K925-E932 PolarHBondContact NZ-OE1 2.96Å; K925-E932 IonicContact NZ-OE2 3.79Å
926	D	59.4	Low	82.7	Confident	131 Å²	131	55 Å²	55	70%	0.701	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.4	-21.7	-166.8	-70.2	-32.3	0	0	0	117	L924	L924-D926 PolarHBondContact O-N 3.5Å; L924-D926 VanDerWaalsContact O-N 3.1Å
927	S	55.2	Low	83	Confident	37 Å²	37	53 Å²	53	26%	0.259	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-11.2	-174.8	53.7	0	0	0	0	115.6	R204 Q207 K925	R204-S927 PolarHBondContact NH1-OG 3.3Å; Q207-S927 VanDerWaalsContact CD-OG 3.31Å; Q207-S927 PolarHBondContact NE2-OG 2.87Å; Q207-S927 PolarHBondContact OE1-OG 3.1Å; K925-S927 PolarHBondContact O-N 2.96Å
928	I	62	Low	83.2	Confident	15 Å²	15	53.2 Å²	53.2	8%	0.077	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.1	-5	-167.2	-27.2	-178.7	0	0	0	112	V159 M194 K925 L930	V159-I928 HydrophobicContact CG1-CG2 4.4Å; V159-I928 WeakPolarHBondContact O-CD1 3.45Å; M194-I928 HydrophobicContact CE-CG2 4.16Å; K925-I928 PolarHBondContact O-N 3.31Å; K925-I928 VanDerWaalsContact O-N 3.1Å; I928-L930 HydrophobicContact CB-CB 4.37Å; I928-L930 HydrophobicContact CB-CD1 4.14Å; I928-L930 HydrophobicContact CB-CG 4.1Å; I928-L930 HydrophobicContact CG2-CD1 3.73Å; I928-L930 HydrophobicContact CG2-CG 3.98Å; I928-L930 PolarHBondContact O-N 3.29Å
929	N	69.9	Low	83.2	Confident	118 Å²	118	48.1 Å²	48.1	63%	0.631	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	31.6	-171.1	-60.9	-35.5	0	0	0	112.7
930	L	75.5	Confident	83	Confident	34 Å²	34	47.6 Å²	47.6	18%	0.178	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	131.3	173.5	-68.3	176	0	0	0	109.2	A900 T901 K925 I928	A900-L930 CarbonylContact O-C 3.55Å; A900-L930 WeakPolarHBondContact O-CA 3.44Å; T901-L930 HydrophobicContact CG2-CD2 3.55Å; K925-L930 WeakPolarHBondContact CB-O 3.31Å; K925-L930 PolarHBondContact N-O 3.29Å; I928-L930 HydrophobicContact CB-CB 4.37Å; I928-L930 HydrophobicContact CB-CD1 4.14Å; I928-L930 HydrophobicContact CB-CG 4.1Å; I928-L930 HydrophobicContact CG2-CD1 3.73Å; I928-L930 HydrophobicContact CG2-CG 3.98Å; I928-L930 PolarHBondContact O-N 3.29Å
931	F	83.9	Confident	82.9	Confident	51 Å²	51	44.1 Å²	44.1	22%	0.224	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	134.4	171.6	-69.1	-96	0	0	0	109.4	Q899 A900 L905 E922 E923 L924	Q899-F931 WeakPolarHBondContact CA-O 3.33Å; A900-F931 PolarHBondContact N-O 3.32Å; A900-F931 PolarHBondContact O-N 3.39Å; L905-F931 HydrophobicContact CD1-CB 4.22Å; L905-F931 HydrophobicContact CD2-CD1 4.33Å; L905-F931 HydrophobicContact CD2-CG 4.4Å; E922-F931 HydrophobicContact CG-CD1 4.46Å; E923-F931 WeakPolarHBondContact O-CA 3.33Å; L924-F931 HydrophobicContact CB-CD1 4.36Å; L924-F931 HydrophobicContact CB-CE1 4.13Å; L924-F931 HydrophobicContact CD1-CD1 4.28Å; L924-F931 HydrophobicContact CD1-CD2 4.03Å; L924-F931 HydrophobicContact CD1-CE1 4.03Å; L924-F931 HydrophobicContact CD1-CE2 3.76Å; L924-F931 HydrophobicContact CD1-CG 4.29Å; L924-F931 HydrophobicContact CD1-CZ 3.77Å
932	E	84.8	Confident	82.9	Confident	27 Å²	27	38.7 Å²	38.7	13%	0.126	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.4	167	-174.4	167	-102.9	0	0	109	T897 I898 Q899 E922 E923 K925	T897-E932 HydrophobicContact CG2-CG 3.71Å; I898-E932 WeakPolarHBondContact O-CA 3.38Å; Q899-E932 PolarHBondContact NE2-OE1 2.69Å; E922-E932 WeakPolarHBondContact CA-O 3.48Å; E923-E932 PolarHBondContact N-O 3.15Å; E923-E932 PolarHBondContact O-N 3.28Å; K925-E932 VanDerWaalsContact CE-CD 3.47Å; K925-E932 WeakPolarHBondContact CE-OE1 3.22Å; K925-E932 WeakPolarHBondContact CE-OE2 3.44Å; K925-E932 IonicContact NZ-OE1 3.02Å; K925-E932 PolarHBondContact NZ-OE1 2.96Å; K925-E932 IonicContact NZ-OE2 3.79Å
933	V	90.2	Very high	82.8	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	118.7	179.3	-174.2	0	0	0	0	108.4	T897 I898 L905 L912 V919 E922	T897-V933 WeakPolarHBondContact CA-O 3.35Å; I898-V933 HydrophobicContact CB-CB 4.37Å; I898-V933 PolarHBondContact N-O 3.24Å; I898-V933 PolarHBondContact O-N 2.92Å; L905-V933 HydrophobicContact CD1-CG2 3.44Å; L905-V933 VanDerWaalsContact CD1-CG2 3.44Å; L912-V933 HydrophobicContact CD1-CG1 4.25Å; V919-V933 HydrophobicContact CG1-CG1 3.81Å; V919-V933 HydrophobicContact CG2-CG1 3.98Å; E922-V933 HydrophobicContact CG-CG2 4.3Å
934	C	91.8	Very high	82.7	Confident	11 Å²	11	33.4 Å²	33.4	7%	0.074	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.8	173.7	-66.9	0	0	0	0	110	C896 F920 R921	C896-C934 WeakPolarHBondContact O-CA 3.35Å; F920-C934 HydrophobicContact CD2-CB 4.45Å; F920-C934 HydrophobicContact CE1-CB 4.49Å; F920-C934 HydrophobicContact CE2-CB 3.79Å; F920-C934 HydrophobicContact CZ-CB 3.82Å; F920-C934 PolarHBondContact N-O 3.32Å; R921-C934 HydrophobicContact CB-CB 4.04Å; R921-C934 PolarHBondContact N-O 2.76Å; R921-C934 PolarHBondContact O-N 2.96Å
935	A	94.3	Very high	82.9	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	150.3	-177.7	0	0	0	0	0	111.9	C896 L912 K918 V919 F920	C896-A935 PolarHBondContact N-O 2.66Å; C896-A935 PolarHBondContact O-N 3.4Å; L912-A935 HydrophobicContact CD1-CB 3.91Å; L912-A935 HydrophobicContact CD2-CB 4.04Å; K918-A935 CarbonylContact O-C 3.54Å; K918-A935 WeakPolarHBondContact O-CA 3.3Å; K918-A935 WeakPolarHBondContact O-CB 3.34Å; V919-A935 HydrophobicContact CG2-CB 4.05Å; F920-A935 VanDerWaalsContact CE1-C 3.49Å
936	S	94.2	Very high	83.5	Confident	12 Å²	12	30.1 Å²	30.1	8%	0.084	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	136.4	164.2	64.5	0	0	0	0	109.3	Y894 G917 K918	Y894-S936 CarbonylContact O-C 3.57Å; Y894-S936 WeakPolarHBondContact O-CA 3.35Å; G917-S936 CarbonylContact C-O 3.53Å; G917-S936 WeakPolarHBondContact CA-O 3.44Å; K918-S936 PolarHBondContact N-O 3.23Å; K918-S936 PolarHBondContact O-N 2.84Å
937	L	93.7	Very high	84.6	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129	-179.8	-176.5	70.9	0	0	0	109.8	Y894 C896 R915 V939 F945 L961	Y894-L937 PolarHBondContact N-O 3.32Å; Y894-L937 PolarHBondContact O-N 3.48Å; C896-L937 HydrophobicContact CB-CB 4.48Å; R915-L937 HydrophobicContact CB-CD1 3.85Å; L937-V939 PolarHBondContact O-N 3.46Å; L937-F945 HydrophobicContact CD2-CB 4.39Å; L937-F945 HydrophobicContact CD2-CD1 3.91Å; L937-F945 HydrophobicContact CD2-CD2 4.21Å; L937-F945 HydrophobicContact CD2-CE1 4.2Å; L937-F945 HydrophobicContact CD2-CE2 4.47Å; L937-F945 HydrophobicContact CD2-CG 3.91Å; L937-F945 HydrophobicContact CD2-CZ 4.48Å; L937-L961 HydrophobicContact CD2-CD2 4.06Å
938	P	92.8	Very high	86.2	Confident	10 Å²	10	29.8 Å²	29.8	7%	0.065	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	131.8	174.3	-23.2	33.8	0	0	0	111.7	M891 M893 V940 E941 S942	M891-P938 HydrophobicContact SD-CB 3.83Å; M891-P938 HydrophobicContact SD-CG 4.03Å; M893-P938 HydrophobicContact CE-CG 3.86Å; M893-P938 VanDerWaalsContact SD-CA 3.6Å; M893-P938 HydrophobicContact SD-CB 4.06Å; M893-P938 HydrophobicContact SD-CG 3.96Å; P938-V940 HydrophobicContact CB-CG1 4.26Å; P938-V940 PolarHBondContact O-N 2.86Å; P938-E941 HydrophobicContact CB-CB 4.36Å; P938-E941 CarbonylContact O-C 3.6Å; P938-E941 PolarHBondContact O-N 2.89Å; P938-S942 PolarHBondContact O-N 3.1Å
939	V	91.6	Very high	87.4	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-58	-37.7	-179	175.1	0	0	0	0	111.3	I583 V657 P892 Y894 L937 E941 S942	I583-V939 HydrophobicContact CG2-CG1 4.35Å; V657-V939 HydrophobicContact CG1-CB 4.02Å; V657-V939 HydrophobicContact CG1-CG1 3.97Å; V657-V939 HydrophobicContact CG2-CB 4.44Å; V657-V939 HydrophobicContact CG2-CG1 3.81Å; P892-V939 HydrophobicContact CB-CG2 3.9Å; P892-V939 HydrophobicContact CG-CB 4.03Å; P892-V939 HydrophobicContact CG-CG2 3.97Å; P892-V939 VanDerWaalsContact O-CG2 3.26Å; P892-V939 WeakPolarHBondContact O-CG2 3.3Å; P892-V939 PolarHBondContact O-N 2.89Å; Y894-V939 HydrophobicContact CD1-CG2 3.79Å; Y894-V939 HydrophobicContact CD2-CB 4.25Å; Y894-V939 HydrophobicContact CD2-CG1 4.41Å; Y894-V939 HydrophobicContact CD2-CG2 3.74Å; Y894-V939 HydrophobicContact CE1-CG2 3.72Å; Y894-V939 HydrophobicContact CE2-CB 3.97Å; Y894-V939 HydrophobicContact CE2-CG1 3.64Å; Y894-V939 HydrophobicContact CE2-CG2 3.67Å; Y894-V939 HydrophobicContact CG-CG2 3.8Å; L937-V939 PolarHBondContact O-N 3.46Å; V939-E941 VanDerWaalsContact C-N 3.26Å; V939-E941 PolarHBondContact O-N 3.47Å; V939-S942 WeakPolarHBondContact O-CB 3.37Å; V939-S942 PolarHBondContact O-N 2.71Å; V939-S942 VanDerWaalsContact O-N 3.09Å; V939-S942 PolarHBondContact O-OG 3.31Å
940	V	89.9	Confident	87.9	Confident	38 Å²	38	28.6 Å²	28.6	23%	0.23	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-63.4	-30.1	178.7	68.8	0	0	0	0	113.2	V657 F659 P938 Y999	V657-V940 HydrophobicContact CB-CB 4.29Å; V657-V940 HydrophobicContact CG2-CB 4.03Å; V657-V940 HydrophobicContact CG2-CG2 4.42Å; F659-V940 HydrophobicContact CZ-CB 4.38Å; F659-V940 HydrophobicContact CZ-CG1 4.48Å; F659-V940 HydrophobicContact CZ-CG2 4.34Å; P938-V940 HydrophobicContact CB-CG1 4.26Å; P938-V940 PolarHBondContact O-N 2.86Å; V940-Y999 HydrophobicContact CG1-CE1 4.02Å; V940-Y999 HydrophobicContact CG1-CE2 4.44Å; V940-Y999 HydrophobicContact CG2-CE1 4.09Å
941	E	89.9	Confident	88.3	Confident	53 Å²	53	35.7 Å²	35.7	25%	0.248	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-96.5	7.7	177.6	-67.4	-62.3	154.5	0	0	112.3	R915 P938 V939 Y999	R915-E941 HydrophobicContact CB-CB 4.1Å; R915-E941 WeakPolarHBondContact CD-O 3.41Å; R915-E941 PolarHBondContact NH1-O 2.85Å; R915-E941 WeakPolarHBondContact O-CB 3.34Å; P938-E941 HydrophobicContact CB-CB 4.36Å; P938-E941 CarbonylContact O-C 3.6Å; P938-E941 PolarHBondContact O-N 2.89Å; V939-E941 VanDerWaalsContact C-N 3.26Å; V939-E941 PolarHBondContact O-N 3.47Å; E941-Y999 PolarHBondContact OE1-OH 3.5Å
942	S	90	Very high	88.5	Confident	6 Å²	6	36.3 Å²	36.3	4%	0.042	18%	0.175	C	C	.	.			trans	-88.7	-19.6	-178.8	75.6	0	0	0	0	114.4	Y894 P938 V939 G944 F945	Y894-S942 WeakPolarHBondContact CE2-OG 3.49Å; P938-S942 PolarHBondContact O-N 3.1Å; V939-S942 WeakPolarHBondContact O-CB 3.37Å; V939-S942 PolarHBondContact O-N 2.71Å; V939-S942 VanDerWaalsContact O-N 3.09Å; V939-S942 PolarHBondContact O-OG 3.31Å; S942-G944 PolarHBondContact O-N 3.14Å; S942-F945 WeakPolarHBondContact O-CB 3.38Å; S942-F945 PolarHBondContact O-N 2.8Å
943	F	87.8	Confident	88.3	Confident	42 Å²	42	35.1 Å²	35.1	18%	0.184	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	127.3	-178.6	-64.1	-76.6	0	0	0	111.5	V584 E630 P655 V657 R915 F945	V584-F943 HydrophobicContact CB-CZ 4.48Å; V584-F943 HydrophobicContact CG1-CE1 3.76Å; V584-F943 HydrophobicContact CG1-CZ 3.78Å; V584-F943 HydrophobicContact CG2-CE1 4.17Å; V584-F943 HydrophobicContact CG2-CZ 3.97Å; E630-F943 HydrophobicContact CB-CD1 4.41Å; E630-F943 HydrophobicContact CG-CD1 4.42Å; P655-F943 HydrophobicContact CB-CD1 3.84Å; P655-F943 HydrophobicContact CB-CD2 4.23Å; P655-F943 HydrophobicContact CB-CE1 3.3Å; P655-F943 HydrophobicContact CB-CE2 3.74Å; P655-F943 HydrophobicContact CB-CG 4.28Å; P655-F943 HydrophobicContact CB-CZ 3.25Å; P655-F943 HydrophobicContact CG-CD1 3.84Å; P655-F943 HydrophobicContact CG-CE1 3.74Å; P655-F943 HydrophobicContact CG-CG 4.37Å; P655-F943 HydrophobicContact CG-CZ 4.18Å; V657-F943 HydrophobicContact CG2-CE2 3.73Å; V657-F943 HydrophobicContact CG2-CZ 4.21Å; R915-F943 PolarHBondContact NH1-O 3.11Å; R915-F943 PolarHBondContact NH2-O 2.77Å; F943-F945 PolarHBondContact O-N 3.49Å
944	G	85.5	Confident	87.8	Confident	18 Å²	18	39.6 Å²	39.6	19%	0.186	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	5.8	-174.3	0	0	0	0	0	115.1	E630 S942 E947 E948	E630-G944 PolarHBondContact OE2-N 2.79Å; S942-G944 PolarHBondContact O-N 3.14Å; G944-E947 PolarHBondContact O-N 2.91Å; G944-E948 WeakPolarHBondContact O-CB 3.45Å; G944-E948 PolarHBondContact O-N 2.78Å
945	F	88.8	Confident	86.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62	-43.8	178.2	171.1	-109.4	0	0	0	112	C896 I898 V911 L912 L937 S942 F943 E947 E948 L949 P959 L961	C896-F945 WeakPolarHBondContact SG-CE1 3.46Å; I898-F945 HydrophobicContact CD1-CE1 4.44Å; I898-F945 HydrophobicContact CD1-CZ 3.95Å; V911-F945 HydrophobicContact CB-CE2 4.38Å; V911-F945 HydrophobicContact CG1-CD2 3.72Å; V911-F945 HydrophobicContact CG1-CE2 3.56Å; L912-F945 HydrophobicContact CD2-CE2 3.94Å; L912-F945 HydrophobicContact CD2-CZ 3.67Å; L912-F945 HydrophobicContact CG-CE2 4.49Å; L912-F945 HydrophobicContact CG-CZ 4.38Å; L937-F945 HydrophobicContact CD2-CB 4.39Å; L937-F945 HydrophobicContact CD2-CD1 3.91Å; L937-F945 HydrophobicContact CD2-CD2 4.21Å; L937-F945 HydrophobicContact CD2-CE1 4.2Å; L937-F945 HydrophobicContact CD2-CE2 4.47Å; L937-F945 HydrophobicContact CD2-CG 3.91Å; L937-F945 HydrophobicContact CD2-CZ 4.48Å; S942-F945 WeakPolarHBondContact O-CB 3.38Å; S942-F945 PolarHBondContact O-N 2.8Å; F943-F945 PolarHBondContact O-N 3.49Å; F945-E947 PolarHBondContact O-N 3.29Å; F945-E948 PolarHBondContact O-N 3.33Å; F945-L949 HydrophobicContact CE1-CD2 4.33Å; F945-L949 HydrophobicContact CZ-CD2 4.17Å; F945-L949 WeakPolarHBondContact O-CB 3.23Å; F945-L949 PolarHBondContact O-N 3.37Å; F945-P959 HydrophobicContact CD1-CB 4.01Å; F945-P959 HydrophobicContact CD1-CG 3.99Å; F945-P959 HydrophobicContact CE1-CB 3.44Å; F945-P959 VanDerWaalsContact CE1-CB 3.44Å; F945-P959 HydrophobicContact CE1-CG 3.83Å; F945-P959 HydrophobicContact CZ-CB 4.42Å; F945-L961 HydrophobicContact CD1-CD1 4.47Å; F945-L961 HydrophobicContact CD1-CD2 4.26Å; F945-L961 HydrophobicContact CE1-CD2 4.39Å
946	A	83.4	Confident	85.5	Confident	30 Å²	30	45.7 Å²	45.7	25%	0.248	24%	0.243	C	C	.	.	H	α-helix	trans	-63.7	-40.6	-179	0	0	0	0	0	112.5	R950 P959	A946-R950 VanDerWaalsContact O-CB 3.27Å; A946-R950 WeakPolarHBondContact O-CB 3.43Å; A946-R950 PolarHBondContact O-N 3.49Å; A946-P959 HydrophobicContact CB-CG 3.73Å
947	E	82.1	Confident	84.5	Confident	119 Å²	119	45.1 Å²	45.1	56%	0.556	24%	0.239	S	C	*	.	H	α-helix	trans	-67.7	-43.3	176.9	-62.4	-172.4	165.4	0	0	111.8	G944 F945 R950 K951	G944-E947 PolarHBondContact O-N 2.91Å; F945-E947 PolarHBondContact O-N 3.29Å; E947-R950 PolarHBondContact O-N 2.97Å; E947-K951 WeakPolarHBondContact O-CB 3.32Å; E947-K951 PolarHBondContact O-N 3.34Å
948	E	88.2	Confident	83.4	Confident	42 Å²	42	49.9 Å²	49.9	20%	0.196	26%	0.257	C	S	.	.	H	α-helix	trans	-62.8	-45.2	176.8	-178.3	172.1	-165.3	0	0	111.6	V911 R915 G944 F945 K951 R952	V911-E948 HydrophobicContact CG1-CG 4.19Å; V911-E948 HydrophobicContact CG2-CG 4.48Å; R915-E948 IonicContact CZ-OE2 3.2Å; R915-E948 VanDerWaalsContact CZ-OE2 3.23Å; R915-E948 IonicContact NE-OE2 3.13Å; R915-E948 PolarHBondContact NE-OE2 2.75Å; R915-E948 IonicContact NH2-OE2 3.18Å; R915-E948 PolarHBondContact NH2-OE2 3.29Å; G944-E948 WeakPolarHBondContact O-CB 3.45Å; G944-E948 PolarHBondContact O-N 2.78Å; F945-E948 PolarHBondContact O-N 3.33Å; E948-K951 PolarHBondContact O-N 3.3Å; E948-R952 WeakPolarHBondContact O-CG 3.44Å; E948-R952 PolarHBondContact O-N 3.31Å; E948-R952 IonicContact OE1-CZ 2.72Å; E948-R952 VanDerWaalsContact OE1-CZ 3.3Å; E948-R952 IonicContact OE1-NE 2.62Å; E948-R952 IonicContact OE1-NH2 3.08Å; E948-R952 PolarHBondContact OE1-NH2 2.8Å
949	L	87.1	Confident	83	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-62	-47.1	177.5	-169.9	65.6	0	0	0	110.6	I898 V908 V911 F945 K951 R952 A953 A957 P959	I898-L949 HydrophobicContact CD1-CD2 3.96Å; I898-L949 HydrophobicContact CG1-CD2 4.3Å; I898-L949 HydrophobicContact CG2-CD2 3.9Å; V908-L949 HydrophobicContact CB-CD1 4.36Å; V908-L949 HydrophobicContact CG1-CD1 4.29Å; V908-L949 HydrophobicContact CG2-CD1 4.12Å; V911-L949 HydrophobicContact CB-CD1 4.35Å; V911-L949 HydrophobicContact CG2-CD1 4.31Å; F945-L949 HydrophobicContact CE1-CD2 4.33Å; F945-L949 HydrophobicContact CZ-CD2 4.17Å; F945-L949 WeakPolarHBondContact O-CB 3.23Å; F945-L949 PolarHBondContact O-N 3.37Å; L949-K951 VanDerWaalsContact C-N 3.32Å; L949-K951 PolarHBondContact O-N 3.13Å; L949-R952 PolarHBondContact O-N 3.37Å; L949-A953 VanDerWaalsContact O-CB 3.25Å; L949-A953 WeakPolarHBondContact O-CB 3.33Å; L949-A953 PolarHBondContact O-N 2.92Å; L949-A957 HydrophobicContact CD1-CB 4.41Å; L949-A957 HydrophobicContact CD2-CB 4.14Å; L949-A957 HydrophobicContact CG-CB 4.03Å; L949-P959 HydrophobicContact CD2-CB 3.87Å; L949-P959 HydrophobicContact CD2-CG 3.76Å
950	R	79.6	Confident	82.5	Confident	107 Å²	107	50.6 Å²	50.6	40%	0.404	26%	0.26	S	S	.	.	H	α-helix	trans	-58.1	-44.5	176.4	-167.6	-171.8	-59.3	159.6	8.1	111.3	A946 E947 S954 G955 W958	A946-R950 VanDerWaalsContact O-CB 3.27Å; A946-R950 WeakPolarHBondContact O-CB 3.43Å; A946-R950 PolarHBondContact O-N 3.49Å; E947-R950 PolarHBondContact O-N 2.97Å; R950-S954 CarbonylContact O-C 3.32Å; R950-S954 PolarHBondContact O-N 2.9Å; R950-S954 VanDerWaalsContact O-N 3.11Å; R950-G955 PolarHBondContact O-N 3.47Å; R950-W958 VanDerWaalsContact NE-CZ3 3.28Å
951	K	85.5	Confident	82.3	Confident	182 Å²	182	50.6 Å²	50.6	79%	0.791	26%	0.259	S	S	*	.	H	α-helix	trans	-66.4	-41.2	-179.8	-171	175.1	-178.2	176.5	0	112.5	E947 E948 L949	E947-K951 WeakPolarHBondContact O-CB 3.32Å; E947-K951 PolarHBondContact O-N 3.34Å; E948-K951 PolarHBondContact O-N 3.3Å; L949-K951 VanDerWaalsContact C-N 3.32Å; L949-K951 PolarHBondContact O-N 3.13Å
952	R	87.6	Confident	82	Confident	65 Å²	65	50.1 Å²	50.1	25%	0.245	26%	0.26	C	S	.	.	H	α-helix	trans	-76.9	-38.3	-179.3	-69.8	-160.7	-165.6	175.2	3.9	113.7	K907 V911 E948 L949 S954	K907-R952 WeakPolarHBondContact CD-O 3.47Å; K907-R952 PolarHBondContact NZ-O 3.3Å; V911-R952 HydrophobicContact CG2-CG 4.42Å; E948-R952 WeakPolarHBondContact O-CG 3.44Å; E948-R952 PolarHBondContact O-N 3.31Å; E948-R952 IonicContact OE1-CZ 2.72Å; E948-R952 VanDerWaalsContact OE1-CZ 3.3Å; E948-R952 IonicContact OE1-NE 2.62Å; E948-R952 IonicContact OE1-NH2 3.08Å; E948-R952 PolarHBondContact OE1-NH2 2.8Å; L949-R952 PolarHBondContact O-N 3.37Å; R952-S954 PolarHBondContact O-N 3.18Å
953	A	81.4	Confident	81.7	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.008	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	6.2	177	0	0	0	0	0	112.8	V904 L949 G955 L956 A957	V904-A953 HydrophobicContact CB-CB 4.29Å; V904-A953 HydrophobicContact CG2-CB 4.48Å; L949-A953 VanDerWaalsContact O-CB 3.25Å; L949-A953 WeakPolarHBondContact O-CB 3.33Å; L949-A953 PolarHBondContact O-N 2.92Å; A953-G955 PolarHBondContact O-N 3.43Å; A953-G955 VanDerWaalsContact O-N 3.17Å; A953-L956 VanDerWaalsContact O-CB 3.3Å; A953-L956 WeakPolarHBondContact O-CB 3.46Å; A953-L956 PolarHBondContact O-N 3.38Å; A953-A957 HydrophobicContact CB-CB 3.52Å
954	S	78.1	Confident	81.6	Confident	95 Å²	95	52.3 Å²	52.3	66%	0.664	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	33.3	-176.6	-55.8	0	0	0	0	113.5	R950 R952	R950-S954 CarbonylContact O-C 3.32Å; R950-S954 PolarHBondContact O-N 2.9Å; R950-S954 VanDerWaalsContact O-N 3.11Å; R952-S954 PolarHBondContact O-N 3.18Å
955	G	67.2	Low	81.7	Confident	44 Å²	44	55.4 Å²	55.4	45%	0.454	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	-3	-177.3	0	0	0	0	0	115.8	R950 A953 A957	R950-G955 PolarHBondContact O-N 3.47Å; A953-G955 PolarHBondContact O-N 3.43Å; A953-G955 VanDerWaalsContact O-N 3.17Å; G955-A957 VanDerWaalsContact C-N 3.3Å; G955-A957 PolarHBondContact O-N 3.37Å
956	L	70.3	Confident	81.7	Confident	94 Å²	94	58.2 Å²	58.2	49%	0.492	30%	0.296	S	S	.	.	S	Bend	trans	-85	2.7	-177	-59.8	173.1	0	0	0	114.5	V904 A953	V904-L956 HydrophobicContact CG1-CB 4.24Å; V904-L956 HydrophobicContact CG1-CD1 4.02Å; V904-L956 HydrophobicContact CG2-CB 4.35Å; A953-L956 VanDerWaalsContact O-CB 3.3Å; A953-L956 WeakPolarHBondContact O-CB 3.46Å; A953-L956 PolarHBondContact O-N 3.38Å
957	A	73.7	Confident	82.1	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.008	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	129.3	173.8	0	0	0	0	0	109.6	I898 Q899 A900 V908 L949 A953 G955	I898-A957 HydrophobicContact CG2-CB 4.09Å; Q899-A957 WeakPolarHBondContact O-CA 3.4Å; A900-A957 HydrophobicContact CB-CB 4.22Å; V908-A957 HydrophobicContact CG2-CB 4.05Å; L949-A957 HydrophobicContact CD1-CB 4.41Å; L949-A957 HydrophobicContact CD2-CB 4.14Å; L949-A957 HydrophobicContact CG-CB 4.03Å; A953-A957 HydrophobicContact CB-CB 3.52Å; G955-A957 VanDerWaalsContact C-N 3.3Å; G955-A957 PolarHBondContact O-N 3.37Å
958	W	71.6	Confident	82.6	Confident	99 Å²	99	56.9 Å²	56.9	38%	0.375	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	124.7	178.4	-169	-88.2	0	0	0	110.3	R950	R950-W958 VanDerWaalsContact NE-CZ3 3.28Å
959	P	84.1	Confident	82.7	Confident	9 Å²	9	56.1 Å²	56.1	6%	0.058	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	139.7	177.8	32.6	-23.9	0	0	0	111.7	I898 F945 A946 L949	I898-P959 HydrophobicContact CG1-CB 4.14Å; F945-P959 HydrophobicContact CD1-CB 4.01Å; F945-P959 HydrophobicContact CD1-CG 3.99Å; F945-P959 HydrophobicContact CE1-CB 3.44Å; F945-P959 VanDerWaalsContact CE1-CB 3.44Å; F945-P959 HydrophobicContact CE1-CG 3.83Å; F945-P959 HydrophobicContact CZ-CB 4.42Å; A946-P959 HydrophobicContact CB-CG 3.73Å; L949-P959 HydrophobicContact CD2-CB 3.87Å; L949-P959 HydrophobicContact CD2-CG 3.76Å
960	Q	81	Confident	82.6	Confident	16 Å²	16	60.2 Å²	60.2	8%	0.075	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.4	165	-176	174	-13.9	0	0	109.3	H66 A136 C896 T897 V962	H66-Q960 PolarHBondContact CE1-OE1 3.39Å; A136-Q960 HydrophobicContact CB-CG 4.32Å; C896-Q960 WeakPolarHBondContact CA-O 3.39Å; T897-Q960 PolarHBondContact N-O 3.42Å; T897-Q960 PolarHBondContact O-N 2.99Å; Q960-V962 HydrophobicContact CG-CG2 4.28Å
961	L	85.8	Confident	82.9	Confident	38 Å²	38	57.9 Å²	57.9	20%	0.199	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	126.1	-179.9	-59.8	174.5	0	0	0	109.8	Y894 C896 L937 F945	Y894-L961 HydrophobicContact CD2-CB 4.07Å; Y894-L961 HydrophobicContact CD2-CD1 4.19Å; Y894-L961 HydrophobicContact CD2-CD2 4.44Å; Y894-L961 HydrophobicContact CD2-CG 4.47Å; Y894-L961 HydrophobicContact CG-CB 4.18Å; C896-L961 HydrophobicContact CB-CD2 3.74Å; L937-L961 HydrophobicContact CD2-CD2 4.06Å; F945-L961 HydrophobicContact CD1-CD1 4.47Å; F945-L961 HydrophobicContact CD1-CD2 4.26Å; F945-L961 HydrophobicContact CE1-CD2 4.39Å
962	V	82.6	Confident	82.8	Confident	43 Å²	43	51 Å²	51	26%	0.261	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136.2	175.9	-176.4	0	0	0	0	109	A136 Y579 Y894 T895 Q960 S964	A136-V962 HydrophobicContact CB-CG2 4.44Å; Y579-V962 HydrophobicContact CE2-CG1 4.48Å; Y894-V962 CarbonylContact C-O 3.56Å; Y894-V962 VanDerWaalsContact CA-O 3.3Å; Y894-V962 WeakPolarHBondContact CA-O 3.38Å; T895-V962 PolarHBondContact N-O 3.47Å; T895-V962 PolarHBondContact O-N 3Å; Q960-V962 HydrophobicContact CG-CG2 4.28Å; V962-S964 PolarHBondContact O-N 3.4Å
963	F	85.3	Confident	82.7	Confident	40 Å²	40	48 Å²	48	18%	0.175	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	134.8	174.9	179.5	-113.2	0	0	0	111.5	E581 I583 P892 Y894 H965 W966	E581-F963 HydrophobicContact CB-CD1 4.38Å; I583-F963 HydrophobicContact CD1-CB 3.64Å; I583-F963 HydrophobicContact CD1-CD1 3.63Å; I583-F963 HydrophobicContact CD1-CD2 3.02Å; I583-F963 HydrophobicContact CD1-CE1 4.01Å; I583-F963 HydrophobicContact CD1-CE2 3.47Å; I583-F963 VanDerWaalsContact CD1-CE2 3.47Å; I583-F963 HydrophobicContact CD1-CG 3.1Å; I583-F963 HydrophobicContact CD1-CZ 3.94Å; P892-F963 HydrophobicContact CB-CD2 4.36Å; P892-F963 HydrophobicContact CB-CE2 3.73Å; Y894-F963 HydrophobicContact CD1-CB 4.23Å; Y894-F963 HydrophobicContact CE1-CB 4.13Å; F963-H965 WeakPolarHBondContact CE2-O 3.35Å; F963-W966 AromaticContact CZ-CD1 3.84Å; F963-W966 AromaticContact CZ-NE1 3.55Å
964	S	84.9	Confident	82.7	Confident	55 Å²	55	53.3 Å²	53.3	39%	0.385	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	-63	-173.4	-174.9	0	0	0	0	111.4	M893 T895 V962	M893-S964 PolarHBondContact O-N 3.33Å; M893-S964 VanDerWaalsContact O-N 3.09Å; T895-S964 WeakPolarHBondContact OG1-CB 3.42Å; T895-S964 PolarHBondContact OG1-OG 3.2Å; T895-S964 VanDerWaalsContact OG1-OG 3.04Å; V962-S964 PolarHBondContact O-N 3.4Å
965	H	88.2	Confident	82.6	Confident	83 Å²	83	51.9 Å²	51.9	38%	0.384	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.6	179.8	-174.6	59.2	-79.4	0	0	0	111.4	M893 F963	M893-H965 PolarHBondContact N-O 2.74Å; F963-H965 WeakPolarHBondContact CE2-O 3.35Å
966	W	89	Confident	82.7	Confident	59 Å²	59	54.1 Å²	54.1	22%	0.223	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.7	173.5	-66.1	86.4	0	0	0	109.7	P658 V890 M891 P892 F963	P658-W966 HydrophobicContact CB-CH2 4.18Å; P658-W966 HydrophobicContact CG-CH2 4Å; P658-W966 WeakPolarHBondContact O-CZ3 3.46Å; V890-W966 HydrophobicContact CG1-CB 3.75Å; V890-W966 HydrophobicContact CG1-CE3 4.21Å; M891-W966 WeakPolarHBondContact O-CA 3.46Å; P892-W966 HydrophobicContact CB-CD2 4.33Å; P892-W966 HydrophobicContact CB-CE3 4.05Å; P892-W966 HydrophobicContact CB-CH2 4.12Å; P892-W966 HydrophobicContact CB-CZ2 4.38Å; P892-W966 HydrophobicContact CB-CZ3 3.96Å; P892-W966 HydrophobicContact CG-CE3 4.46Å; P892-W966 HydrophobicContact CG-CH2 4.22Å; P892-W966 HydrophobicContact CG-CZ3 3.98Å; F963-W966 AromaticContact CZ-CD1 3.84Å; F963-W966 AromaticContact CZ-NE1 3.55Å
967	E	91.6	Very high	82.7	Confident	43 Å²	43	50.4 Å²	50.4	20%	0.201	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.5	-179.7	-170	179.2	157.2	0	0	110.4	V890 M891 M893 K918 F969	V890-E967 WeakPolarHBondContact CA-O 3.4Å; V890-E967 WeakPolarHBondContact CG1-O 3.49Å; M891-E967 PolarHBondContact N-O 2.84Å; M891-E967 PolarHBondContact O-N 2.6Å; M893-E967 WeakPolarHBondContact CE-OE2 3.48Å; M893-E967 HydrophobicContact CG-CB 3.47Å; M893-E967 VanDerWaalsContact CG-CB 3.47Å; M893-E967 HydrophobicContact SD-CB 4.2Å; K918-E967 IonicContact NZ-OE1 2.74Å; K918-E967 PolarHBondContact NZ-OE1 3.43Å; E967-F969 PolarHBondContact O-N 3.45Å
968	I	92.1	Very high	82.6	Confident	77 Å²	77	56 Å²	56	40%	0.395	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	123.2	174.2	-55.4	-179.6	0	0	0	108.1	T662 I664 R888 V890 P970	T662-I968 HydrophobicContact CG2-CD1 4.09Å; T662-I968 HydrophobicContact CG2-CG1 4.13Å; T662-I968 HydrophobicContact CG2-CG2 4.14Å; I664-I968 HydrophobicContact CG2-CD1 4.29Å; I664-I968 HydrophobicContact CG2-CG2 4.25Å; R888-I968 HydrophobicContact CB-CG2 3.57Å; R888-I968 HydrophobicContact CG-CG2 3.97Å; V890-I968 HydrophobicContact CG2-CG1 4.31Å; I968-P970 WeakPolarHBondContact O-CD 3.42Å
969	F	90.1	Very high	82.5	Confident	26 Å²	26	53.4 Å²	53.4	11%	0.114	29%	0.286	C	S	.	.			trans	-71.5	120.7	174.4	-167.9	-123.7	0	0	0	109	R888 L889 M891 E967 V971 L995 A996 Y999	R888-F969 WeakPolarHBondContact CD-O 3.48Å; L889-F969 HydrophobicContact CB-CB 4.41Å; L889-F969 WeakPolarHBondContact O-CB 3.5Å; L889-F969 PolarHBondContact O-N 3.37Å; M891-F969 HydrophobicContact CE-CB 3.96Å; M891-F969 HydrophobicContact CE-CD1 4.35Å; M891-F969 HydrophobicContact CE-CD2 3.37Å; M891-F969 HydrophobicContact CE-CE2 3.95Å; M891-F969 HydrophobicContact CE-CG 3.64Å; M891-F969 HydrophobicContact CG-CB 4.47Å; M891-F969 HydrophobicContact SD-CB 4.37Å; M891-F969 HydrophobicContact SD-CD2 3.63Å; M891-F969 HydrophobicContact SD-CE2 4.33Å; M891-F969 HydrophobicContact SD-CG 4.28Å; E967-F969 PolarHBondContact O-N 3.45Å; F969-V971 VanDerWaalsContact C-N 3.26Å; F969-V971 HydrophobicContact CD1-CB 4.03Å; F969-V971 HydrophobicContact CE1-CB 3.59Å; F969-V971 HydrophobicContact CE1-CG2 3.83Å; F969-V971 HydrophobicContact CZ-CB 4.13Å; F969-V971 HydrophobicContact CZ-CG2 3.82Å; F969-V971 PolarHBondContact O-N 3.42Å; F969-L995 HydrophobicContact CE1-CB 4.5Å; F969-L995 HydrophobicContact CZ-CB 4.3Å; F969-L995 HydrophobicContact CZ-CD2 3.98Å; F969-L995 HydrophobicContact CZ-CG 4.39Å; F969-A996 HydrophobicContact CD1-CB 3.77Å; F969-A996 HydrophobicContact CE1-CB 3.67Å; F969-Y999 HydrophobicContact CE1-CD2 4.47Å; F969-Y999 HydrophobicContact CE1-CE2 4.39Å; F969-Y999 HydrophobicContact CZ-CE2 4.34Å
970	P	85.2	Confident	81.8	Confident	87 Å²	87	61.1 Å²	61.1	57%	0.565	32%	0.321	S	S	*	.			trans	-69.3	-24.5	-168.2	24.8	-34.3	0	0	0	113.5	R888 I968	R888-P970 PolarHBondContact NE-O 3.42Å; I968-P970 WeakPolarHBondContact O-CD 3.42Å
971	V	84.6	Confident	81.2	Confident	58 Å²	58	64.7 Å²	64.7	35%	0.352	34%	0.338	S	S	.	.	S	Bend	trans	-78.5	129.9	-174.7	-174.4	0	0	0	0	110.9	F969 N994 A996	F969-V971 VanDerWaalsContact C-N 3.26Å; F969-V971 HydrophobicContact CD1-CB 4.03Å; F969-V971 HydrophobicContact CE1-CB 3.59Å; F969-V971 HydrophobicContact CE1-CG2 3.83Å; F969-V971 HydrophobicContact CZ-CB 4.13Å; F969-V971 HydrophobicContact CZ-CG2 3.82Å; F969-V971 PolarHBondContact O-N 3.42Å; V971-N994 WeakPolarHBondContact CG1-OD1 3.38Å; V971-A996 HydrophobicContact CB-CB 4.09Å; V971-A996 HydrophobicContact CG1-CB 4.05Å; V971-A996 WeakPolarHBondContact O-CB 3.3Å
972	D	85.4	Confident	80.3	Confident	38 Å²	38	63.2 Å²	63.2	20%	0.203	33%	0.33	C	S	.	.			trans	-74.1	122.2	176.3	-168.7	-35.6	0	0	0	111.3	R888 F974 W975 N994	R888-D972 IonicContact CZ-OD2 3.56Å; R888-D972 IonicContact NH1-OD1 3.58Å; R888-D972 IonicContact NH1-OD2 3.23Å; R888-D972 PolarHBondContact NH1-OD2 3.46Å; R888-D972 IonicContact NH2-OD2 2.82Å; D972-F974 PolarHBondContact O-N 3.37Å; D972-F974 WeakPolarHBondContact OD1-CA 3.35Å; D972-F974 PolarHBondContact OD1-N 3.26Å; D972-W975 HydrophobicContact CB-CB 3.98Å; D972-W975 PolarHBondContact OD1-N 3.4Å; D972-N994 PolarHBondContact O-ND2 2.88Å
973	P	84.3	Confident	79.7	Confident	3 Å²	3	63.1 Å²	63.1	2%	0.019	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-17.2	178.2	26.6	-33	0	0	0	114.8	M834 A996 V1000	M834-P973 HydrophobicContact SD-CG 4.02Å; P973-A996 HydrophobicContact CB-CB 3.91Å; P973-V1000 HydrophobicContact CB-CG2 3.68Å; P973-V1000 HydrophobicContact CG-CG2 4.32Å
974	F	82.4	Confident	79.1	Confident	111 Å²	111	67 Å²	67	49%	0.487	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	2.6	-176.4	-56.8	-68.6	0	0	0	114	M834 Q887 D972 V976	M834-F974 HydrophobicContact CG-CE2 3.98Å; M834-F974 HydrophobicContact CG-CZ 3.97Å; M834-F974 HydrophobicContact SD-CE2 3.74Å; M834-F974 HydrophobicContact SD-CZ 4.2Å; Q887-F974 HydrophobicContact CB-CE2 4.36Å; D972-F974 PolarHBondContact O-N 3.37Å; D972-F974 WeakPolarHBondContact OD1-CA 3.35Å; D972-F974 PolarHBondContact OD1-N 3.26Å; F974-V976 PolarHBondContact O-N 3.27Å
975	W	75.2	Confident	78.1	Confident	65 Å²	65	71.3 Å²	71.3	25%	0.246	37%	0.37	C	S	.	.			trans	-59.6	135	-179.6	-177.4	87.1	0	0	0	112.1	L671 D972 P977 E982 Y986 V990	L671-W975 HydrophobicContact CD1-CD2 3.98Å; L671-W975 VanDerWaalsContact CD1-CE2 3.41Å; L671-W975 HydrophobicContact CD1-CG 4.18Å; L671-W975 HydrophobicContact CD1-CZ2 3.81Å; L671-W975 VanDerWaalsContact CD1-NE1 3.27Å; D972-W975 HydrophobicContact CB-CB 3.98Å; D972-W975 PolarHBondContact OD1-N 3.4Å; W975-P977 HydrophobicContact CH2-CB 3.95Å; W975-P977 HydrophobicContact CH2-CG 4.35Å; W975-P977 HydrophobicContact CZ2-CB 4.12Å; W975-E982 HydrophobicContact CZ2-CB 4.43Å; W975-E982 HydrophobicContact CZ2-CG 4.24Å; W975-E982 PolarHBondContact NE1-OE1 3.32Å; W975-Y986 HydrophobicContact CH2-CD1 4.44Å; W975-Y986 AromaticContact CH2-CD2 3.74Å; W975-Y986 HydrophobicContact CH2-CD2 3.74Å; W975-Y986 HydrophobicContact CH2-CE2 4.34Å; W975-Y986 AromaticContact CH2-CG 3.8Å; W975-Y986 HydrophobicContact CH2-CG 3.8Å; W975-Y986 HydrophobicContact CZ2-CD2 4.12Å; W975-Y986 HydrophobicContact CZ2-CE2 4.44Å; W975-V990 HydrophobicContact CZ3-CG1 4.5Å; W975-V990 HydrophobicContact CZ3-CG2 3.96Å
976	V	70.2	Confident	76.9	Confident	92 Å²	92	72.4 Å²	72.4	56%	0.558	37%	0.371	S	S	*	.			trans	-138.7	137.1	174.2	-179.3	0	0	0	0	105.1	F974 T978	F974-V976 PolarHBondContact O-N 3.27Å; V976-T978 PolarHBondContact O-N 3.3Å
977	P	69.6	Low	75.6	Confident	15 Å²	15	71 Å²	71	10%	0.097	38%	0.375	C	S	.	.			trans	-59.2	125.4	176.1	24.5	-33.6	0	0	0	109.6	W975 E982 V983 V990	W975-P977 HydrophobicContact CH2-CB 3.95Å; W975-P977 HydrophobicContact CH2-CG 4.35Å; W975-P977 HydrophobicContact CZ2-CB 4.12Å; P977-E982 HydrophobicContact CB-CB 3.86Å; P977-V983 HydrophobicContact CB-CG2 3.97Å; P977-V983 HydrophobicContact CG-CG2 4.5Å; P977-V990 HydrophobicContact CG-CG2 4.02Å
978	T	70.8	Confident	74	Confident	118 Å²	118	77 Å²	77	72%	0.724	40%	0.403	S	S	*	.			trans	-116.8	-35.8	-177.1	51.3	0	0	0	0	113	V976 E982	V976-T978 PolarHBondContact O-N 3.3Å; T978-E982 PolarHBondContact N-OE2 2.93Å; T978-E982 PolarHBondContact OG1-OE2 2.85Å; T978-E982 VanDerWaalsContact OG1-OE2 3.14Å
979	T	70.8	Confident	72.3	Confident	45 Å²	45	80 Å²	80	28%	0.276	42%	0.417	S	S	.	.	S	Bend	trans	-83.4	152.5	178	67	0	0	0	0	110.5	E981 E982 V983	T979-E981 PolarHBondContact O-N 3.42Å; T979-E982 PolarHBondContact N-OE2 2.88Å; T979-E982 VanDerWaalsContact N-OE2 3.13Å; T979-E982 PolarHBondContact O-N 3.5Å; T979-E982 VanDerWaalsContact OG1-CB 3.28Å; T979-E982 WeakPolarHBondContact OG1-CB 3.37Å; T979-E982 WeakPolarHBondContact OG1-CG 3.45Å; T979-E982 PolarHBondContact OG1-N 2.93Å; T979-E982 VanDerWaalsContact OG1-N 3.08Å; T979-V983 VanDerWaalsContact O-CG2 3.32Å; T979-V983 WeakPolarHBondContact O-CG2 3.34Å; T979-V983 PolarHBondContact O-N 2.82Å
980	E	69.8	Low	70.6	Confident	171 Å²	171	81.3 Å²	81.3	80%	0.799	43%	0.427	S	S	*	.	H	α-helix	trans	-58.4	-37.1	176.4	-67.5	-173.6	172	0	0	111	V983 V984	E980-V983 PolarHBondContact O-N 2.86Å; E980-V984 WeakPolarHBondContact O-CB 3.44Å; E980-V984 WeakPolarHBondContact O-CG2 3.44Å; E980-V984 PolarHBondContact O-N 2.93Å
981	E	67	Low	68.9	Low	91 Å²	91	84.5 Å²	84.5	43%	0.425	44%	0.439	S	S	.	.	H	α-helix	trans	-66	-43.5	175.7	-57.2	-162.6	164	0	0	112.7	T979 V983 V984 H985	T979-E981 PolarHBondContact O-N 3.42Å; E981-V983 VanDerWaalsContact C-N 3.3Å; E981-V983 PolarHBondContact O-N 3.18Å; E981-V984 PolarHBondContact O-N 2.91Å; E981-H985 WeakPolarHBondContact O-CB 3.45Å; E981-H985 PolarHBondContact O-CD2 3.47Å; E981-H985 VanDerWaalsContact O-CD2 3.31Å; E981-H985 PolarHBondContact O-N 2.93Å
982	E	67.4	Low	67.7	Low	8 Å²	8	87.8 Å²	87.8	4%	0.037	46%	0.455	C	S	.	.	H	α-helix	trans	-60.4	-42.1	173.5	-78.5	176.3	152.6	0	0	111.1	W975 P977 T978 T979 V984 H985 Y986	W975-E982 HydrophobicContact CZ2-CB 4.43Å; W975-E982 HydrophobicContact CZ2-CG 4.24Å; W975-E982 PolarHBondContact NE1-OE1 3.32Å; P977-E982 HydrophobicContact CB-CB 3.86Å; T978-E982 PolarHBondContact N-OE2 2.93Å; T978-E982 PolarHBondContact OG1-OE2 2.85Å; T978-E982 VanDerWaalsContact OG1-OE2 3.14Å; T979-E982 PolarHBondContact N-OE2 2.88Å; T979-E982 VanDerWaalsContact N-OE2 3.13Å; T979-E982 PolarHBondContact O-N 3.5Å; T979-E982 VanDerWaalsContact OG1-CB 3.28Å; T979-E982 WeakPolarHBondContact OG1-CB 3.37Å; T979-E982 WeakPolarHBondContact OG1-CG 3.45Å; T979-E982 PolarHBondContact OG1-N 2.93Å; T979-E982 VanDerWaalsContact OG1-N 3.08Å; E982-V984 VanDerWaalsContact C-N 3.35Å; E982-H985 PolarHBondContact O-N 2.82Å; E982-Y986 HydrophobicContact CB-CD2 4.47Å; E982-Y986 WeakPolarHBondContact O-CB 3.3Å; E982-Y986 WeakPolarHBondContact O-CD2 3.44Å; E982-Y986 PolarHBondContact O-N 2.83Å
983	V	69.8	Low	66.8	Low	41 Å²	41	91.6 Å²	91.6	25%	0.248	48%	0.479	C	S	.	.	H	α-helix	trans	-66	-38.2	177.4	172.6	0	0	0	0	111.2	P977 T979 E980 E981 G987 E988	P977-V983 HydrophobicContact CB-CG2 3.97Å; P977-V983 HydrophobicContact CG-CG2 4.5Å; T979-V983 VanDerWaalsContact O-CG2 3.32Å; T979-V983 WeakPolarHBondContact O-CG2 3.34Å; T979-V983 PolarHBondContact O-N 2.82Å; E980-V983 PolarHBondContact O-N 2.86Å; E981-V983 VanDerWaalsContact C-N 3.3Å; E981-V983 PolarHBondContact O-N 3.18Å; V983-G987 CarbonylContact O-C 3.59Å; V983-G987 WeakPolarHBondContact O-CA 3.43Å; V983-G987 PolarHBondContact O-N 3.46Å; V983-E988 HydrophobicContact CG1-CB 4.45Å; V983-E988 HydrophobicContact CG1-CG 3.41Å; V983-E988 VanDerWaalsContact CG1-CG 3.41Å
984	V	73.1	Confident	66.6	Low	121 Å²	121	93 Å²	93	73%	0.733	49%	0.487	S	S	*	.	H	α-helix	trans	-67.3	-43.2	175.6	168.6	0	0	0	0	111.2	E980 E981 E982	E980-V984 WeakPolarHBondContact O-CB 3.44Å; E980-V984 WeakPolarHBondContact O-CG2 3.44Å; E980-V984 PolarHBondContact O-N 2.93Å; E981-V984 PolarHBondContact O-N 2.91Å; E982-V984 VanDerWaalsContact C-N 3.35Å
985	H	63.5	Low	66.7	Low	145 Å²	145	90.8 Å²	90.8	67%	0.671	48%	0.479	S	S	*	.	H	α-helix	trans	-76.1	-41.9	-176.9	-86.3	-67.9	0	0	0	113.8	E981 E982	E981-H985 WeakPolarHBondContact O-CB 3.45Å; E981-H985 PolarHBondContact O-CD2 3.47Å; E981-H985 VanDerWaalsContact O-CD2 3.31Å; E981-H985 PolarHBondContact O-N 2.93Å; E982-H985 PolarHBondContact O-N 2.82Å
986	Y	63.7	Low	67.2	Low	106 Å²	106	87.7 Å²	87.7	42%	0.416	47%	0.468	S	S	.	.	H	α-helix	trans	-105	-7.4	-173.7	-62.6	-77.3	0	0	0	113.6	W975 E982	W975-Y986 HydrophobicContact CH2-CD1 4.44Å; W975-Y986 AromaticContact CH2-CD2 3.74Å; W975-Y986 HydrophobicContact CH2-CD2 3.74Å; W975-Y986 HydrophobicContact CH2-CE2 4.34Å; W975-Y986 AromaticContact CH2-CG 3.8Å; W975-Y986 HydrophobicContact CH2-CG 3.8Å; W975-Y986 HydrophobicContact CZ2-CD2 4.12Å; W975-Y986 HydrophobicContact CZ2-CE2 4.44Å; E982-Y986 HydrophobicContact CB-CD2 4.47Å; E982-Y986 WeakPolarHBondContact O-CB 3.3Å; E982-Y986 WeakPolarHBondContact O-CD2 3.44Å; E982-Y986 PolarHBondContact O-N 2.83Å
987	G	62	Low	68	Low	29 Å²	29	87.9 Å²	87.9	30%	0.299	46%	0.461	S	S	.	.			trans	75.5	155.6	-172.4	0	0	0	0	0	112.5	V983 M989	V983-G987 CarbonylContact O-C 3.59Å; V983-G987 WeakPolarHBondContact O-CA 3.43Å; V983-G987 PolarHBondContact O-N 3.46Å; G987-M989 PolarHBondContact O-N 2.83Å
988	E	57.9	Low	68.9	Low	169 Å²	169	92.7 Å²	92.7	79%	0.79	48%	0.48	S	S	*	.	S	Bend	trans	-62.3	-25	169	-68.7	-174.2	163.1	0	0	112.2	V983	V983-E988 HydrophobicContact CG1-CB 4.45Å; V983-E988 HydrophobicContact CG1-CG 3.41Å; V983-E988 VanDerWaalsContact CG1-CG 3.41Å
989	M	55.8	Low	69.7	Low	140 Å²	140	87.8 Å²	87.8	69%	0.69	45%	0.449	S	S	*	.	S	Bend	trans	-114.3	96.5	177.8	-65.5	-88.3	-174.6	0	0	108	G987 D991	G987-M989 PolarHBondContact O-N 2.83Å; M989-D991 PolarHBondContact O-N 2.97Å
990	V	53.3	Low	70.6	Confident	54 Å²	54	86 Å²	86	33%	0.327	44%	0.438	S	S	.	.			trans	-69.4	96.3	178.1	-170.5	0	0	0	0	108.7	W975 P977 N992	W975-V990 HydrophobicContact CZ3-CG1 4.5Å; W975-V990 HydrophobicContact CZ3-CG2 3.96Å; P977-V990 HydrophobicContact CG-CG2 4.02Å; V990-N992 HydrophobicContact CG1-CB 4.01Å; V990-N992 WeakPolarHBondContact CG1-O 3.44Å; V990-N992 PolarHBondContact O-N 2.77Å
991	D	50.9	Low	71.5	Confident	155 Å²	155	78.9 Å²	78.9	83%	0.829	41%	0.405	S	S	*	.			trans	-64.2	-18.4	172.8	-80.5	-23.5	0	0	0	111.9	M989 V993	M989-D991 PolarHBondContact O-N 2.97Å; D991-V993 PolarHBondContact O-N 3.1Å
992	N	58.2	Low	72.4	Confident	127 Å²	127	77.1 Å²	77.1	68%	0.679	41%	0.406	S	S	*	.	S	Bend	trans	-77.7	112.1	174.5	-73.4	-28	0	0	0	111.4	V990 N994	V990-N992 HydrophobicContact CG1-CB 4.01Å; V990-N992 WeakPolarHBondContact CG1-O 3.44Å; V990-N992 PolarHBondContact O-N 2.77Å; N992-N994 PolarHBondContact O-N 3.26Å
993	V	66.4	Low	73.3	Confident	117 Å²	117	76.9 Å²	76.9	71%	0.709	41%	0.405	S	S	*	.			trans	-63.2	106	176.3	-178.2	0	0	0	0	109.6	D991 L995 K998	D991-V993 PolarHBondContact O-N 3.1Å; V993-L995 PolarHBondContact O-N 2.91Å; V993-K998 HydrophobicContact CG1-CB 4.29Å
994	N	80	Confident	74.2	Confident	33 Å²	33	77.5 Å²	77.5	18%	0.176	40%	0.403	C	S	.	.			trans	-54.1	112.3	171	178.4	-21.1	0	0	0	109.8	V971 D972 N992 A996 K997 K998	V971-N994 WeakPolarHBondContact CG1-OD1 3.38Å; D972-N994 PolarHBondContact O-ND2 2.88Å; N992-N994 PolarHBondContact O-N 3.26Å; N994-A996 VanDerWaalsContact C-N 3.32Å; N994-A996 PolarHBondContact O-N 3.28Å; N994-A996 WeakPolarHBondContact OD1-CB 3.36Å; N994-A996 PolarHBondContact OD1-N 2.87Å; N994-K997 HydrophobicContact CB-CB 3.95Å; N994-K997 WeakPolarHBondContact O-CB 3.02Å; N994-K997 PolarHBondContact O-N 2.97Å; N994-K997 PolarHBondContact OD1-N 3.27Å; N994-K998 PolarHBondContact O-N 2.77Å
995	L	84.6	Confident	74.8	Confident	64 Å²	64	78 Å²	78	34%	0.335	39%	0.392	S	S	.	.	H	α-helix	trans	-64.5	-35.9	-174.5	-166.8	68.4	0	0	0	112	F969 V993 K997 K998 Y999	F969-L995 HydrophobicContact CE1-CB 4.5Å; F969-L995 HydrophobicContact CZ-CB 4.3Å; F969-L995 HydrophobicContact CZ-CD2 3.98Å; F969-L995 HydrophobicContact CZ-CG 4.39Å; V993-L995 PolarHBondContact O-N 2.91Å; L995-K997 VanDerWaalsContact C-N 3.34Å; L995-K997 PolarHBondContact O-N 3.12Å; L995-K998 HydrophobicContact CD1-CD 4.03Å; L995-K998 WeakPolarHBondContact O-CB 3Å; L995-K998 PolarHBondContact O-N 3.17Å; L995-Y999 HydrophobicContact CD1-CE1 4.39Å; L995-Y999 HydrophobicContact CD1-CE2 4.45Å; L995-Y999 HydrophobicContact CD2-CE2 3.92Å; L995-Y999 WeakPolarHBondContact CD2-OH 3.3Å; L995-Y999 HydrophobicContact CG-CD2 4.37Å; L995-Y999 HydrophobicContact CG-CE1 4.44Å; L995-Y999 HydrophobicContact CG-CE2 3.66Å; L995-Y999 WeakPolarHBondContact O-CD2 3.47Å; L995-Y999 PolarHBondContact O-N 3.43Å
996	A	86.5	Confident	75.6	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-61.5	-46	175.4	0	0	0	0	0	110.3	F969 V971 P973 N994 K998 Y999 V1000	F969-A996 HydrophobicContact CD1-CB 3.77Å; F969-A996 HydrophobicContact CE1-CB 3.67Å; V971-A996 HydrophobicContact CB-CB 4.09Å; V971-A996 HydrophobicContact CG1-CB 4.05Å; V971-A996 WeakPolarHBondContact O-CB 3.3Å; P973-A996 HydrophobicContact CB-CB 3.91Å; N994-A996 VanDerWaalsContact C-N 3.32Å; N994-A996 PolarHBondContact O-N 3.28Å; N994-A996 WeakPolarHBondContact OD1-CB 3.36Å; N994-A996 PolarHBondContact OD1-N 2.87Å; A996-K998 VanDerWaalsContact C-N 3.31Å; A996-K998 PolarHBondContact O-N 3.45Å; A996-Y999 PolarHBondContact O-N 3.39Å; A996-V1000 WeakPolarHBondContact O-CG2 3.42Å; A996-V1000 PolarHBondContact O-N 3.07Å
997	K	87.2	Confident	76.4	Confident	96 Å²	96	71 Å²	71	42%	0.417	36%	0.36	S	S	.	.	H	α-helix	trans	-63.6	-35.8	176.3	-168.9	171.7	-178.2	174.8	0	112.3	N994 L995 V1000 N1001	N994-K997 HydrophobicContact CB-CB 3.95Å; N994-K997 WeakPolarHBondContact O-CB 3.02Å; N994-K997 PolarHBondContact O-N 2.97Å; N994-K997 PolarHBondContact OD1-N 3.27Å; L995-K997 VanDerWaalsContact C-N 3.34Å; L995-K997 PolarHBondContact O-N 3.12Å; K997-V1000 PolarHBondContact O-N 3.39Å; K997-N1001 VanDerWaalsContact O-CB 3.28Å; K997-N1001 WeakPolarHBondContact O-CB 3.33Å; K997-N1001 PolarHBondContact O-N 3.32Å
998	K	87.4	Confident	77.3	Confident	116 Å²	116	72.9 Å²	72.9	50%	0.504	38%	0.379	S	S	.	.	H	α-helix	trans	-60.5	-46.5	173.1	-174.8	-171	176.7	-170.9	0	111.1	V993 N994 L995 A996 N1001 A1002	V993-K998 HydrophobicContact CG1-CB 4.29Å; N994-K998 PolarHBondContact O-N 2.77Å; L995-K998 HydrophobicContact CD1-CD 4.03Å; L995-K998 WeakPolarHBondContact O-CB 3Å; L995-K998 PolarHBondContact O-N 3.17Å; A996-K998 VanDerWaalsContact C-N 3.31Å; A996-K998 PolarHBondContact O-N 3.45Å; K998-N1001 PolarHBondContact O-N 3.35Å; K998-A1002 WeakPolarHBondContact O-CB 3.32Å; K998-A1002 PolarHBondContact O-N 3.27Å
999	Y	89	Confident	78.6	Confident	15 Å²	15	66.6 Å²	66.6	6%	0.059	35%	0.351	C	S	.	.	H	α-helix	trans	-64.9	-46.6	176.4	-61.7	-39.2	0	0	0	112.1	F659 M891 V940 E941 F969 L995 A996 N1001 A1002 V1003	F659-Y999 HydrophobicContact CE1-CD2 4.47Å; F659-Y999 HydrophobicContact CE1-CG 4.44Å; F659-Y999 HydrophobicContact CZ-CD1 4.35Å; F659-Y999 HydrophobicContact CZ-CG 4.14Å; M891-Y999 HydrophobicContact CE-CD2 4.18Å; M891-Y999 HydrophobicContact CE-CE2 3.81Å; V940-Y999 HydrophobicContact CG1-CE1 4.02Å; V940-Y999 HydrophobicContact CG1-CE2 4.44Å; V940-Y999 HydrophobicContact CG2-CE1 4.09Å; E941-Y999 PolarHBondContact OE1-OH 3.5Å; F969-Y999 HydrophobicContact CE1-CD2 4.47Å; F969-Y999 HydrophobicContact CE1-CE2 4.39Å; F969-Y999 HydrophobicContact CZ-CE2 4.34Å; L995-Y999 HydrophobicContact CD1-CE1 4.39Å; L995-Y999 HydrophobicContact CD1-CE2 4.45Å; L995-Y999 HydrophobicContact CD2-CE2 3.92Å; L995-Y999 WeakPolarHBondContact CD2-OH 3.3Å; L995-Y999 HydrophobicContact CG-CD2 4.37Å; L995-Y999 HydrophobicContact CG-CE1 4.44Å; L995-Y999 HydrophobicContact CG-CE2 3.66Å; L995-Y999 WeakPolarHBondContact O-CD2 3.47Å; L995-Y999 PolarHBondContact O-N 3.43Å; A996-Y999 PolarHBondContact O-N 3.39Å; Y999-N1001 VanDerWaalsContact C-N 3.34Å; Y999-N1001 PolarHBondContact O-N 3.48Å; Y999-A1002 PolarHBondContact O-N 2.89Å; Y999-A1002 VanDerWaalsContact O-N 3.16Å; Y999-V1003 WeakPolarHBondContact O-CG2 3.45Å; Y999-V1003 PolarHBondContact O-N 3.41Å
1000	V	88.8	Confident	80	Confident	8 Å²	8	64.7 Å²	64.7	5%	0.048	35%	0.349	C	S	.	.	H	α-helix	trans	-54.8	-50.5	174.8	167.3	0	0	0	0	110.6	L889 P973 A996 K997 A1002 V1003 R1004	L889-V1000 HydrophobicContact CD1-CG2 3.65Å; L889-V1000 HydrophobicContact CD2-CG2 4.25Å; L889-V1000 HydrophobicContact CG-CG2 4.07Å; P973-V1000 HydrophobicContact CB-CG2 3.68Å; P973-V1000 HydrophobicContact CG-CG2 4.32Å; A996-V1000 WeakPolarHBondContact O-CG2 3.42Å; A996-V1000 PolarHBondContact O-N 3.07Å; K997-V1000 PolarHBondContact O-N 3.39Å; V1000-A1002 VanDerWaalsContact C-N 3.33Å; V1000-A1002 PolarHBondContact O-N 2.84Å; V1000-V1003 PolarHBondContact O-N 3.24Å; V1000-R1004 HydrophobicContact CG1-CG 4.27Å; V1000-R1004 WeakPolarHBondContact O-CB 3.4Å; V1000-R1004 VanDerWaalsContact O-CG 3.27Å; V1000-R1004 WeakPolarHBondContact O-CG 3.15Å; V1000-R1004 PolarHBondContact O-N 3.33Å
1001	N	88.6	Confident	81.3	Confident	22 Å²	22	63.9 Å²	63.9	12%	0.118	34%	0.344	C	S	.	.	H	α-helix	trans	-63.9	-38.2	179.7	-72.7	-7.3	0	0	0	111.9	K997 K998 Y999 R1004 R1005 V1011	K997-N1001 VanDerWaalsContact O-CB 3.28Å; K997-N1001 WeakPolarHBondContact O-CB 3.33Å; K997-N1001 PolarHBondContact O-N 3.32Å; K998-N1001 PolarHBondContact O-N 3.35Å; Y999-N1001 VanDerWaalsContact C-N 3.34Å; Y999-N1001 PolarHBondContact O-N 3.48Å; N1001-R1004 PolarHBondContact O-N 2.84Å; N1001-R1005 WeakPolarHBondContact O-CB 3.11Å; N1001-R1005 VanDerWaalsContact O-CG 3.27Å; N1001-R1005 WeakPolarHBondContact O-CG 3.41Å; N1001-R1005 PolarHBondContact O-N 2.82Å; N1001-V1011 HydrophobicContact CB-CG1 4.14Å
1002	A	86.4	Confident	82.2	Confident	53 Å²	53	66.1 Å²	66.1	44%	0.438	35%	0.346	S	S	.	.	H	α-helix	trans	-62.9	-46.4	176.3	0	0	0	0	0	111.9	K998 Y999 V1000 R1006	K998-A1002 WeakPolarHBondContact O-CB 3.32Å; K998-A1002 PolarHBondContact O-N 3.27Å; Y999-A1002 PolarHBondContact O-N 2.89Å; Y999-A1002 VanDerWaalsContact O-N 3.16Å; V1000-A1002 VanDerWaalsContact C-N 3.33Å; V1000-A1002 PolarHBondContact O-N 2.84Å; A1002-R1006 PolarHBondContact O-N 2.82Å; A1002-R1006 VanDerWaalsContact O-N 3.11Å
1003	V	86.3	Confident	82.5	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.018	34%	0.336	C	S	.	.	H	α-helix	trans	-65.7	-43.2	177	179.5	0	0	0	0	111	F659 C835 E837 Y999 V1000 R1006 K1007	F659-V1003 HydrophobicContact CD2-CG2 3.58Å; F659-V1003 HydrophobicContact CE2-CG2 3.84Å; C835-V1003 HydrophobicContact CB-CB 4.19Å; C835-V1003 HydrophobicContact CB-CG1 3.7Å; E837-V1003 HydrophobicContact CG-CG1 3.93Å; E837-V1003 WeakPolarHBondContact OE1-CG1 3.45Å; Y999-V1003 WeakPolarHBondContact O-CG2 3.45Å; Y999-V1003 PolarHBondContact O-N 3.41Å; V1000-V1003 PolarHBondContact O-N 3.24Å; V1003-R1006 WeakPolarHBondContact O-CB 3.29Å; V1003-R1006 PolarHBondContact O-N 2.71Å; V1003-K1007 HydrophobicContact CG1-CD 4.34Å; V1003-K1007 PolarHBondContact O-N 2.85Å
1004	R	88.9	Confident	82	Confident	54 Å²	54	68.5 Å²	68.5	20%	0.204	34%	0.343	C	S	.	.	H	α-helix	trans	-61.5	-45.5	177.6	-73.6	180	77.5	93.6	3	112.1	M834 V1000 N1001 R1006 K1007 G1008 L1009 P1010 V1011	M834-R1004 WeakPolarHBondContact O-CD 3.28Å; M834-R1004 PolarHBondContact O-NH1 3.07Å; V1000-R1004 HydrophobicContact CG1-CG 4.27Å; V1000-R1004 WeakPolarHBondContact O-CB 3.4Å; V1000-R1004 VanDerWaalsContact O-CG 3.27Å; V1000-R1004 WeakPolarHBondContact O-CG 3.15Å; V1000-R1004 PolarHBondContact O-N 3.33Å; N1001-R1004 PolarHBondContact O-N 2.84Å; R1004-R1006 VanDerWaalsContact C-N 3.32Å; R1004-R1006 PolarHBondContact O-N 3.2Å; R1004-K1007 PolarHBondContact O-N 3.35Å; R1004-G1008 PolarHBondContact O-N 3.44Å; R1004-G1008 VanDerWaalsContact O-N 3.13Å; R1004-L1009 HydrophobicContact CB-CB 3.93Å; R1004-L1009 HydrophobicContact CG-CB 4.12Å; R1004-L1009 HydrophobicContact CG-CD1 4.19Å; R1004-L1009 PolarHBondContact O-N 3.18Å; R1004-P1010 VanDerWaalsContact CZ-O 3.29Å; R1004-P1010 PolarHBondContact NE-O 3.14Å; R1004-P1010 PolarHBondContact NH2-O 2.76Å; R1004-V1011 HydrophobicContact CB-CG2 3.89Å
1005	R	85.5	Confident	80.6	Confident	132 Å²	132	74.5 Å²	74.5	50%	0.498	37%	0.374	S	S	.	.	H	α-helix	trans	-57.7	-45.7	174.8	-75.5	-177.7	-174.4	119.3	-8.9	111.7	N1001 K1007 G1008 V1011 E1013	N1001-R1005 WeakPolarHBondContact O-CB 3.11Å; N1001-R1005 VanDerWaalsContact O-CG 3.27Å; N1001-R1005 WeakPolarHBondContact O-CG 3.41Å; N1001-R1005 PolarHBondContact O-N 2.82Å; R1005-K1007 PolarHBondContact O-N 3.38Å; R1005-G1008 PolarHBondContact O-N 2.86Å; R1005-G1008 VanDerWaalsContact O-N 3.14Å; R1005-V1011 HydrophobicContact CG-CG2 3.81Å; R1005-E1013 IonicContact CZ-OE1 2.61Å; R1005-E1013 IonicContact CZ-OE2 3.22Å; R1005-E1013 IonicContact NH2-OE1 2.69Å; R1005-E1013 PolarHBondContact NH2-OE1 2.85Å; R1005-E1013 IonicContact NH2-OE2 3.04Å; R1005-E1013 PolarHBondContact NH2-OE2 2.71Å
1006	R	79.5	Confident	78.8	Confident	56 Å²	56	74.9 Å²	74.9	21%	0.211	38%	0.379	C	S	.	.	H	α-helix	trans	-59	-46.6	179.1	-173	-172.5	77.2	-137.6	3.1	111.6	E837 A1002 V1003 R1004 G1008	E837-R1006 IonicContact OE1-CZ 2.83Å; E837-R1006 IonicContact OE1-NH2 3.69Å; E837-R1006 PolarHBondContact OE1-NH2 3.26Å; A1002-R1006 PolarHBondContact O-N 2.82Å; A1002-R1006 VanDerWaalsContact O-N 3.11Å; V1003-R1006 WeakPolarHBondContact O-CB 3.29Å; V1003-R1006 PolarHBondContact O-N 2.71Å; R1004-R1006 VanDerWaalsContact C-N 3.32Å; R1004-R1006 PolarHBondContact O-N 3.2Å; R1006-G1008 PolarHBondContact O-N 3.31Å
1007	K	80.4	Confident	77.2	Confident	48 Å²	48	81.2 Å²	81.2	21%	0.209	41%	0.412	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	3.3	179.2	-67.9	-173.7	-179.8	175.1	0	114.1	C835 D836 E837 V1003 R1004 R1005 L1009	C835-K1007 VanDerWaalsContact O-CD 3.22Å; C835-K1007 WeakPolarHBondContact O-CD 3.48Å; C835-K1007 PolarHBondContact O-NZ 2.85Å; D836-K1007 HydrophobicContact CB-CD 4.17Å; D836-K1007 PolarHBondContact O-NZ 3.23Å; E837-K1007 IonicContact OE1-NZ 2.96Å; E837-K1007 PolarHBondContact OE1-NZ 3.33Å; E837-K1007 IonicContact OE2-NZ 2.57Å; E837-K1007 PolarHBondContact OE2-NZ 2.92Å; V1003-K1007 HydrophobicContact CG1-CD 4.34Å; V1003-K1007 PolarHBondContact O-N 2.85Å; R1004-K1007 PolarHBondContact O-N 3.35Å; R1005-K1007 PolarHBondContact O-N 3.38Å; K1007-L1009 HydrophobicContact CB-CD1 4.18Å; K1007-L1009 HydrophobicContact CB-CG 4.02Å; K1007-L1009 PolarHBondContact O-N 3.4Å
1008	G	80.9	Confident	75.4	Confident	68 Å²	68	82.1 Å²	82.1	70%	0.701	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.9	17.2	-176.3	0	0	0	0	0	114.4	R1004 R1005 R1006	R1004-G1008 PolarHBondContact O-N 3.44Å; R1004-G1008 VanDerWaalsContact O-N 3.13Å; R1005-G1008 PolarHBondContact O-N 2.86Å; R1005-G1008 VanDerWaalsContact O-N 3.14Å; R1006-G1008 PolarHBondContact O-N 3.31Å
1009	L	86	Confident	73.6	Confident	38 Å²	38	79.7 Å²	79.7	20%	0.199	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-77.7	146.3	178.5	-63.1	174.9	0	0	0	111	D836 R1004 K1007 V1011	D836-L1009 HydrophobicContact CB-CD1 4.19Å; D836-L1009 WeakPolarHBondContact OD2-CD2 3.3Å; R1004-L1009 HydrophobicContact CB-CB 3.93Å; R1004-L1009 HydrophobicContact CG-CB 4.12Å; R1004-L1009 HydrophobicContact CG-CD1 4.19Å; R1004-L1009 PolarHBondContact O-N 3.18Å; K1007-L1009 HydrophobicContact CB-CD1 4.18Å; K1007-L1009 HydrophobicContact CB-CG 4.02Å; K1007-L1009 PolarHBondContact O-N 3.4Å; L1009-V1011 PolarHBondContact O-N 3.13Å
1010	P	85.1	Confident	71.8	Confident	99 Å²	99	87.1 Å²	87.1	64%	0.643	45%	0.454	S	S	*	.	P	Polyproline II helix	trans	-64	129.4	-178.1	24.8	-32.9	0	0	0	110.5	R1004	R1004-P1010 VanDerWaalsContact CZ-O 3.29Å; R1004-P1010 PolarHBondContact NE-O 3.14Å; R1004-P1010 PolarHBondContact NH2-O 2.76Å
1011	V	81.5	Confident	70	Confident	38 Å²	38	93 Å²	93	23%	0.23	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-103.1	126.3	175.5	-178.9	0	0	0	0	108.8	N1001 R1004 R1005 L1009 E1013	N1001-V1011 HydrophobicContact CB-CG1 4.14Å; R1004-V1011 HydrophobicContact CB-CG2 3.89Å; R1005-V1011 HydrophobicContact CG-CG2 3.81Å; L1009-V1011 PolarHBondContact O-N 3.13Å; V1011-E1013 HydrophobicContact CG1-CG 3.93Å; V1011-E1013 PolarHBondContact O-N 3.08Å
1012	K	69.7	Low	68.4	Low	201 Å²	201	98.3 Å²	98.3	87%	0.874	50%	0.503	S	S	*	.			trans	-79.3	70	175	-66	-178.3	-178.7	177.1	0	110
1013	E	63.9	Low	66.7	Low	98 Å²	98	106.1 Å²	106.1	46%	0.458	52%	0.522	S	S	.	.			trans	-92.9	119.9	166.9	-87.4	177	171.1	0	0	109.4	R1005 V1011 L1015	R1005-E1013 IonicContact CZ-OE1 2.61Å; R1005-E1013 IonicContact CZ-OE2 3.22Å; R1005-E1013 IonicContact NH2-OE1 2.69Å; R1005-E1013 PolarHBondContact NH2-OE1 2.85Å; R1005-E1013 IonicContact NH2-OE2 3.04Å; R1005-E1013 PolarHBondContact NH2-OE2 2.71Å; V1011-E1013 HydrophobicContact CG1-CG 3.93Å; V1011-E1013 PolarHBondContact O-N 3.08Å; E1013-L1015 PolarHBondContact O-N 3.19Å
1014	K	55.8	Low	65.2	Low	197 Å²	197	110.4 Å²	110.4	86%	0.857	55%	0.548	S	S	*	.			trans	-70.4	87.4	168.2	-76.4	-175.6	178.4	177.7	0	107.6	V1016	K1014-V1016 PolarHBondContact O-N 2.85Å
1015	L	51.9	Low	63.3	Low	158 Å²	158	114.6 Å²	114.6	83%	0.827	57%	0.573	S	S	*	*			trans	-65.8	-11.3	176.4	-110.5	145.9	0	0	0	113.1	E1013	E1013-L1015 PolarHBondContact O-N 3.19Å
1016	V	45.3	Very low	61.9	Low	72 Å²	72	112.7 Å²	112.7	44%	0.436	59%	0.586	S	S	.	*			trans	-132.1	104.6	-178.6	-173.1	0	0	0	0	110	K1014 H1018 A1019	K1014-V1016 PolarHBondContact O-N 2.85Å; V1016-H1018 VanDerWaalsContact C-N 3.3Å; V1016-H1018 PolarHBondContact O-N 2.79Å; V1016-A1019 HydrophobicContact CG1-CB 4.43Å
1017	L	53.6	Low	60.6	Low	134 Å²	134	121 Å²	121	70%	0.702	62%	0.617	S	S	*	*	S	Bend	trans	-69.9	-22.7	176.5	-81.9	154.3	0	0	0	113.2
1018	H	48.8	Very low	58.9	Low	114 Å²	114	127.9 Å²	127.9	53%	0.528	65%	0.647	S	S	.	*			trans	-141.3	76	-177.2	-60.9	-54.8	0	0	0	112.6	V1016 E1020 K1021	V1016-H1018 VanDerWaalsContact C-N 3.3Å; V1016-H1018 PolarHBondContact O-N 2.79Å; H1018-E1020 PolarHBondContact O-N 2.99Å; H1018-K1021 HydrophobicContact CB-CB 4.11Å; H1018-K1021 HydrophobicContact CB-CD 4.19Å; H1018-K1021 HydrophobicContact CB-CG 4.21Å; H1018-K1021 PolarHBondContact O-N 2.89Å
1019	A	50.6	Low	57.3	Low	66 Å²	66	134.8 Å²	134.8	55%	0.545	68%	0.675	S	S	.	*	H	α-helix	trans	-62.3	-27	171.5	0	0	0	0	0	112.3	V1016 K1021 Q1022 R1023	V1016-A1019 HydrophobicContact CG1-CB 4.43Å; A1019-K1021 VanDerWaalsContact C-N 3.31Å; A1019-K1021 PolarHBondContact O-N 3.25Å; A1019-Q1022 PolarHBondContact O-N 3.16Å; A1019-R1023 PolarHBondContact O-N 3.19Å
1020	E	50.5	Low	55.9	Low	170 Å²	170	139.7 Å²	139.7	79%	0.794	70%	0.699	S	S	*	*	H	α-helix	trans	-67.3	-27.6	177.8	-71.8	-175.6	149.9	0	0	113.6	H1018 T1024	H1018-E1020 PolarHBondContact O-N 2.99Å; E1020-T1024 PolarHBondContact O-OG1 3.3Å
1021	K	52	Low	54.3	Low	131 Å²	131	141.8 Å²	141.8	57%	0.57	70%	0.702	S	S	*	*	H	α-helix	trans	-81.1	-26.1	177	-73.4	-177.4	178.4	172.4	0	113.2	H1018 A1019 T1024 L1025	H1018-K1021 HydrophobicContact CB-CB 4.11Å; H1018-K1021 HydrophobicContact CB-CD 4.19Å; H1018-K1021 HydrophobicContact CB-CG 4.21Å; H1018-K1021 PolarHBondContact O-N 2.89Å; A1019-K1021 VanDerWaalsContact C-N 3.31Å; A1019-K1021 PolarHBondContact O-N 3.25Å; K1021-T1024 WeakPolarHBondContact CA-OG1 3.28Å; K1021-T1024 PolarHBondContact O-OG1 2.89Å; K1021-L1025 WeakPolarHBondContact O-CD1 3.19Å; K1021-L1025 PolarHBondContact O-N 3.35Å
1022	Q	53.2	Low	52.8	Low	134 Å²	134	147.6 Å²	147.6	63%	0.626	73%	0.728	S	S	*	*	H	α-helix	trans	-76.2	-31.3	177	-76.5	-172	-20.1	0	0	112.9	A1019	A1019-Q1022 PolarHBondContact O-N 3.16Å
1023	R	52.1	Low	51.9	Low	218 Å²	218	144.4 Å²	144.4	82%	0.823	72%	0.72	S	S	*	*	H	α-helix	trans	-74.3	-24.9	174.3	-89.1	-178.6	163.8	178.8	-4	114	A1019	A1019-R1023 PolarHBondContact O-N 3.19Å
1024	T	54.1	Low	51.1	Low	93 Å²	93	147.3 Å²	147.3	57%	0.571	74%	0.736	S	S	*	*	H	α-helix	trans	-87.3	-23	-178.4	35.3	0	0	0	0	113.8	E1020 K1021 A1026 R1027	E1020-T1024 PolarHBondContact O-OG1 3.3Å; K1021-T1024 WeakPolarHBondContact CA-OG1 3.28Å; K1021-T1024 PolarHBondContact O-OG1 2.89Å; T1024-A1026 VanDerWaalsContact C-N 3.34Å; T1024-R1027 PolarHBondContact O-N 2.8Å
1025	L	49.2	Very low	50.8	Low	141 Å²	141	144 Å²	144	74%	0.738	73%	0.728	S	S	*	*	H	α-helix	trans	-70.7	-25.9	174.8	-82.1	159.2	0	0	0	113.6	K1021 R1027	K1021-L1025 WeakPolarHBondContact O-CD1 3.19Å; K1021-L1025 PolarHBondContact O-N 3.35Å; L1025-R1027 VanDerWaalsContact C-N 3.3Å; L1025-R1027 PolarHBondContact O-N 2.91Å
1026	A	55.7	Low	50.7	Low	92 Å²	92	143 Å²	143	76%	0.76	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	-0.2	177.4	0	0	0	0	0	114.2	T1024	T1024-A1026 VanDerWaalsContact C-N 3.34Å
1027	R	52.9	Low	51.1	Low	230 Å²	230	148.5 Å²	148.5	87%	0.868	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.5	14.2	-173.7	-119.6	179.6	-178.6	-177.3	-0.2	114.6	T1024 L1025	T1024-R1027 PolarHBondContact O-N 2.8Å; L1025-R1027 VanDerWaalsContact C-N 3.3Å; L1025-R1027 PolarHBondContact O-N 2.91Å
1028	K	45	Very low	50.9	Low	193 Å²	193	149.7 Å²	149.7	84%	0.839	75%	0.747	S	S	*	*			trans	-132.7	72.5	172.9	-73.6	-173.1	175.9	-177.9	0	110.7
1029	V	46.9	Very low	51.1	Low	214 Å²	214	152.9 Å²	152.9	100%	1.297	77%	0.766	S	S	*	*			trans	-140	0	151.3	178.9	0	0	0	0	106.9

Retrieved 1,029 of 1,029 residues in 2751.5 ms (Link to these results)

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