G4VGG1_SCHMA Loading...

Putative proteasome inhibitor

AlphaFold DB , UniProt , Accession G4VGG1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 316 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.1	Very low	45.1	Very low	241 Å²	241	143.2 Å²	143.2	100%	1.187	86%	0.864	S	S	*	*				0	98.8	0	-72.8	-172.8	158.4	0	0	106.5
2	S	54.1	Low	45	Very low	120 Å²	120	141.8 Å²	141.8	84%	0.839	86%	0.856	S	S	*	*			cis	-150.8	137.7	6.4	-62.6	0	0	0	0	106.8
3	E	47.5	Very low	44.2	Very low	180 Å²	180	138.6 Å²	138.6	84%	0.841	85%	0.845	S	S	*	*			trans	-95.3	145.9	174.6	-62.2	176.7	119.2	0	0	109
4	D	54.5	Low	44.1	Very low	165 Å²	165	137.6 Å²	137.6	88%	0.882	84%	0.842	S	S	*	*			trans	-176.5	88.9	153.5	-95.2	-21.4	0	0	0	106.1
5	S	49.5	Very low	43.7	Very low	114 Å²	114	140.1 Å²	140.1	80%	0.797	84%	0.843	S	S	*	*				64.3	117.3	66.7	-71.1	0	0	0	0	115.4
6	S	40.8	Very low	43.1	Very low	121 Å²	121	139.3 Å²	139.3	85%	0.846	84%	0.842	S	S	*	*			trans	-78.3	144.5	-175	167.1	0	0	0	0	113.7
7	S	44.5	Very low	42.7	Very low	119 Å²	119	135.1 Å²	135.1	83%	0.832	83%	0.834	S	S	*	*			trans	-172.4	130.9	140.1	59	0	0	0	0	106.9
8	G	36.7	Very low	42.6	Very low	77 Å²	77	131.9 Å²	131.9	79%	0.794	82%	0.824	S	S	*	*			cis	108.3	56.3	38	0	0	0	0	0	109.3	H10	G8-H10 PolarHBondContact O-N 3.2Å
9	A	43.7	Very low	43.1	Very low	97 Å²	97	130.4 Å²	130.4	80%	0.802	82%	0.818	S	S	*	*			trans	-93	96.8	177.5	0	0	0	0	0	110.1	L11	A9-L11 PolarHBondContact O-N 3.18Å
10	H	38.9	Very low	43.9	Very low	173 Å²	173	127 Å²	127	80%	0.801	79%	0.794	S	S	*	*			trans	-75.1	104.3	171.9	-151.9	-64.5	0	0	0	108.4	G8 T12	G8-H10 PolarHBondContact O-N 3.2Å; H10-T12 PolarHBondContact O-N 3.41Å
11	L	41	Very low	45.2	Very low	168 Å²	168	127.6 Å²	127.6	88%	0.88	79%	0.785	S	S	*	*			trans	-69.4	103.7	169	-89.8	132.4	0	0	0	109	A9	A9-L11 PolarHBondContact O-N 3.18Å
12	T	43.3	Very low	46.9	Very low	126 Å²	126	117.3 Å²	117.3	77%	0.773	73%	0.733	S	S	*	*			trans	-78.9	112.5	165	40.6	0	0	0	0	109.2	H10	H10-T12 PolarHBondContact O-N 3.41Å
13	S	35.8	Very low	48.5	Very low	101 Å²	101	112.7 Å²	112.7	71%	0.706	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-63.6	140.7	171	55.2	0	0	0	0	111.4	M15	S13-M15 PolarHBondContact O-N 3.16Å
14	P	41.9	Very low	50.5	Low	125 Å²	125	109.3 Å²	109.3	81%	0.812	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-69.6	126.2	173.8	28.7	-31.2	0	0	0	110
15	M	38.9	Very low	52.2	Low	174 Å²	174	105.9 Å²	105.9	86%	0.857	68%	0.683	S	S	*	*	P	Polyproline II helix	trans	-62.2	130.6	175.1	-78.6	-77.1	-74.1	0	0	110.7	S13	S13-M15 PolarHBondContact O-N 3.16Å
16	P	33.9	Very low	54.3	Low	127 Å²	127	103.8 Å²	103.8	83%	0.825	66%	0.661	S	S	*	*	S	Bend	trans	-84.3	116.7	174.3	32.5	-27.8	0	0	0	108.8
17	G	35.5	Very low	56.7	Low	69 Å²	69	99.7 Å²	99.7	71%	0.711	63%	0.631	S	S	*	*			trans	145.8	31.1	169.6	0	0	0	0	0	117.5	S19	G17-S19 VanDerWaalsContact C-N 3.28Å; G17-S19 PolarHBondContact O-N 3.28Å
18	A	42.1	Very low	59	Low	78 Å²	78	97.6 Å²	97.6	65%	0.645	62%	0.616	S	S	*	*			trans	-70.6	88.6	167.5	0	0	0	0	0	109.2	N20	A18-N20 PolarHBondContact O-N 3.43Å
19	S	51.7	Low	61.6	Low	102 Å²	102	95.8 Å²	95.8	71%	0.713	59%	0.588	S	S	*	*			trans	-61.7	116	164.3	53.4	0	0	0	0	108.2	G17 K21	G17-S19 VanDerWaalsContact C-N 3.28Å; G17-S19 PolarHBondContact O-N 3.28Å; S19-K21 PolarHBondContact O-N 3.5Å
20	N	58.1	Low	64	Low	63 Å²	63	91.3 Å²	91.3	34%	0.337	55%	0.55	S	S	.	*			trans	-57.1	122.9	175.2	-67.3	-17.4	0	0	0	109.1	A18 R22 N153	A18-N20 PolarHBondContact O-N 3.43Å; N20-R22 PolarHBondContact O-N 3.19Å; N20-N153 PolarHBondContact OD1-ND2 3.35Å
21	K	72.7	Confident	66.5	Low	140 Å²	140	86 Å²	86	61%	0.609	53%	0.528	S	S	*	.	S	Bend	trans	-64.4	-22.6	175.8	-110.5	178.3	177.4	177.1	0	112.4	S19 N160 D164	S19-K21 PolarHBondContact O-N 3.5Å; K21-N160 PolarHBondContact N-OD1 3.3Å; K21-N160 VanDerWaalsContact N-OD1 3.08Å; K21-D164 IonicContact NZ-OD1 3.65Å; K21-D164 PolarHBondContact NZ-OD1 3.08Å; K21-D164 IonicContact NZ-OD2 3.62Å; K21-D164 PolarHBondContact NZ-OD2 3.12Å
22	R	80.1	Confident	68.9	Low	24 Å²	24	83.1 Å²	83.1	9%	0.091	51%	0.506	C	S	.	.	S	Bend	trans	-69.4	137.4	179.7	-65.1	-173.6	106.1	-142	3.9	110.3	N20 E26 S54 E55 L163	N20-R22 PolarHBondContact O-N 3.19Å; R22-E26 HydrophobicContact CB-CB 4.13Å; R22-E26 PolarHBondContact NH1-O 2.75Å; R22-S54 PolarHBondContact NH2-OG 2.91Å; R22-S54 VanDerWaalsContact NH2-OG 3.15Å; R22-E55 IonicContact CZ-OE1 3.93Å; R22-E55 IonicContact NE-OE1 2.78Å; R22-E55 PolarHBondContact NE-OE1 3.14Å; R22-E55 IonicContact NH2-OE1 2.65Å; R22-E55 PolarHBondContact NH2-OE1 2.88Å; R22-L163 HydrophobicContact CG-CD1 3.39Å
23	G	87	Confident	71.3	Confident	24 Å²	24	77.1 Å²	77.1	25%	0.247	47%	0.469	C	S	.	.			trans	-65.7	169.8	169.2	0	0	0	0	0	111.8	V25 E26 T27	G23-V25 PolarHBondContact O-N 2.79Å; G23-E26 WeakPolarHBondContact CA-OE2 3.47Å; G23-E26 PolarHBondContact N-OE2 2.79Å; G23-E26 VanDerWaalsContact N-OE2 3.13Å; G23-E26 PolarHBondContact O-N 3.18Å; G23-T27 WeakPolarHBondContact O-CB 3.39Å; G23-T27 PolarHBondContact O-N 3.36Å; G23-T27 PolarHBondContact O-OG1 2.73Å
24	P	89.6	Confident	73.9	Confident	108 Å²	108	72.4 Å²	72.4	70%	0.701	44%	0.436	S	S	*	.	H	α-helix	trans	-63.8	-30.1	-178.3	24.9	-33.9	0	0	0	112.5	S28	P24-S28 WeakPolarHBondContact O-CB 3.45Å; P24-S28 PolarHBondContact O-N 3.34Å; P24-S28 VanDerWaalsContact O-N 3.07Å; P24-S28 PolarHBondContact O-OG 3.16Å
25	V	91.2	Very high	76.1	Confident	94 Å²	94	70.1 Å²	70.1	57%	0.57	42%	0.423	S	S	*	.	H	α-helix	trans	-72	-49	180	177.3	0	0	0	0	110.3	G23 T27 S28 I29	G23-V25 PolarHBondContact O-N 2.79Å; V25-T27 VanDerWaalsContact C-N 3.3Å; V25-T27 PolarHBondContact O-N 3.36Å; V25-S28 WeakPolarHBondContact O-CB 3.2Å; V25-S28 PolarHBondContact O-N 2.89Å; V25-I29 HydrophobicContact CG1-CD1 3.96Å; V25-I29 WeakPolarHBondContact O-CG1 3.31Å; V25-I29 PolarHBondContact O-N 3.39Å
26	E	92.3	Very high	78.5	Confident	69 Å²	69	66.5 Å²	66.5	32%	0.322	40%	0.403	S	S	.	.	H	α-helix	trans	-60.9	-43.4	179.3	-61.3	84.8	172.6	0	0	110.4	R22 G23 I29 L30	R22-E26 HydrophobicContact CB-CB 4.13Å; R22-E26 PolarHBondContact NH1-O 2.75Å; G23-E26 WeakPolarHBondContact CA-OE2 3.47Å; G23-E26 PolarHBondContact N-OE2 2.79Å; G23-E26 VanDerWaalsContact N-OE2 3.13Å; G23-E26 PolarHBondContact O-N 3.18Å; E26-I29 PolarHBondContact O-N 2.95Å; E26-L30 PolarHBondContact O-N 3.48Å
27	T	91.8	Very high	81.2	Confident	35 Å²	35	60.6 Å²	60.6	22%	0.215	36%	0.364	C	S	.	.	H	α-helix	trans	-57.4	-50.3	174.6	-54.3	0	0	0	0	111	G23 V25 I29 L30 D31	G23-T27 WeakPolarHBondContact O-CB 3.39Å; G23-T27 PolarHBondContact O-N 3.36Å; G23-T27 PolarHBondContact O-OG1 2.73Å; V25-T27 VanDerWaalsContact C-N 3.3Å; V25-T27 PolarHBondContact O-N 3.36Å; T27-I29 VanDerWaalsContact C-N 3.28Å; T27-I29 PolarHBondContact O-N 3.01Å; T27-L30 PolarHBondContact O-N 3.26Å; T27-L30 VanDerWaalsContact O-N 3.12Å; T27-D31 PolarHBondContact O-N 3.14Å
28	S	92	Very high	83.8	Confident	76 Å²	76	57.3 Å²	57.3	53%	0.531	33%	0.33	S	S	.	.	H	α-helix	trans	-60.1	-35.7	177.7	-57.5	0	0	0	0	113	P24 V25 Y32	P24-S28 WeakPolarHBondContact O-CB 3.45Å; P24-S28 PolarHBondContact O-N 3.34Å; P24-S28 VanDerWaalsContact O-N 3.07Å; P24-S28 PolarHBondContact O-OG 3.16Å; V25-S28 WeakPolarHBondContact O-CB 3.2Å; V25-S28 PolarHBondContact O-N 2.89Å; S28-Y32 WeakPolarHBondContact O-CB 3.45Å; S28-Y32 PolarHBondContact O-N 3.22Å
29	I	93.2	Very high	85.9	Confident	39 Å²	39	58.1 Å²	58.1	20%	0.2	33%	0.331	C	S	.	.	H	α-helix	trans	-66.4	-43.6	176.6	-69.2	166.5	0	0	0	110.7	V25 E26 T27 Y32 V33 L57 S58	V25-I29 HydrophobicContact CG1-CD1 3.96Å; V25-I29 WeakPolarHBondContact O-CG1 3.31Å; V25-I29 PolarHBondContact O-N 3.39Å; E26-I29 PolarHBondContact O-N 2.95Å; T27-I29 VanDerWaalsContact C-N 3.28Å; T27-I29 PolarHBondContact O-N 3.01Å; I29-Y32 PolarHBondContact O-N 2.86Å; I29-V33 HydrophobicContact CG2-CG2 4.48Å; I29-V33 VanDerWaalsContact O-CG2 3.3Å; I29-V33 WeakPolarHBondContact O-CG2 3.42Å; I29-V33 PolarHBondContact O-N 3.24Å; I29-L57 HydrophobicContact CG2-CB 3.92Å; I29-L57 HydrophobicContact CG2-CD1 4.12Å; I29-S58 WeakPolarHBondContact CD1-OG 3.34Å
30	L	93.3	Very high	87.6	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-66.3	-42.9	178	175	63.2	0	0	0	111.6	E26 T27 Y32 V33 L34 L51 A152 F156 L159	E26-L30 PolarHBondContact O-N 3.48Å; T27-L30 PolarHBondContact O-N 3.26Å; T27-L30 VanDerWaalsContact O-N 3.12Å; L30-Y32 VanDerWaalsContact C-N 3.28Å; L30-Y32 PolarHBondContact O-N 3.26Å; L30-V33 PolarHBondContact O-N 3.07Å; L30-V33 VanDerWaalsContact O-N 3.15Å; L30-L34 HydrophobicContact CD1-CD1 3.93Å; L30-L34 HydrophobicContact CD1-CD2 4.45Å; L30-L34 HydrophobicContact CD1-CG 3.88Å; L30-L34 HydrophobicContact CG-CD1 3.91Å; L30-L34 HydrophobicContact CG-CG 4.28Å; L30-L34 WeakPolarHBondContact O-CB 3.37Å; L30-L34 WeakPolarHBondContact O-CG 3.31Å; L30-L34 PolarHBondContact O-N 2.9Å; L30-L51 HydrophobicContact CD1-CD1 3.86Å; L30-L51 HydrophobicContact CD2-CD1 3.86Å; L30-A152 HydrophobicContact CD2-CB 3.62Å; L30-A152 HydrophobicContact CG-CB 4.26Å; L30-F156 HydrophobicContact CD1-CE2 4.38Å; L30-L159 HydrophobicContact CD2-CD1 4.45Å; L30-L159 HydrophobicContact CD2-CD2 4.39Å
31	D	91.6	Very high	89.1	Confident	63 Å²	63	52.4 Å²	52.4	34%	0.337	29%	0.294	S	S	.	.	H	α-helix	trans	-60.5	-40.9	176.1	-65.6	-21.2	0	0	0	111.2	T27 S35	T27-D31 PolarHBondContact O-N 3.14Å; D31-S35 VanDerWaalsContact O-CB 3.25Å; D31-S35 WeakPolarHBondContact O-CB 3.38Å; D31-S35 PolarHBondContact O-N 3.17Å; D31-S35 PolarHBondContact O-OG 3.44Å
32	Y	91.2	Very high	89.8	Confident	107 Å²	107	53.7 Å²	53.7	42%	0.42	30%	0.299	S	S	.	.	H	α-helix	trans	-61.2	-47.4	172.9	173.2	-99.2	0	0	0	112.1	S28 I29 L30 S35 F36	S28-Y32 WeakPolarHBondContact O-CB 3.45Å; S28-Y32 PolarHBondContact O-N 3.22Å; I29-Y32 PolarHBondContact O-N 2.86Å; L30-Y32 VanDerWaalsContact C-N 3.28Å; L30-Y32 PolarHBondContact O-N 3.26Å; Y32-S35 WeakPolarHBondContact CA-OG 3.48Å; Y32-S35 PolarHBondContact O-OG 3.12Å; Y32-F36 WeakPolarHBondContact O-CB 3.49Å; Y32-F36 PolarHBondContact O-N 3.24Å
33	V	92.6	Very high	90.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-45.2	179.9	169.6	0	0	0	0	111.2	I29 L30 F36 H37 L50 L57	I29-V33 HydrophobicContact CG2-CG2 4.48Å; I29-V33 VanDerWaalsContact O-CG2 3.3Å; I29-V33 WeakPolarHBondContact O-CG2 3.42Å; I29-V33 PolarHBondContact O-N 3.24Å; L30-V33 PolarHBondContact O-N 3.07Å; L30-V33 VanDerWaalsContact O-N 3.15Å; V33-F36 PolarHBondContact O-N 2.87Å; V33-H37 WeakPolarHBondContact O-CB 3.47Å; V33-H37 PolarHBondContact O-N 3.12Å; V33-L50 HydrophobicContact CG1-CB 3.91Å; V33-L50 HydrophobicContact CG1-CD1 4.36Å; V33-L50 HydrophobicContact CG1-CD2 3.85Å; V33-L50 HydrophobicContact CG1-CG 4.25Å; V33-L57 HydrophobicContact CG2-CD1 3.99Å
34	L	91.5	Very high	90.5	Very high	1 Å²	1	56.7 Å²	56.7	1%	0.005	31%	0.307	C	S	.	.	H	α-helix	trans	-66.4	-43.7	179.1	-70.7	175.3	0	0	0	112	L30 F36 G38 F47 L50 Y149 A152 F156	L30-L34 HydrophobicContact CD1-CD1 3.93Å; L30-L34 HydrophobicContact CD1-CD2 4.45Å; L30-L34 HydrophobicContact CD1-CG 3.88Å; L30-L34 HydrophobicContact CG-CD1 3.91Å; L30-L34 HydrophobicContact CG-CG 4.28Å; L30-L34 WeakPolarHBondContact O-CB 3.37Å; L30-L34 WeakPolarHBondContact O-CG 3.31Å; L30-L34 PolarHBondContact O-N 2.9Å; L34-F36 VanDerWaalsContact C-N 3.28Å; L34-F36 PolarHBondContact O-N 3.22Å; L34-G38 WeakPolarHBondContact O-CA 3.49Å; L34-G38 PolarHBondContact O-N 3.01Å; L34-F47 HydrophobicContact CD2-CD1 4.17Å; L34-F47 HydrophobicContact CD2-CE1 4.42Å; L34-L50 HydrophobicContact CD2-CD1 4.13Å; L34-Y149 HydrophobicContact CB-CD1 4.49Å; L34-Y149 HydrophobicContact CB-CG 4.32Å; L34-A152 HydrophobicContact CD1-CB 4.22Å; L34-F156 HydrophobicContact CD1-CE2 4.24Å; L34-F156 HydrophobicContact CD2-CE2 4.2Å
35	S	88.8	Confident	90.7	Very high	78 Å²	78	51.6 Å²	51.6	55%	0.545	27%	0.274	S	S	.	.	H	α-helix	trans	-64	-34.3	177.6	58.7	0	0	0	0	112.7	D31 Y32	D31-S35 VanDerWaalsContact O-CB 3.25Å; D31-S35 WeakPolarHBondContact O-CB 3.38Å; D31-S35 PolarHBondContact O-N 3.17Å; D31-S35 PolarHBondContact O-OG 3.44Å; Y32-S35 WeakPolarHBondContact CA-OG 3.48Å; Y32-S35 PolarHBondContact O-OG 3.12Å
36	F	88.7	Confident	90.9	Very high	98 Å²	98	47.1 Å²	47.1	43%	0.43	25%	0.247	S	C	.	.	H	α-helix	trans	-82.2	-43.8	-179.8	-166.2	-83.1	0	0	0	113.3	Y32 V33 L34 V72	Y32-F36 WeakPolarHBondContact O-CB 3.49Å; Y32-F36 PolarHBondContact O-N 3.24Å; V33-F36 PolarHBondContact O-N 2.87Å; L34-F36 VanDerWaalsContact C-N 3.28Å; L34-F36 PolarHBondContact O-N 3.22Å; F36-V72 HydrophobicContact CD1-CG1 4.08Å; F36-V72 HydrophobicContact CD1-CG2 4.3Å; F36-V72 HydrophobicContact CE1-CB 4.28Å; F36-V72 HydrophobicContact CE1-CG1 3.31Å; F36-V72 HydrophobicContact CE1-CG2 3.94Å; F36-V72 HydrophobicContact CE2-CG2 4.43Å; F36-V72 HydrophobicContact CZ-CG1 3.82Å; F36-V72 HydrophobicContact CZ-CG2 4Å
37	H	90.6	Very high	90.9	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.009	23%	0.232	C	C	.	.	H	α-helix	trans	-106.4	-18.3	-171.2	-68.2	-73.3	0	0	0	114.8	V33 S39 N40 L50 L73 L78	V33-H37 WeakPolarHBondContact O-CB 3.47Å; V33-H37 PolarHBondContact O-N 3.12Å; H37-S39 VanDerWaalsContact C-N 3.26Å; H37-S39 PolarHBondContact O-N 3.42Å; H37-N40 WeakPolarHBondContact O-CB 3.4Å; H37-N40 PolarHBondContact O-N 3.26Å; H37-L50 HydrophobicContact CB-CD1 3.69Å; H37-L50 HydrophobicContact CB-CD2 3.56Å; H37-L50 HydrophobicContact CB-CG 4.29Å; H37-L73 PolarHBondContact CE1-N 2.9Å; H37-L73 VanDerWaalsContact CE1-N 3.27Å; H37-L73 PolarHBondContact CE1-O 3.22Å; H37-L73 PolarHBondContact NE2-N 3.22Å; H37-L78 HydrophobicContact CB-CD1 4.14Å
38	G	88.8	Confident	91.1	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-59.6	-34.7	-170.7	0	0	0	0	0	113.3	L34 N40 C41 Y149	L34-G38 WeakPolarHBondContact O-CA 3.49Å; L34-G38 PolarHBondContact O-N 3.01Å; G38-N40 PolarHBondContact O-N 3.39Å; G38-N40 VanDerWaalsContact O-N 3.17Å; G38-C41 WeakPolarHBondContact O-CB 3.45Å; G38-C41 PolarHBondContact O-N 2.58Å; G38-Y149 WeakPolarHBondContact CA-OH 3.34Å; G38-Y149 PolarHBondContact O-OH 3.41Å; G38-Y149 VanDerWaalsContact O-OH 3.05Å
39	S	87.6	Confident	91.3	Very high	95 Å²	95	38.6 Å²	38.6	66%	0.664	20%	0.196	S	C	*	.	G	3₁₀ helix	trans	-63.8	-18.4	175.9	56.9	0	0	0	0	114.3	H37	H37-S39 VanDerWaalsContact C-N 3.26Å; H37-S39 PolarHBondContact O-N 3.42Å
40	N	87.3	Confident	91.3	Very high	33 Å²	33	36.8 Å²	36.8	18%	0.176	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-91.5	-10.5	176.5	-56.8	-47.7	0	0	0	112.6	H37 G38 L78 F79	H37-N40 WeakPolarHBondContact O-CB 3.4Å; H37-N40 PolarHBondContact O-N 3.26Å; G38-N40 PolarHBondContact O-N 3.39Å; G38-N40 VanDerWaalsContact O-N 3.17Å; N40-L78 HydrophobicContact CB-CD1 4.39Å; N40-F79 HydrophobicContact CB-CZ 4.23Å; N40-F79 WeakPolarHBondContact O-CE1 3.38Å
41	C	89.1	Confident	91.4	Very high	12 Å²	12	36.7 Å²	36.7	8%	0.081	19%	0.186	C	C	.	.			trans	-82.1	132.7	-178.1	-66.6	0	0	0	0	110.7	G38 S46 F47 L50	G38-C41 WeakPolarHBondContact O-CB 3.45Å; G38-C41 PolarHBondContact O-N 2.58Å; C41-S46 VanDerWaalsContact CA-OG 3.3Å; C41-S46 WeakPolarHBondContact CA-OG 3.45Å; C41-S46 WeakPolarHBondContact CB-OG 3.3Å; C41-F47 HydrophobicContact CB-CD1 4.3Å; C41-F47 HydrophobicContact CB-CD2 3.94Å; C41-F47 HydrophobicContact CB-CE1 3.89Å; C41-F47 HydrophobicContact CB-CE2 3.48Å; C41-F47 VanDerWaalsContact CB-CE2 3.48Å; C41-F47 HydrophobicContact CB-CG 4.31Å; C41-F47 HydrophobicContact CB-CZ 3.42Å; C41-F47 VanDerWaalsContact CB-CZ 3.42Å; C41-L50 WeakPolarHBondContact SG-CD1 2.87Å
42	K	86.5	Confident	91.7	Very high	168 Å²	168	33.7 Å²	33.7	73%	0.73	17%	0.17	S	C	*	.			trans	-118.8	-28.8	-177.2	-67.6	-178.9	179.7	172.8	0	113.5	S46 F79	K42-S46 PolarHBondContact N-OG 3.43Å; K42-F79 HydrophobicContact CD-CD1 4.45Å; K42-F79 HydrophobicContact CD-CE1 4.26Å
43	N	90.4	Very high	91.9	Very high	53 Å²	53	28.6 Å²	28.6	28%	0.283	15%	0.15	S	C	.	.	S	Bend	trans	-127.1	170.6	-173.1	68.2	-3.2	0	0	0	110.1	A45 S46 F47 E111	N43-A45 VanDerWaalsContact C-N 3.3Å; N43-A45 PolarHBondContact O-N 3.27Å; N43-S46 PolarHBondContact N-OG 2.72Å; N43-S46 PolarHBondContact O-N 3.09Å; N43-S46 PolarHBondContact O-OG 2.95Å; N43-S46 WeakPolarHBondContact OD1-CB 3.47Å; N43-S46 PolarHBondContact OD1-N 2.73Å; N43-S46 PolarHBondContact OD1-OG 2.66Å; N43-F47 WeakPolarHBondContact O-CD2 3.47Å; N43-E111 VanDerWaalsContact CB-OE2 3.24Å; N43-E111 WeakPolarHBondContact CB-OE2 3.39Å
44	R	92.6	Very high	92	Very high	58 Å²	58	28.6 Å²	28.6	22%	0.219	15%	0.15	C	C	.	.	H	α-helix	trans	-69.4	-33.7	-177.1	-58.6	-171.5	170.6	85.6	-4.2	111.3	S46 F47 I48 E111 I116 G135 V139 L141	R44-S46 VanDerWaalsContact C-N 3.26Å; R44-S46 PolarHBondContact O-N 2.78Å; R44-F47 PolarHBondContact O-N 2.85Å; R44-F47 VanDerWaalsContact O-N 3.16Å; R44-I48 WeakPolarHBondContact O-CG1 3.08Å; R44-I48 PolarHBondContact O-N 3.25Å; R44-E111 PolarHBondContact N-OE2 3.45Å; R44-I116 HydrophobicContact CB-CD1 3.51Å; R44-G135 WeakPolarHBondContact CD-O 3.44Å; R44-G135 PolarHBondContact NE-O 3.46Å; R44-V139 HydrophobicContact CB-CB 4.04Å; R44-V139 HydrophobicContact CB-CG1 4.33Å; R44-V139 HydrophobicContact CB-CG2 4.25Å; R44-V139 HydrophobicContact CG-CB 4Å; R44-V139 HydrophobicContact CG-CG1 4.2Å; R44-V139 PolarHBondContact NE-O 2.84Å; R44-L141 HydrophobicContact CG-CD1 3.87Å; R44-L141 HydrophobicContact CG-CD2 4.05Å; R44-L141 HydrophobicContact CG-CG 3.96Å
45	A	94.2	Very high	92.1	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.008	15%	0.153	C	C	.	.	H	α-helix	trans	-50.9	-46.9	173.7	0	0	0	0	0	111.7	N43 F47 I48 A49 I83 V109 E111	N43-A45 VanDerWaalsContact C-N 3.3Å; N43-A45 PolarHBondContact O-N 3.27Å; A45-F47 PolarHBondContact O-N 2.96Å; A45-I48 PolarHBondContact O-N 3.22Å; A45-A49 WeakPolarHBondContact O-CB 3.5Å; A45-A49 PolarHBondContact O-N 2.9Å; A45-I83 HydrophobicContact CB-CD1 4.03Å; A45-V109 HydrophobicContact CB-CG1 4.15Å; A45-E111 HydrophobicContact CB-CB 3.62Å; A45-E111 PolarHBondContact N-OE2 3.09Å
46	S	94.1	Very high	92.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-64.5	-39.2	-178.3	61.8	0	0	0	0	112.6	C41 K42 N43 R44 A49 L50	C41-S46 VanDerWaalsContact CA-OG 3.3Å; C41-S46 WeakPolarHBondContact CA-OG 3.45Å; C41-S46 WeakPolarHBondContact CB-OG 3.3Å; K42-S46 PolarHBondContact N-OG 3.43Å; N43-S46 PolarHBondContact N-OG 2.72Å; N43-S46 PolarHBondContact O-N 3.09Å; N43-S46 PolarHBondContact O-OG 2.95Å; N43-S46 WeakPolarHBondContact OD1-CB 3.47Å; N43-S46 PolarHBondContact OD1-N 2.73Å; N43-S46 PolarHBondContact OD1-OG 2.66Å; R44-S46 VanDerWaalsContact C-N 3.26Å; R44-S46 PolarHBondContact O-N 2.78Å; S46-A49 PolarHBondContact O-N 2.94Å; S46-L50 WeakPolarHBondContact O-CG 3.28Å; S46-L50 PolarHBondContact O-N 2.85Å
47	F	93.7	Very high	92.6	Very high	1 Å²	1	21.6 Å²	21.6	0%	0.004	11%	0.111	C	C	.	.	H	α-helix	trans	-68.4	-41.7	173.8	-76.2	-73.4	0	0	0	112.8	L34 C41 N43 R44 A45 A49 L50 L51 V139 L141 V144 Y149 V155 F156	L34-F47 HydrophobicContact CD2-CD1 4.17Å; L34-F47 HydrophobicContact CD2-CE1 4.42Å; C41-F47 HydrophobicContact CB-CD1 4.3Å; C41-F47 HydrophobicContact CB-CD2 3.94Å; C41-F47 HydrophobicContact CB-CE1 3.89Å; C41-F47 HydrophobicContact CB-CE2 3.48Å; C41-F47 VanDerWaalsContact CB-CE2 3.48Å; C41-F47 HydrophobicContact CB-CG 4.31Å; C41-F47 HydrophobicContact CB-CZ 3.42Å; C41-F47 VanDerWaalsContact CB-CZ 3.42Å; N43-F47 WeakPolarHBondContact O-CD2 3.47Å; R44-F47 PolarHBondContact O-N 2.85Å; R44-F47 VanDerWaalsContact O-N 3.16Å; A45-F47 PolarHBondContact O-N 2.96Å; F47-A49 VanDerWaalsContact C-N 3.31Å; F47-A49 PolarHBondContact O-N 2.91Å; F47-L50 PolarHBondContact O-N 3.24Å; F47-L51 PolarHBondContact O-N 3.3Å; F47-V139 HydrophobicContact CB-CG1 3.84Å; F47-V139 HydrophobicContact CB-CG2 4.32Å; F47-V139 HydrophobicContact CD2-CG1 4.08Å; F47-V139 HydrophobicContact CG-CG1 4.11Å; F47-L141 HydrophobicContact CD2-CD2 3.95Å; F47-L141 HydrophobicContact CE2-CD2 4Å; F47-V144 HydrophobicContact CE1-CG1 4.45Å; F47-V144 HydrophobicContact CE1-CG2 4.17Å; F47-V144 HydrophobicContact CE2-CG1 4.07Å; F47-V144 HydrophobicContact CE2-CG2 3.78Å; F47-V144 HydrophobicContact CZ-CB 4.17Å; F47-V144 HydrophobicContact CZ-CG1 3.48Å; F47-V144 VanDerWaalsContact CZ-CG1 3.48Å; F47-V144 HydrophobicContact CZ-CG2 3.52Å; F47-Y149 HydrophobicContact CE1-CE1 4.21Å; F47-V155 HydrophobicContact CB-CG1 4.46Å; F47-V155 HydrophobicContact CD1-CG1 3.6Å; F47-V155 HydrophobicContact CE1-CG1 4.08Å; F47-V155 HydrophobicContact CG-CG1 4.08Å; F47-F156 HydrophobicContact CB-CE1 4.07Å; F47-F156 HydrophobicContact CB-CZ 4.07Å; F47-F156 WeakPolarHBondContact O-CZ 3.3Å
48	I	95.2	Very high	92.7	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-61.5	-42.1	173.9	-65.5	-60.5	0	0	0	110.6	R44 A45 L50 L51 V52 V109 I116 V118 L133 V139 F156 L162 F166	R44-I48 WeakPolarHBondContact O-CG1 3.08Å; R44-I48 PolarHBondContact O-N 3.25Å; A45-I48 PolarHBondContact O-N 3.22Å; I48-L50 VanDerWaalsContact C-N 3.33Å; I48-L50 PolarHBondContact O-N 2.82Å; I48-L51 PolarHBondContact O-N 2.99Å; I48-L51 VanDerWaalsContact O-N 3.15Å; I48-V52 HydrophobicContact CG2-CG2 4.45Å; I48-V52 WeakPolarHBondContact O-CG2 3.09Å; I48-V52 PolarHBondContact O-N 3.25Å; I48-V109 HydrophobicContact CB-CG1 4.43Å; I48-V109 HydrophobicContact CG2-CG1 4.2Å; I48-I116 HydrophobicContact CB-CG2 4.44Å; I48-I116 HydrophobicContact CG1-CD1 3.84Å; I48-I116 HydrophobicContact CG1-CG2 4.37Å; I48-I116 HydrophobicContact CG2-CG2 4.33Å; I48-V118 HydrophobicContact CG2-CG2 3.59Å; I48-L133 HydrophobicContact CD1-CD1 4.02Å; I48-L133 HydrophobicContact CG1-CD1 4.39Å; I48-L133 HydrophobicContact CG2-CD1 4.26Å; I48-V139 HydrophobicContact CD1-CG2 3.58Å; I48-V139 HydrophobicContact CG1-CG2 3.82Å; I48-F156 HydrophobicContact CD1-CE1 4.29Å; I48-L162 HydrophobicContact CD1-CD1 4.48Å; I48-L162 HydrophobicContact CD1-CD2 3.72Å; I48-F166 HydrophobicContact CG2-CZ 4.29Å
49	A	95.5	Very high	92.7	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.3	-40.7	175.2	0	0	0	0	0	112	A45 S46 F47 V52 H53 I83 M85 V109	A45-A49 WeakPolarHBondContact O-CB 3.5Å; A45-A49 PolarHBondContact O-N 2.9Å; S46-A49 PolarHBondContact O-N 2.94Å; F47-A49 VanDerWaalsContact C-N 3.31Å; F47-A49 PolarHBondContact O-N 2.91Å; A49-V52 PolarHBondContact O-N 2.81Å; A49-H53 VanDerWaalsContact O-CB 3.29Å; A49-H53 WeakPolarHBondContact O-CB 3.29Å; A49-H53 PolarHBondContact O-N 3.21Å; A49-I83 HydrophobicContact CB-CD1 4.07Å; A49-I83 HydrophobicContact CB-CG2 3.96Å; A49-M85 HydrophobicContact CB-CE 4.04Å; A49-V109 HydrophobicContact CB-CB 4.3Å; A49-V109 HydrophobicContact CB-CG2 3.99Å
50	L	94.9	Very high	92.8	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-64	-38.8	173.5	-70.3	-167.6	0	0	0	113	V33 L34 H37 C41 S46 F47 I48 H53 S54 L73 L78	V33-L50 HydrophobicContact CG1-CB 3.91Å; V33-L50 HydrophobicContact CG1-CD1 4.36Å; V33-L50 HydrophobicContact CG1-CD2 3.85Å; V33-L50 HydrophobicContact CG1-CG 4.25Å; L34-L50 HydrophobicContact CD2-CD1 4.13Å; H37-L50 HydrophobicContact CB-CD1 3.69Å; H37-L50 HydrophobicContact CB-CD2 3.56Å; H37-L50 HydrophobicContact CB-CG 4.29Å; C41-L50 WeakPolarHBondContact SG-CD1 2.87Å; S46-L50 WeakPolarHBondContact O-CG 3.28Å; S46-L50 PolarHBondContact O-N 2.85Å; F47-L50 PolarHBondContact O-N 3.24Å; I48-L50 VanDerWaalsContact C-N 3.33Å; I48-L50 PolarHBondContact O-N 2.82Å; L50-H53 WeakPolarHBondContact O-CB 3.28Å; L50-H53 PolarHBondContact O-N 3.28Å; L50-S54 PolarHBondContact O-N 2.99Å; L50-L73 HydrophobicContact CD2-CD1 4.35Å; L50-L78 HydrophobicContact CD2-CD1 4.1Å; L50-L78 HydrophobicContact CD2-CD2 4.02Å
51	L	95.4	Very high	93	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-64.4	-47.9	175.8	-176.8	63.6	0	0	0	110.9	L30 F47 I48 H53 S54 E55 F156 L159 L162 L163 F166	L30-L51 HydrophobicContact CD1-CD1 3.86Å; L30-L51 HydrophobicContact CD2-CD1 3.86Å; F47-L51 PolarHBondContact O-N 3.3Å; I48-L51 PolarHBondContact O-N 2.99Å; I48-L51 VanDerWaalsContact O-N 3.15Å; L51-H53 VanDerWaalsContact C-N 3.29Å; L51-H53 PolarHBondContact O-N 2.9Å; L51-S54 PolarHBondContact O-N 3.2Å; L51-S54 VanDerWaalsContact O-N 3.12Å; L51-S54 PolarHBondContact O-OG 3.49Å; L51-E55 PolarHBondContact O-N 2.79Å; L51-F156 HydrophobicContact CB-CE1 4.22Å; L51-F156 HydrophobicContact CB-CZ 3.95Å; L51-F156 HydrophobicContact CD2-CD1 4.37Å; L51-F156 HydrophobicContact CD2-CE1 4.33Å; L51-L159 HydrophobicContact CD1-CD1 3.81Å; L51-L159 HydrophobicContact CD2-CD1 4.02Å; L51-L162 HydrophobicContact CD2-CD2 3.23Å; L51-L162 HydrophobicContact CD2-CG 3.8Å; L51-L163 HydrophobicContact CD1-CD2 4.48Å; L51-F166 HydrophobicContact CB-CE2 4.41Å; L51-F166 HydrophobicContact CD2-CE2 3.82Å; L51-F166 HydrophobicContact CD2-CZ 4.06Å; L51-F166 HydrophobicContact CG-CE2 3.86Å; L51-F166 HydrophobicContact CG-CZ 4.45Å
52	V	96.2	Very high	93	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.1	-44.3	174.8	173.7	0	0	0	0	110.8	I48 A49 S54 E55 L56 M85 V107 V118 F166 W171	I48-V52 HydrophobicContact CG2-CG2 4.45Å; I48-V52 WeakPolarHBondContact O-CG2 3.09Å; I48-V52 PolarHBondContact O-N 3.25Å; A49-V52 PolarHBondContact O-N 2.81Å; V52-S54 PolarHBondContact O-N 3.29Å; V52-E55 PolarHBondContact O-N 2.88Å; V52-L56 HydrophobicContact CG1-CD1 4.08Å; V52-L56 WeakPolarHBondContact O-CG 3.4Å; V52-L56 PolarHBondContact O-N 2.79Å; V52-M85 HydrophobicContact CG1-CE 4.5Å; V52-V107 HydrophobicContact CG1-CG1 3.86Å; V52-V107 HydrophobicContact CG1-CG2 4.44Å; V52-V118 HydrophobicContact CG2-CG1 4.01Å; V52-F166 HydrophobicContact CB-CE2 4.45Å; V52-F166 HydrophobicContact CG2-CD2 4.41Å; V52-F166 HydrophobicContact CG2-CE1 4.48Å; V52-F166 HydrophobicContact CG2-CE2 3.52Å; V52-F166 HydrophobicContact CG2-CZ 3.56Å; V52-W171 HydrophobicContact CG1-CH2 4.02Å
53	H	95.5	Very high	93.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-57.8	-46.9	175.4	175.4	37.4	0	0	0	111.8	A49 L50 L51 E55 L56 L57 A71 L73 M85 Y87	A49-H53 VanDerWaalsContact O-CB 3.29Å; A49-H53 WeakPolarHBondContact O-CB 3.29Å; A49-H53 PolarHBondContact O-N 3.21Å; L50-H53 WeakPolarHBondContact O-CB 3.28Å; L50-H53 PolarHBondContact O-N 3.28Å; L51-H53 VanDerWaalsContact C-N 3.29Å; L51-H53 PolarHBondContact O-N 2.9Å; H53-E55 VanDerWaalsContact C-N 3.32Å; H53-E55 PolarHBondContact O-N 3.05Å; H53-L56 PolarHBondContact O-N 3.08Å; H53-L57 WeakPolarHBondContact O-CG 3.47Å; H53-L57 PolarHBondContact O-N 3.47Å; H53-A71 PolarHBondContact CE1-O 3.29Å; H53-A71 PolarHBondContact NE2-O 3.44Å; H53-L73 HydrophobicContact CB-CD1 4.19Å; H53-M85 HydrophobicContact CB-SD 4.37Å; H53-Y87 WeakPolarHBondContact CB-OH 3.23Å; H53-Y87 VanDerWaalsContact CG-OH 3.27Å; H53-Y87 AromaticContact ND1-CE1 3.46Å; H53-Y87 WeakPolarHBondContact ND1-CE1 3.45Å; H53-Y87 AromaticContact ND1-CZ 3.54Å; H53-Y87 PolarHBondContact ND1-OH 2.9Å
54	S	94.8	Very high	93.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.3	-37.3	178.4	83.5	0	0	0	0	112.7	R22 L50 L51 V52 L57 S58	R22-S54 PolarHBondContact NH2-OG 2.91Å; R22-S54 VanDerWaalsContact NH2-OG 3.15Å; L50-S54 PolarHBondContact O-N 2.99Å; L51-S54 PolarHBondContact O-N 3.2Å; L51-S54 VanDerWaalsContact O-N 3.12Å; L51-S54 PolarHBondContact O-OG 3.49Å; V52-S54 PolarHBondContact O-N 3.29Å; S54-L57 PolarHBondContact O-N 3.13Å; S54-S58 WeakPolarHBondContact O-CB 3.35Å; S54-S58 PolarHBondContact O-N 2.95Å; S54-S58 PolarHBondContact O-OG 2.69Å
55	E	94.8	Very high	92.5	Very high	14 Å²	14	25.8 Å²	25.8	7%	0.065	13%	0.13	C	C	.	.	H	α-helix	trans	-69.2	-38	177.8	-76.2	-65.2	122	0	0	111.9	R22 L51 V52 H53 S58 R59 L163 F166 W171	R22-E55 IonicContact CZ-OE1 3.93Å; R22-E55 IonicContact NE-OE1 2.78Å; R22-E55 PolarHBondContact NE-OE1 3.14Å; R22-E55 IonicContact NH2-OE1 2.65Å; R22-E55 PolarHBondContact NH2-OE1 2.88Å; L51-E55 PolarHBondContact O-N 2.79Å; V52-E55 PolarHBondContact O-N 2.88Å; H53-E55 VanDerWaalsContact C-N 3.32Å; H53-E55 PolarHBondContact O-N 3.05Å; E55-S58 PolarHBondContact O-N 3.28Å; E55-R59 WeakPolarHBondContact O-CG 3.31Å; E55-R59 PolarHBondContact O-N 2.92Å; E55-R59 VanDerWaalsContact O-N 3.09Å; E55-R59 PolarHBondContact O-NH1 3.14Å; E55-R59 IonicContact OE2-CZ 2.72Å; E55-R59 IonicContact OE2-NH1 2.66Å; E55-R59 PolarHBondContact OE2-NH1 3.48Å; E55-R59 IonicContact OE2-NH2 2.73Å; E55-L163 VanDerWaalsContact CD-CD2 3.49Å; E55-L163 HydrophobicContact CG-CD2 3.93Å; E55-L163 WeakPolarHBondContact OE1-CD2 3.3Å; E55-F166 HydrophobicContact CG-CD2 4.26Å; E55-W171 HydrophobicContact CB-CZ2 3.89Å
56	L	94	Very high	91	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.3	-41.7	174.1	-75.3	173.5	0	0	0	111.8	V52 H53 S58 R59 G60 A61 Y87 L105 V107 W171	V52-L56 HydrophobicContact CG1-CD1 4.08Å; V52-L56 WeakPolarHBondContact O-CG 3.4Å; V52-L56 PolarHBondContact O-N 2.79Å; H53-L56 PolarHBondContact O-N 3.08Å; L56-S58 VanDerWaalsContact C-N 3.31Å; L56-S58 PolarHBondContact O-N 3.07Å; L56-R59 PolarHBondContact O-N 3.35Å; L56-G60 PolarHBondContact O-N 3.31Å; L56-A61 HydrophobicContact CB-CB 4.01Å; L56-A61 HydrophobicContact CD2-CB 4.42Å; L56-A61 VanDerWaalsContact O-CB 3.22Å; L56-A61 WeakPolarHBondContact O-CB 3.41Å; L56-A61 PolarHBondContact O-N 3.05Å; L56-Y87 HydrophobicContact CB-CD1 4.36Å; L56-Y87 HydrophobicContact CB-CE1 4.28Å; L56-Y87 HydrophobicContact CD1-CD1 4.3Å; L56-Y87 HydrophobicContact CD1-CD2 3.57Å; L56-Y87 HydrophobicContact CD1-CE1 4.23Å; L56-Y87 HydrophobicContact CD1-CE2 3.45Å; L56-Y87 VanDerWaalsContact CD1-CE2 3.45Å; L56-Y87 HydrophobicContact CD1-CG 4.01Å; L56-L105 HydrophobicContact CD2-CD1 3.71Å; L56-V107 HydrophobicContact CD1-CG2 3.71Å; L56-W171 HydrophobicContact CD1-CH2 4.49Å; L56-W171 HydrophobicContact CD2-CH2 3.82Å; L56-W171 HydrophobicContact CD2-CZ3 3.76Å; L56-W171 HydrophobicContact CG-CH2 3.89Å; L56-W171 HydrophobicContact CG-CZ3 4.35Å
57	L	92.9	Very high	89.3	Confident	16 Å²	16	32 Å²	32	8%	0.084	17%	0.17	C	C	.	.	H	α-helix	trans	-61.6	-40.8	174.2	-69.1	-177.2	0	0	0	112	I29 V33 H53 S54 R59 G60 A61 A71	I29-L57 HydrophobicContact CG2-CB 3.92Å; I29-L57 HydrophobicContact CG2-CD1 4.12Å; V33-L57 HydrophobicContact CG2-CD1 3.99Å; H53-L57 WeakPolarHBondContact O-CG 3.47Å; H53-L57 PolarHBondContact O-N 3.47Å; S54-L57 PolarHBondContact O-N 3.13Å; L57-R59 VanDerWaalsContact C-N 3.27Å; L57-R59 PolarHBondContact O-N 3.22Å; L57-G60 PolarHBondContact O-N 3.09Å; L57-A61 WeakPolarHBondContact CD2-O 3.45Å; L57-A71 HydrophobicContact CD1-CB 3.74Å; L57-A71 HydrophobicContact CD2-CB 3.62Å; L57-A71 HydrophobicContact CG-CB 4.33Å
58	S	92.2	Very high	87.4	Confident	37 Å²	37	37 Å²	37	26%	0.259	21%	0.211	S	C	.	.	H	α-helix	trans	-63	-34.2	177.1	-59	0	0	0	0	111.9	I29 S54 E55 L56 G60	I29-S58 WeakPolarHBondContact CD1-OG 3.34Å; S54-S58 WeakPolarHBondContact O-CB 3.35Å; S54-S58 PolarHBondContact O-N 2.95Å; S54-S58 PolarHBondContact O-OG 2.69Å; E55-S58 PolarHBondContact O-N 3.28Å; L56-S58 VanDerWaalsContact C-N 3.31Å; L56-S58 PolarHBondContact O-N 3.07Å; S58-G60 PolarHBondContact O-N 3.41Å
59	R	90.4	Very high	85.9	Confident	82 Å²	82	48.7 Å²	48.7	31%	0.309	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-3.3	173	-72.2	170.9	176.5	68	2.7	113.9	E55 L56 L57 L89 E167	E55-R59 WeakPolarHBondContact O-CG 3.31Å; E55-R59 PolarHBondContact O-N 2.92Å; E55-R59 VanDerWaalsContact O-N 3.09Å; E55-R59 PolarHBondContact O-NH1 3.14Å; E55-R59 IonicContact OE2-CZ 2.72Å; E55-R59 IonicContact OE2-NH1 2.66Å; E55-R59 PolarHBondContact OE2-NH1 3.48Å; E55-R59 IonicContact OE2-NH2 2.73Å; L56-R59 PolarHBondContact O-N 3.35Å; L57-R59 VanDerWaalsContact C-N 3.27Å; L57-R59 PolarHBondContact O-N 3.22Å; R59-L89 WeakPolarHBondContact O-CD1 3.46Å; R59-E167 IonicContact CZ-OE2 2.69Å; R59-E167 IonicContact NH2-OE2 3.17Å; R59-E167 PolarHBondContact NH2-OE2 3.04Å
60	G	89.3	Confident	84.6	Confident	28 Å²	28	51.8 Å²	51.8	29%	0.289	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.1	10.2	178.5	0	0	0	0	0	114.7	L56 L57 S58	L56-G60 PolarHBondContact O-N 3.31Å; L57-G60 PolarHBondContact O-N 3.09Å; S58-G60 PolarHBondContact O-N 3.41Å
61	A	90.8	Very high	84	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	155.9	172.7	0	0	0	0	0	110.9	L56 L57 Y87 T88 L89	L56-A61 HydrophobicContact CB-CB 4.01Å; L56-A61 HydrophobicContact CD2-CB 4.42Å; L56-A61 VanDerWaalsContact O-CB 3.22Å; L56-A61 WeakPolarHBondContact O-CB 3.41Å; L56-A61 PolarHBondContact O-N 3.05Å; L57-A61 WeakPolarHBondContact CD2-O 3.45Å; A61-Y87 HydrophobicContact CB-CD1 4.14Å; A61-Y87 HydrophobicContact CB-CG 4.48Å; A61-T88 WeakPolarHBondContact CA-O 3.28Å; A61-L89 HydrophobicContact CB-CB 4.3Å; A61-L89 HydrophobicContact CB-CD1 4.06Å
62	R	90.8	Very high	83.6	Confident	134 Å²	134	54.2 Å²	54.2	51%	0.506	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	131.7	176.2	-67.8	-67.1	176.1	-106.8	7.6	109.9	T64 Y87 T88	R62-T64 PolarHBondContact O-N 3.08Å; R62-Y87 CarbonylContact O-C 3.43Å; R62-Y87 VanDerWaalsContact O-CA 3.26Å; R62-Y87 WeakPolarHBondContact O-CA 3.32Å; R62-T88 PolarHBondContact N-O 2.83Å; R62-T88 PolarHBondContact O-N 2.83Å
63	P	91.4	Very high	83.2	Confident	12 Å²	12	54.9 Å²	54.9	8%	0.078	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	136.2	175.6	-11.9	22.5	0	0	0	110.1	A66 L73 S86 Y87	P63-A66 HydrophobicContact CB-CB 3.82Å; P63-A66 HydrophobicContact CG-CB 4.03Å; P63-A66 PolarHBondContact O-N 3.46Å; P63-L73 HydrophobicContact CB-CD2 4.2Å; P63-L73 HydrophobicContact CG-CD2 4.25Å; P63-S86 CarbonylContact C-O 3.55Å; P63-S86 VanDerWaalsContact CA-O 3.32Å; P63-S86 WeakPolarHBondContact CA-O 3.4Å; P63-Y87 HydrophobicContact CB-CD1 4.24Å; P63-Y87 HydrophobicContact CB-CE1 4.05Å; P63-Y87 HydrophobicContact CG-CD1 4.15Å; P63-Y87 HydrophobicContact CG-CE1 3.73Å
64	T	87.4	Confident	82.6	Confident	84 Å²	84	57.5 Å²	57.5	52%	0.515	31%	0.313	S	S	.	.	S	Bend	trans	-72.6	-31.6	-177.9	-49.4	0	0	0	0	112.1	R62 S86 T88	R62-T64 PolarHBondContact O-N 3.08Å; T64-S86 PolarHBondContact N-O 2.83Å; T64-S86 PolarHBondContact OG1-O 2.88Å; T64-T88 PolarHBondContact OG1-OG1 2.85Å
65	E	78.3	Confident	82.1	Confident	132 Å²	132	63.1 Å²	63.1	62%	0.617	34%	0.34	S	S	*	.	S	Bend	trans	-82.2	-14.8	179.2	-64.8	178.4	-173.9	0	0	113.3
66	A	64.6	Low	81.7	Confident	16 Å²	16	65.5 Å²	65.5	13%	0.132	36%	0.358	C	S	.	.	S	Bend	trans	-79	132.7	-177.4	0	0	0	0	0	110.2	P63 A68 T70 V72	P63-A66 HydrophobicContact CB-CB 3.82Å; P63-A66 HydrophobicContact CG-CB 4.03Å; P63-A66 PolarHBondContact O-N 3.46Å; A66-A68 PolarHBondContact O-N 3.41Å; A66-A68 VanDerWaalsContact O-N 3.13Å; A66-T70 WeakPolarHBondContact CB-O 3.3Å; A66-V72 VanDerWaalsContact CB-O 3.31Å; A66-V72 WeakPolarHBondContact CB-O 3.15Å
67	T	57.4	Low	81.3	Confident	115 Å²	115	65.7 Å²	65.7	71%	0.706	36%	0.359	S	S	*	.			trans	-51	125.3	169.6	-31.7	0	0	0	0	107.5	R69 T70	T67-R69 PolarHBondContact O-N 3.39Å; T67-T70 PolarHBondContact O-N 2.98Å; T67-T70 PolarHBondContact O-OG1 2.81Å
68	A	54	Low	81.2	Confident	106 Å²	106	65.1 Å²	65.1	88%	0.876	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-9	-162.3	0	0	0	0	0	118	A66	A66-A68 PolarHBondContact O-N 3.41Å; A66-A68 VanDerWaalsContact O-N 3.13Å
69	R	62.4	Low	80.9	Confident	246 Å²	246	68.3 Å²	68.3	93%	0.928	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-20.1	179.1	-62.6	-175	178.3	176.8	-0.1	114.5	T67	T67-R69 PolarHBondContact O-N 3.39Å
70	T	69.6	Low	80.9	Confident	66 Å²	66	69 Å²	69	41%	0.405	37%	0.372	S	S	.	.			trans	-119.5	127.7	-172.6	51.7	0	0	0	0	109.9	A66 T67 V72	A66-T70 WeakPolarHBondContact CB-O 3.3Å; T67-T70 PolarHBondContact O-N 2.98Å; T67-T70 PolarHBondContact O-OG1 2.81Å; T70-V72 PolarHBondContact O-N 3.38Å
71	A	82.1	Confident	80.9	Confident	22 Å²	22	73.2 Å²	73.2	18%	0.182	39%	0.388	C	S	.	.			trans	-79.3	39.8	171.9	0	0	0	0	0	111.2	H53 L57	H53-A71 PolarHBondContact CE1-O 3.29Å; H53-A71 PolarHBondContact NE2-O 3.44Å; L57-A71 HydrophobicContact CD1-CB 3.74Å; L57-A71 HydrophobicContact CD2-CB 3.62Å; L57-A71 HydrophobicContact CG-CB 4.33Å
72	V	86	Confident	81.1	Confident	28 Å²	28	75.1 Å²	75.1	17%	0.17	40%	0.401	C	S	.	.			trans	-107.2	126.8	-168	170.2	0	0	0	0	108.7	F36 A66 T70	F36-V72 HydrophobicContact CD1-CG1 4.08Å; F36-V72 HydrophobicContact CD1-CG2 4.3Å; F36-V72 HydrophobicContact CE1-CB 4.28Å; F36-V72 HydrophobicContact CE1-CG1 3.31Å; F36-V72 HydrophobicContact CE1-CG2 3.94Å; F36-V72 HydrophobicContact CE2-CG2 4.43Å; F36-V72 HydrophobicContact CZ-CG1 3.82Å; F36-V72 HydrophobicContact CZ-CG2 4Å; A66-V72 VanDerWaalsContact CB-O 3.31Å; A66-V72 WeakPolarHBondContact CB-O 3.15Å; T70-V72 PolarHBondContact O-N 3.38Å
73	L	87.9	Confident	81.3	Confident	14 Å²	14	68.8 Å²	68.8	7%	0.073	38%	0.377	C	S	.	.			trans	-74.8	150.4	174	-61.1	175.2	0	0	0	111.4	H37 L50 H53 P63 L78 M85	H37-L73 PolarHBondContact CE1-N 2.9Å; H37-L73 VanDerWaalsContact CE1-N 3.27Å; H37-L73 PolarHBondContact CE1-O 3.22Å; H37-L73 PolarHBondContact NE2-N 3.22Å; L50-L73 HydrophobicContact CD2-CD1 4.35Å; H53-L73 HydrophobicContact CB-CD1 4.19Å; P63-L73 HydrophobicContact CB-CD2 4.2Å; P63-L73 HydrophobicContact CG-CD2 4.25Å; L73-L78 HydrophobicContact CD1-CD2 4.34Å; L73-M85 HydrophobicContact CD1-CG 4.47Å; L73-M85 HydrophobicContact CD1-SD 3.54Å; L73-M85 VanDerWaalsContact CD1-SD 3.54Å; L73-M85 HydrophobicContact CD2-CG 4.37Å; L73-M85 HydrophobicContact CD2-SD 4.17Å
74	S	84.2	Confident	81.5	Confident	55 Å²	55	75.5 Å²	75.5	39%	0.385	40%	0.401	S	S	.	.			trans	-61.9	138.7	167.1	-179	0	0	0	0	109.7	S76 C77	S74-S76 PolarHBondContact O-N 3.28Å; S74-S76 PolarHBondContact OG-N 3.13Å; S74-S76 PolarHBondContact OG-OG 3.06Å; S74-C77 WeakPolarHBondContact O-CB 3.32Å; S74-C77 PolarHBondContact O-N 3.31Å
75	Q	83.8	Confident	81.8	Confident	118 Å²	118	71.8 Å²	71.8	55%	0.551	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-60	-33.3	176.7	-67.2	177.6	-5.2	0	0	111.8	C77 L78 F79	Q75-C77 VanDerWaalsContact C-N 3.29Å; Q75-C77 PolarHBondContact O-N 2.83Å; Q75-L78 PolarHBondContact O-N 3.15Å; Q75-F79 HydrophobicContact CB-CE2 4.44Å; Q75-F79 WeakPolarHBondContact O-CD2 3.24Å; Q75-F79 WeakPolarHBondContact O-CE2 3.45Å
76	S	85.2	Confident	82.6	Confident	64 Å²	64	67.5 Å²	67.5	45%	0.448	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-61.2	-36.2	-179.8	57.6	0	0	0	0	113.1	S74 L78 F79	S74-S76 PolarHBondContact O-N 3.28Å; S74-S76 PolarHBondContact OG-N 3.13Å; S74-S76 PolarHBondContact OG-OG 3.06Å; S76-L78 VanDerWaalsContact C-N 3.3Å; S76-L78 PolarHBondContact O-N 3.44Å; S76-F79 PolarHBondContact O-N 3.09Å; S76-F79 VanDerWaalsContact O-N 3.16Å
77	C	87	Confident	84	Confident	4 Å²	4	66.8 Å²	66.8	3%	0.027	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-60.5	-37.7	-176.2	165.5	0	0	0	0	112.3	S74 Q75 F79 E80 R84 M85	S74-C77 WeakPolarHBondContact O-CB 3.32Å; S74-C77 PolarHBondContact O-N 3.31Å; Q75-C77 VanDerWaalsContact C-N 3.29Å; Q75-C77 PolarHBondContact O-N 2.83Å; C77-F79 PolarHBondContact O-N 3.04Å; C77-E80 PolarHBondContact O-N 2.92Å; C77-R84 PolarHBondContact SG-O 3.28Å; C77-M85 VanDerWaalsContact SG-CG 3.6Å
78	L	89.3	Confident	85.6	Confident	5 Å²	5	63.5 Å²	63.5	3%	0.026	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-74.9	-8.5	-177.6	-62.3	174.3	0	0	0	113.9	H37 N40 L50 L73 Q75 S76	H37-L78 HydrophobicContact CB-CD1 4.14Å; N40-L78 HydrophobicContact CB-CD1 4.39Å; L50-L78 HydrophobicContact CD2-CD1 4.1Å; L50-L78 HydrophobicContact CD2-CD2 4.02Å; L73-L78 HydrophobicContact CD1-CD2 4.34Å; Q75-L78 PolarHBondContact O-N 3.15Å; S76-L78 VanDerWaalsContact C-N 3.3Å; S76-L78 PolarHBondContact O-N 3.44Å
79	F	87.6	Confident	87.3	Confident	103 Å²	103	59.5 Å²	59.5	45%	0.452	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-101.2	-8.1	177.9	-58.4	-59.4	0	0	0	113.5	N40 K42 Q75 S76 C77	N40-F79 HydrophobicContact CB-CZ 4.23Å; N40-F79 WeakPolarHBondContact O-CE1 3.38Å; K42-F79 HydrophobicContact CD-CD1 4.45Å; K42-F79 HydrophobicContact CD-CE1 4.26Å; Q75-F79 HydrophobicContact CB-CE2 4.44Å; Q75-F79 WeakPolarHBondContact O-CD2 3.24Å; Q75-F79 WeakPolarHBondContact O-CE2 3.45Å; S76-F79 PolarHBondContact O-N 3.09Å; S76-F79 VanDerWaalsContact O-N 3.16Å; C77-F79 PolarHBondContact O-N 3.04Å
80	E	90	Very high	88.2	Confident	96 Å²	96	53 Å²	53	45%	0.449	28%	0.282	S	S	.	.	S	Bend	trans	-78	151.5	178.2	-67.7	177.3	-166.6	0	0	110.8	C77 P82 I83	C77-E80 PolarHBondContact O-N 2.92Å; E80-P82 CarbonylContact O-C 3.51Å; E80-I83 WeakPolarHBondContact O-CG1 3.47Å; E80-I83 PolarHBondContact O-N 2.69Å
81	D	89.4	Confident	88.2	Confident	117 Å²	117	52.3 Å²	52.3	63%	0.626	28%	0.28	S	S	*	.	S	Bend	trans	-130.8	111.7	169.7	-174.1	21	0	0	0	109.1
82	P	94.3	Very high	87.3	Confident	41 Å²	41	62.2 Å²	62.2	27%	0.266	31%	0.313	S	S	.	.	S	Bend	cis	-71.2	150.6	-1.3	31.4	-36.3	0	0	0	112.7	E80 R84 V109 A110	E80-P82 CarbonylContact O-C 3.51Å; P82-R84 HydrophobicContact CG-CG 4.44Å; P82-R84 PolarHBondContact O-N 3.17Å; P82-V109 CarbonylContact C-O 3.57Å; P82-V109 WeakPolarHBondContact CA-O 3.42Å; P82-A110 HydrophobicContact CB-CB 4.04Å
83	I	95.4	Very high	86	Confident	1 Å²	1	66.2 Å²	66.2	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	122	169.7	-61.4	173.4	0	0	0	108	A45 A49 E80 M85 S108 V109	A45-I83 HydrophobicContact CB-CD1 4.03Å; A49-I83 HydrophobicContact CB-CD1 4.07Å; A49-I83 HydrophobicContact CB-CG2 3.96Å; E80-I83 WeakPolarHBondContact O-CG1 3.47Å; E80-I83 PolarHBondContact O-N 2.69Å; I83-M85 HydrophobicContact CG2-CG 4.39Å; I83-S108 CarbonylContact O-C 3.54Å; I83-S108 VanDerWaalsContact O-CA 3.24Å; I83-S108 WeakPolarHBondContact O-CA 3.22Å; I83-V109 HydrophobicContact CB-CB 4.35Å; I83-V109 PolarHBondContact N-O 3.45Å; I83-V109 PolarHBondContact O-N 2.97Å
84	R	95.4	Very high	84.5	Confident	153 Å²	153	76.2 Å²	76.2	58%	0.577	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.6	129	-178.2	-68	174.1	-178.2	-93.3	-2.2	111.4	C77 P82 V107	C77-R84 PolarHBondContact SG-O 3.28Å; P82-R84 HydrophobicContact CG-CG 4.44Å; P82-R84 PolarHBondContact O-N 3.17Å; R84-V107 WeakPolarHBondContact CA-O 3.44Å
85	M	94.4	Very high	83.1	Confident	5 Å²	5	77.1 Å²	77.1	3%	0.025	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	136.6	178.2	-57	175.8	-67.4	0	0	110.2	A49 V52 H53 L73 C77 I83 Y87 V107	A49-M85 HydrophobicContact CB-CE 4.04Å; V52-M85 HydrophobicContact CG1-CE 4.5Å; H53-M85 HydrophobicContact CB-SD 4.37Å; L73-M85 HydrophobicContact CD1-CG 4.47Å; L73-M85 HydrophobicContact CD1-SD 3.54Å; L73-M85 VanDerWaalsContact CD1-SD 3.54Å; L73-M85 HydrophobicContact CD2-CG 4.37Å; L73-M85 HydrophobicContact CD2-SD 4.17Å; C77-M85 VanDerWaalsContact SG-CG 3.6Å; I83-M85 HydrophobicContact CG2-CG 4.39Å; M85-Y87 HydrophobicContact CB-CD2 4.3Å; M85-Y87 HydrophobicContact CB-CE2 3.47Å; M85-Y87 VanDerWaalsContact CB-CE2 3.47Å; M85-Y87 HydrophobicContact CE-CE2 4.46Å; M85-Y87 HydrophobicContact CG-CE2 4.49Å; M85-Y87 HydrophobicContact SD-CE2 4.39Å; M85-Y87 PolarHBondContact SD-OH 3.14Å; M85-Y87 VanDerWaalsContact SD-OH 3.35Å; M85-V107 HydrophobicContact CB-CB 4.31Å; M85-V107 HydrophobicContact CE-CB 4.06Å; M85-V107 HydrophobicContact CE-CG1 3.68Å; M85-V107 PolarHBondContact N-O 2.98Å; M85-V107 PolarHBondContact O-N 3.25Å
86	S	94	Very high	81.2	Confident	42 Å²	42	79.2 Å²	79.2	29%	0.294	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	136.1	177.1	-60.8	0	0	0	0	110.6	P63 T64 L105	P63-S86 CarbonylContact C-O 3.55Å; P63-S86 VanDerWaalsContact CA-O 3.32Å; P63-S86 WeakPolarHBondContact CA-O 3.4Å; T64-S86 PolarHBondContact N-O 2.83Å; T64-S86 PolarHBondContact OG1-O 2.88Å; S86-L105 CarbonylContact C-O 3.59Å; S86-L105 WeakPolarHBondContact CA-O 3.19Å
87	Y	93.7	Very high	79.8	Confident	2 Å²	2	81.8 Å²	81.8	1%	0.008	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	154.3	-179.8	-62.3	-99.5	0	0	0	112.7	H53 L56 A61 R62 P63 M85 Q104 L105 V107	H53-Y87 WeakPolarHBondContact CB-OH 3.23Å; H53-Y87 VanDerWaalsContact CG-OH 3.27Å; H53-Y87 AromaticContact ND1-CE1 3.46Å; H53-Y87 WeakPolarHBondContact ND1-CE1 3.45Å; H53-Y87 AromaticContact ND1-CZ 3.54Å; H53-Y87 PolarHBondContact ND1-OH 2.9Å; L56-Y87 HydrophobicContact CB-CD1 4.36Å; L56-Y87 HydrophobicContact CB-CE1 4.28Å; L56-Y87 HydrophobicContact CD1-CD1 4.3Å; L56-Y87 HydrophobicContact CD1-CD2 3.57Å; L56-Y87 HydrophobicContact CD1-CE1 4.23Å; L56-Y87 HydrophobicContact CD1-CE2 3.45Å; L56-Y87 VanDerWaalsContact CD1-CE2 3.45Å; L56-Y87 HydrophobicContact CD1-CG 4.01Å; A61-Y87 HydrophobicContact CB-CD1 4.14Å; A61-Y87 HydrophobicContact CB-CG 4.48Å; R62-Y87 CarbonylContact O-C 3.43Å; R62-Y87 VanDerWaalsContact O-CA 3.26Å; R62-Y87 WeakPolarHBondContact O-CA 3.32Å; P63-Y87 HydrophobicContact CB-CD1 4.24Å; P63-Y87 HydrophobicContact CB-CE1 4.05Å; P63-Y87 HydrophobicContact CG-CD1 4.15Å; P63-Y87 HydrophobicContact CG-CE1 3.73Å; M85-Y87 HydrophobicContact CB-CD2 4.3Å; M85-Y87 HydrophobicContact CB-CE2 3.47Å; M85-Y87 VanDerWaalsContact CB-CE2 3.47Å; M85-Y87 HydrophobicContact CE-CE2 4.46Å; M85-Y87 HydrophobicContact CG-CE2 4.49Å; M85-Y87 HydrophobicContact SD-CE2 4.39Å; M85-Y87 PolarHBondContact SD-OH 3.14Å; M85-Y87 VanDerWaalsContact SD-OH 3.35Å; Y87-Q104 CarbonylContact O-C 3.53Å; Y87-Q104 WeakPolarHBondContact O-CA 3.47Å; Y87-L105 PolarHBondContact N-O 3.45Å; Y87-L105 PolarHBondContact O-N 3.4Å; Y87-V107 HydrophobicContact CD2-CG2 4.1Å; Y87-V107 HydrophobicContact CE2-CG2 4.05Å
88	T	91.7	Very high	77.9	Confident	46 Å²	46	87.4 Å²	87.4	28%	0.282	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	119	173.7	-59.7	0	0	0	0	107.5	A61 R62 T64 C102	A61-T88 WeakPolarHBondContact CA-O 3.28Å; R62-T88 PolarHBondContact N-O 2.83Å; R62-T88 PolarHBondContact O-N 2.83Å; T64-T88 PolarHBondContact OG1-OG1 2.85Å; T88-C102 WeakPolarHBondContact CG2-SG 2.96Å
89	L	90	Very high	76.2	Confident	22 Å²	22	92.1 Å²	92.1	12%	0.115	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	111.5	178.2	178.6	65.9	0	0	0	109.9	R59 A61 S91 C102 S103 L105 L175	R59-L89 WeakPolarHBondContact O-CD1 3.46Å; A61-L89 HydrophobicContact CB-CB 4.3Å; A61-L89 HydrophobicContact CB-CD1 4.06Å; L89-S91 PolarHBondContact O-N 2.8Å; L89-C102 CarbonylContact O-C 3.54Å; L89-C102 WeakPolarHBondContact O-CA 2.82Å; L89-S103 PolarHBondContact N-O 2.98Å; L89-S103 PolarHBondContact O-N 2.97Å; L89-L105 HydrophobicContact CB-CD1 4.23Å; L89-L105 HydrophobicContact CD2-CD1 4.33Å; L89-L175 HydrophobicContact CD2-CD1 3.74Å; L89-L175 HydrophobicContact CD2-CD2 3.65Å; L89-L175 HydrophobicContact CD2-CG 4.35Å
90	I	81.3	Confident	74.6	Confident	108 Å²	108	91.4 Å²	91.4	55%	0.554	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	110.1	178.3	-57.6	175.5	0	0	0	108.2	R92 T100	I90-R92 PolarHBondContact O-N 3.45Å; I90-T100 HydrophobicContact CG2-CG2 3.46Å; I90-T100 VanDerWaalsContact CG2-CG2 3.46Å
91	S	70.1	Confident	73.4	Confident	52 Å²	52	89.7 Å²	89.7	36%	0.364	48%	0.482	S	S	.	.			trans	-64.9	120.4	174.6	-177	0	0	0	0	109.4	L89 M93 T100 P101	L89-S91 PolarHBondContact O-N 2.8Å; S91-M93 PolarHBondContact O-N 2.64Å; S91-T100 WeakPolarHBondContact O-CG2 3.47Å; S91-P101 WeakPolarHBondContact CB-O 3.36Å; S91-P101 PolarHBondContact N-O 3.32Å; S91-P101 VanDerWaalsContact N-O 3.07Å
92	R	63.1	Low	72.9	Confident	231 Å²	231	86.4 Å²	86.4	87%	0.872	47%	0.468	S	S	*	.			trans	-75.6	75.8	171.4	-61.2	-168.6	-143.2	173.3	8.5	108.9	I90 K94	I90-R92 PolarHBondContact O-N 3.45Å; R92-K94 PolarHBondContact O-N 2.81Å
93	M	58.9	Low	72.6	Confident	112 Å²	112	85.4 Å²	85.4	55%	0.552	46%	0.462	S	S	*	.			trans	-66.7	129.1	166.7	-73.2	-171	76	0	0	108.7	S91 S95 P101	S91-M93 PolarHBondContact O-N 2.64Å; M93-S95 PolarHBondContact O-N 2.84Å; M93-P101 HydrophobicContact CG-CG 3.93Å; M93-P101 WeakPolarHBondContact SD-CD 3.45Å; M93-P101 HydrophobicContact SD-CG 3.31Å; M93-P101 WeakPolarHBondContact SD-CG 3.36Å
94	K	55.5	Low	72.6	Confident	223 Å²	223	90.7 Å²	90.7	97%	0.97	49%	0.487	S	S	*	.	S	Bend	trans	-78	8.1	-176.6	-111.4	178.3	-180	179.3	0	113.9	R92	R92-K94 PolarHBondContact O-N 2.81Å
95	S	55.6	Low	72.5	Confident	74 Å²	74	83.5 Å²	83.5	52%	0.517	46%	0.46	S	S	.	.	S	Bend	trans	-126.4	118.5	-173.9	55.3	0	0	0	0	110.7	M93 T97	M93-S95 PolarHBondContact O-N 2.84Å; S95-T97 PolarHBondContact O-N 2.86Å
96	D	43.7	Very low	72.6	Confident	163 Å²	163	88.2 Å²	88.2	87%	0.872	48%	0.482	S	S	*	.			trans	-50	116.3	168.9	-69.3	-50.6	0	0	0	110.6
97	T	54.5	Low	72.8	Confident	117 Å²	117	86.4 Å²	86.4	72%	0.718	47%	0.469	S	S	*	.	S	Bend	trans	173.2	98.2	151.3	28.2	0	0	0	0	108.5	S95 S99	S95-T97 PolarHBondContact O-N 2.86Å; T97-S99 PolarHBondContact O-N 3Å
98	S	47.4	Very low	72.9	Confident	123 Å²	123	87.4 Å²	87.4	86%	0.86	48%	0.476	S	S	*	.	S	Bend	trans	23.7	58.1	148.3	64.4	0	0	0	0	119.7
99	S	53.3	Low	73.2	Confident	103 Å²	103	85.2 Å²	85.2	72%	0.72	46%	0.463	S	S	*	.			trans	173.5	94.4	143	58.1	0	0	0	0	107.7	T97 P101	T97-S99 PolarHBondContact O-N 3Å; S99-P101 VanDerWaalsContact O-CD 3.3Å; S99-P101 WeakPolarHBondContact O-CD 2.98Å
100	T	55.8	Low	73.4	Confident	88 Å²	88	85.5 Å²	85.5	54%	0.54	47%	0.468	S	S	.	.			trans	-65.5	117	177.2	-45.1	0	0	0	0	108.6	I90 S91 C102	I90-T100 HydrophobicContact CG2-CG2 3.46Å; I90-T100 VanDerWaalsContact CG2-CG2 3.46Å; S91-T100 WeakPolarHBondContact O-CG2 3.47Å; T100-C102 PolarHBondContact O-N 3.17Å; T100-C102 VanDerWaalsContact O-N 3.08Å
101	P	63	Low	74	Confident	61 Å²	61	82.6 Å²	82.6	40%	0.396	45%	0.452	S	S	.	.			trans	-64.4	121.2	179.1	23.5	-27.9	0	0	0	107.8	S91 M93 S99	S91-P101 WeakPolarHBondContact CB-O 3.36Å; S91-P101 PolarHBondContact N-O 3.32Å; S91-P101 VanDerWaalsContact N-O 3.07Å; M93-P101 HydrophobicContact CG-CG 3.93Å; M93-P101 WeakPolarHBondContact SD-CD 3.45Å; M93-P101 HydrophobicContact SD-CG 3.31Å; M93-P101 WeakPolarHBondContact SD-CG 3.36Å; S99-P101 VanDerWaalsContact O-CD 3.3Å; S99-P101 WeakPolarHBondContact O-CD 2.98Å
102	C	79.3	Confident	75.1	Confident	48 Å²	48	83.2 Å²	83.2	32%	0.324	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	109.6	-176.9	-168.5	0	0	0	0	107.8	T88 L89 T100 T124	T88-C102 WeakPolarHBondContact CG2-SG 2.96Å; L89-C102 CarbonylContact O-C 3.54Å; L89-C102 WeakPolarHBondContact O-CA 2.82Å; T100-C102 PolarHBondContact O-N 3.17Å; T100-C102 VanDerWaalsContact O-N 3.08Å; C102-T124 WeakPolarHBondContact O-CG2 3.25Å
103	S	89.3	Confident	76.4	Confident	20 Å²	20	80.7 Å²	80.7	14%	0.14	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	142	173.6	-76	0	0	0	0	109.9	L89 D122	L89-S103 PolarHBondContact N-O 2.98Å; L89-S103 PolarHBondContact O-N 2.97Å; S103-D122 WeakPolarHBondContact CB-OD1 3.43Å; S103-D122 WeakPolarHBondContact CB-OD2 3.42Å; S103-D122 PolarHBondContact OG-OD2 2.65Å
104	Q	93.6	Very high	77.8	Confident	112 Å²	112	77.9 Å²	77.9	52%	0.523	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	109.4	176.4	-72.1	-173.6	4	0	0	107.1	Y87 D122 T123 T124	Y87-Q104 CarbonylContact O-C 3.53Å; Y87-Q104 WeakPolarHBondContact O-CA 3.47Å; Q104-D122 PolarHBondContact N-OD1 2.79Å; Q104-D122 CarbonylContact O-C 3.6Å; Q104-D122 WeakPolarHBondContact O-CA 3.46Å; Q104-T123 VanDerWaalsContact CB-OG1 3.22Å; Q104-T123 WeakPolarHBondContact CB-OG1 3.22Å; Q104-T123 PolarHBondContact O-N 2.99Å; Q104-T123 PolarHBondContact O-OG1 3.15Å; Q104-T123 VanDerWaalsContact O-OG1 3.14Å; Q104-T124 HydrophobicContact CB-CG2 3.97Å; Q104-T124 HydrophobicContact CG-CG2 4.08Å
105	L	95.3	Very high	79.7	Confident	2 Å²	2	70 Å²	70	1%	0.01	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129.1	-174	-52.5	177.7	0	0	0	109.7	L56 S86 Y87 L89 T121 D122 V174 L175	L56-L105 HydrophobicContact CD2-CD1 3.71Å; S86-L105 CarbonylContact C-O 3.59Å; S86-L105 WeakPolarHBondContact CA-O 3.19Å; Y87-L105 PolarHBondContact N-O 3.45Å; Y87-L105 PolarHBondContact O-N 3.4Å; L89-L105 HydrophobicContact CB-CD1 4.23Å; L89-L105 HydrophobicContact CD2-CD1 4.33Å; L105-T121 CarbonylContact C-O 3.55Å; L105-T121 VanDerWaalsContact CA-O 3.32Å; L105-T121 WeakPolarHBondContact CA-O 3.1Å; L105-D122 HydrophobicContact CD2-CB 3.6Å; L105-V174 HydrophobicContact CD2-CG1 3.92Å; L105-L175 HydrophobicContact CD1-CD1 4.35Å; L105-L175 HydrophobicContact CD2-CD2 4.13Å
106	Q	96.1	Very high	81.6	Confident	103 Å²	103	66.5 Å²	66.5	48%	0.481	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	124	168.7	-68.7	-174.4	-11.9	0	0	109	V120 T121 T123	Q106-V120 CarbonylContact O-C 3.57Å; Q106-V120 WeakPolarHBondContact O-CA 3.26Å; Q106-T121 PolarHBondContact N-O 2.93Å; Q106-T121 PolarHBondContact O-N 3.12Å; Q106-T123 HydrophobicContact CG-CG2 3.87Å
107	V	97.2	Very high	84.1	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.024	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	135.8	177.8	-176	0	0	0	0	108.7	V52 L56 R84 M85 Y87 V109 N119 V120	V52-V107 HydrophobicContact CG1-CG1 3.86Å; V52-V107 HydrophobicContact CG1-CG2 4.44Å; L56-V107 HydrophobicContact CD1-CG2 3.71Å; R84-V107 WeakPolarHBondContact CA-O 3.44Å; M85-V107 HydrophobicContact CB-CB 4.31Å; M85-V107 HydrophobicContact CE-CB 4.06Å; M85-V107 HydrophobicContact CE-CG1 3.68Å; M85-V107 PolarHBondContact N-O 2.98Å; M85-V107 PolarHBondContact O-N 3.25Å; Y87-V107 HydrophobicContact CD2-CG2 4.1Å; Y87-V107 HydrophobicContact CE2-CG2 4.05Å; V107-V109 HydrophobicContact CG1-CG2 4.22Å; V107-N119 CarbonylContact C-O 3.59Å; V107-N119 WeakPolarHBondContact CA-O 3.45Å; V107-V120 HydrophobicContact CG1-CG2 4.39Å; V107-V120 HydrophobicContact CG2-CG1 4.38Å; V107-V120 HydrophobicContact CG2-CG2 4.25Å
108	S	97.1	Very high	86.1	Confident	24 Å²	24	55.7 Å²	55.7	17%	0.168	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	135.5	166.4	62.2	0	0	0	0	110.9	I83 N119	I83-S108 CarbonylContact O-C 3.54Å; I83-S108 VanDerWaalsContact O-CA 3.24Å; I83-S108 WeakPolarHBondContact O-CA 3.22Å; S108-N119 PolarHBondContact N-O 3.48Å; S108-N119 PolarHBondContact O-N 3.17Å; S108-N119 WeakPolarHBondContact OG-CB 3.45Å; S108-N119 PolarHBondContact OG-ND2 3.16Å
109	V	97	Very high	88.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	122.4	175.5	-173.4	0	0	0	0	108.7	A45 I48 A49 P82 I83 V107 I116 F117 V118	A45-V109 HydrophobicContact CB-CG1 4.15Å; I48-V109 HydrophobicContact CB-CG1 4.43Å; I48-V109 HydrophobicContact CG2-CG1 4.2Å; A49-V109 HydrophobicContact CB-CB 4.3Å; A49-V109 HydrophobicContact CB-CG2 3.99Å; P82-V109 CarbonylContact C-O 3.57Å; P82-V109 WeakPolarHBondContact CA-O 3.42Å; I83-V109 HydrophobicContact CB-CB 4.35Å; I83-V109 PolarHBondContact N-O 3.45Å; I83-V109 PolarHBondContact O-N 2.97Å; V107-V109 HydrophobicContact CG1-CG2 4.22Å; V109-I116 HydrophobicContact CG1-CG2 3.8Å; V109-F117 CarbonylContact C-O 3.57Å; V109-F117 VanDerWaalsContact CA-O 3.31Å; V109-F117 WeakPolarHBondContact CA-O 3.32Å; V109-V118 HydrophobicContact CG1-CG2 4.26Å; V109-V118 HydrophobicContact CG2-CG1 4.3Å; V109-V118 HydrophobicContact CG2-CG2 4.37Å
110	A	95.2	Very high	90.6	Very high	27 Å²	27	46.8 Å²	46.8	22%	0.223	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	142.2	179.4	0	0	0	0	0	109.7	P82 I116 F117	P82-A110 HydrophobicContact CB-CB 4.04Å; A110-I116 CarbonylContact O-C 3.54Å; A110-I116 WeakPolarHBondContact O-CA 3.41Å; A110-F117 PolarHBondContact N-O 2.88Å; A110-F117 PolarHBondContact O-N 3.09Å
111	E	93.4	Very high	92.6	Very high	47 Å²	47	44.2 Å²	44.2	22%	0.22	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.2	174.8	175.3	173.5	-170.6	0	0	109.7	N43 R44 A45 I116	N43-E111 VanDerWaalsContact CB-OE2 3.24Å; N43-E111 WeakPolarHBondContact CB-OE2 3.39Å; R44-E111 PolarHBondContact N-OE2 3.45Å; A45-E111 HydrophobicContact CB-CB 3.62Å; A45-E111 PolarHBondContact N-OE2 3.09Å; E111-I116 HydrophobicContact CB-CG1 4.26Å; E111-I116 HydrophobicContact CG-CG1 4.15Å
112	T	92.8	Very high	94.1	Very high	65 Å²	65	41.5 Å²	41.5	40%	0.399	23%	0.231	S	C	.	.			trans	-112.8	179.3	171	61.9	0	0	0	0	108.9	A114 H115 F117	T112-A114 PolarHBondContact O-N 3.21Å; T112-A114 VanDerWaalsContact O-N 3.11Å; T112-H115 PolarHBondContact N-O 3.29Å; T112-H115 PolarHBondContact OG1-N 2.91Å; T112-H115 PolarHBondContact OG1-O 3.41Å; T112-F117 HydrophobicContact CG2-CD2 4.21Å; T112-F117 HydrophobicContact CG2-CE2 3.71Å
113	D	89.6	Confident	94.7	Very high	178 Å²	178	42 Å²	42	95%	0.952	23%	0.232	S	C	*	.	S	Bend	trans	-56.4	-31	-179.3	-62.7	-19.2	0	0	0	113.7
114	A	90	Very high	94.8	Very high	53 Å²	53	44.4 Å²	44.4	44%	0.438	25%	0.246	S	C	.	.	S	Bend	trans	-119.9	-27.5	-176	0	0	0	0	0	114.1	T112 G135	T112-A114 PolarHBondContact O-N 3.21Å; T112-A114 VanDerWaalsContact O-N 3.11Å; A114-G135 PolarHBondContact O-N 3.23Å
115	H	93.7	Very high	94.7	Very high	59 Å²	59	42.1 Å²	42.1	27%	0.273	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	150.1	-168.5	-62	-73	0	0	0	113.2	T112 F117 E132 L133	T112-H115 PolarHBondContact N-O 3.29Å; T112-H115 PolarHBondContact OG1-N 2.91Å; T112-H115 PolarHBondContact OG1-O 3.41Å; H115-F117 HydrophobicContact CB-CE2 3.89Å; H115-F117 HydrophobicContact CB-CZ 3.84Å; H115-E132 HydrophobicContact CB-CG 4.22Å; H115-E132 IonicContact CD2-OE1 3.69Å; H115-E132 IonicContact CE1-OE1 3.73Å; H115-E132 IonicContact CG-OE1 3.42Å; H115-E132 IonicContact ND1-OE1 3.46Å; H115-E132 PolarHBondContact ND1-OE1 3.28Å; H115-E132 IonicContact NE2-OE1 3.92Å; H115-L133 CarbonylContact C-O 3.51Å; H115-L133 WeakPolarHBondContact CA-O 3.42Å
116	I	95.5	Very high	94.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	128.8	168.5	-56.1	169.2	0	0	0	107.7	R44 I48 V109 A110 E111 V118 L133	R44-I116 HydrophobicContact CB-CD1 3.51Å; I48-I116 HydrophobicContact CB-CG2 4.44Å; I48-I116 HydrophobicContact CG1-CD1 3.84Å; I48-I116 HydrophobicContact CG1-CG2 4.37Å; I48-I116 HydrophobicContact CG2-CG2 4.33Å; V109-I116 HydrophobicContact CG1-CG2 3.8Å; A110-I116 CarbonylContact O-C 3.54Å; A110-I116 WeakPolarHBondContact O-CA 3.41Å; E111-I116 HydrophobicContact CB-CG1 4.26Å; E111-I116 HydrophobicContact CG-CG1 4.15Å; I116-V118 HydrophobicContact CG2-CG2 4.46Å; I116-L133 HydrophobicContact CB-CB 4.26Å; I116-L133 PolarHBondContact N-O 3.07Å; I116-L133 PolarHBondContact O-N 2.76Å
117	F	96.6	Very high	94.6	Very high	53 Å²	53	47.5 Å²	47.5	23%	0.232	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.9	177.9	-59.8	-81.3	0	0	0	109.7	V109 A110 T112 H115 H130 L131 E132	V109-F117 CarbonylContact C-O 3.57Å; V109-F117 VanDerWaalsContact CA-O 3.31Å; V109-F117 WeakPolarHBondContact CA-O 3.32Å; A110-F117 PolarHBondContact N-O 2.88Å; A110-F117 PolarHBondContact O-N 3.09Å; T112-F117 HydrophobicContact CG2-CD2 4.21Å; T112-F117 HydrophobicContact CG2-CE2 3.71Å; H115-F117 HydrophobicContact CB-CE2 3.89Å; H115-F117 HydrophobicContact CB-CZ 3.84Å; F117-H130 AromaticContact CD1-CE1 3.76Å; F117-L131 WeakPolarHBondContact CA-O 3.32Å; F117-E132 HydrophobicContact CD1-CB 4.08Å; F117-E132 HydrophobicContact CD1-CG 3.97Å; F117-E132 HydrophobicContact CE1-CB 4.08Å; F117-E132 VanDerWaalsContact CE1-CD 3.47Å; F117-E132 HydrophobicContact CE1-CG 3.55Å; F117-E132 HydrophobicContact CZ-CG 4.26Å
118	V	97.7	Very high	94.5	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120	175.8	-175.8	0	0	0	0	108.4	I48 V52 V109 I116 H130 L131 L170	I48-V118 HydrophobicContact CG2-CG2 3.59Å; V52-V118 HydrophobicContact CG2-CG1 4.01Å; V109-V118 HydrophobicContact CG1-CG2 4.26Å; V109-V118 HydrophobicContact CG2-CG1 4.3Å; V109-V118 HydrophobicContact CG2-CG2 4.37Å; I116-V118 HydrophobicContact CG2-CG2 4.46Å; V118-H130 CarbonylContact O-C 3.58Å; V118-H130 WeakPolarHBondContact O-CA 3.31Å; V118-L131 HydrophobicContact CB-CB 4.34Å; V118-L131 PolarHBondContact N-O 3.2Å; V118-L131 PolarHBondContact O-N 3.03Å; V118-L170 HydrophobicContact CB-CD1 4.35Å; V118-L170 HydrophobicContact CG1-CD1 3.64Å; V118-L170 HydrophobicContact CG1-CD2 4.32Å
119	N	97.8	Very high	94.5	Very high	38 Å²	38	51.5 Å²	51.5	20%	0.203	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	137.4	173.1	-52.7	-57.6	0	0	0	110.2	V107 S108 F128 G129 H130	V107-N119 CarbonylContact C-O 3.59Å; V107-N119 WeakPolarHBondContact CA-O 3.45Å; S108-N119 PolarHBondContact N-O 3.48Å; S108-N119 PolarHBondContact O-N 3.17Å; S108-N119 WeakPolarHBondContact OG-CB 3.45Å; S108-N119 PolarHBondContact OG-ND2 3.16Å; N119-F128 HydrophobicContact CB-CE2 3.86Å; N119-F128 HydrophobicContact CB-CZ 4.14Å; N119-G129 WeakPolarHBondContact CA-O 3.47Å; N119-H130 PolarHBondContact OD1-ND1 3.43Å
120	V	97.4	Very high	94.5	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.1	171.3	-175.2	0	0	0	0	108.4	Q106 V107 F128 G129 L170 W171 V174	Q106-V120 CarbonylContact O-C 3.57Å; Q106-V120 WeakPolarHBondContact O-CA 3.26Å; V107-V120 HydrophobicContact CG1-CG2 4.39Å; V107-V120 HydrophobicContact CG2-CG1 4.38Å; V107-V120 HydrophobicContact CG2-CG2 4.25Å; V120-F128 WeakPolarHBondContact O-CA 3.44Å; V120-G129 PolarHBondContact N-O 3.12Å; V120-G129 PolarHBondContact O-N 2.98Å; V120-L170 HydrophobicContact CG2-CB 4.37Å; V120-L170 HydrophobicContact CG2-CD1 4.28Å; V120-L170 HydrophobicContact CG2-CD2 4.21Å; V120-W171 HydrophobicContact CG1-CZ3 4.18Å; V120-W171 HydrophobicContact CG2-CH2 4.32Å; V120-W171 HydrophobicContact CG2-CZ3 4.04Å; V120-V174 HydrophobicContact CB-CG2 4.13Å; V120-V174 HydrophobicContact CG1-CB 4.49Å; V120-V174 HydrophobicContact CG1-CG1 4.02Å; V120-V174 HydrophobicContact CG1-CG2 4.17Å; V120-V174 WeakPolarHBondContact O-CG2 3.5Å
121	T	96.7	Very high	94.6	Very high	35 Å²	35	54.4 Å²	54.4	22%	0.215	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	127.7	176.8	-49.4	0	0	0	0	109.3	L105 Q106 K127 F128	L105-T121 CarbonylContact C-O 3.55Å; L105-T121 VanDerWaalsContact CA-O 3.32Å; L105-T121 WeakPolarHBondContact CA-O 3.1Å; Q106-T121 PolarHBondContact N-O 2.93Å; Q106-T121 PolarHBondContact O-N 3.12Å; T121-K127 CarbonylContact C-O 3.28Å; T121-K127 WeakPolarHBondContact CA-O 3.44Å; T121-F128 WeakPolarHBondContact OG1-CD2 3.2Å
122	D	94.9	Very high	94.8	Very high	3 Å²	3	57 Å²	57	2%	0.016	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	103.2	164.5	-176	11.3	0	0	0	108.9	S103 Q104 L105 T124 T125 D126 K127 V174	S103-D122 WeakPolarHBondContact CB-OD1 3.43Å; S103-D122 WeakPolarHBondContact CB-OD2 3.42Å; S103-D122 PolarHBondContact OG-OD2 2.65Å; Q104-D122 PolarHBondContact N-OD1 2.79Å; Q104-D122 CarbonylContact O-C 3.6Å; Q104-D122 WeakPolarHBondContact O-CA 3.46Å; L105-D122 HydrophobicContact CD2-CB 3.6Å; D122-T124 PolarHBondContact O-N 2.77Å; D122-T124 VanDerWaalsContact O-N 3.17Å; D122-T124 PolarHBondContact OD1-N 2.79Å; D122-T124 PolarHBondContact OD1-OG1 3.17Å; D122-T124 PolarHBondContact OD2-OG1 3.32Å; D122-T125 WeakPolarHBondContact CB-OG1 3.49Å; D122-T125 VanDerWaalsContact CG-OG1 3.3Å; D122-T125 PolarHBondContact O-N 3.46Å; D122-T125 WeakPolarHBondContact OD2-CG2 3.43Å; D122-T125 PolarHBondContact OD2-OG1 3.07Å; D122-D126 WeakPolarHBondContact O-CA 3.19Å; D122-D126 PolarHBondContact O-N 2.72Å; D122-K127 PolarHBondContact N-O 2.94Å; D122-K127 PolarHBondContact O-N 3.27Å; D122-V174 HydrophobicContact CB-CG1 3.68Å
123	T	93	Very high	94.8	Very high	59 Å²	59	54.1 Å²	54.1	36%	0.362	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.1	-175.5	62.8	0	0	0	0	112.9	Q104 Q106	Q104-T123 VanDerWaalsContact CB-OG1 3.22Å; Q104-T123 WeakPolarHBondContact CB-OG1 3.22Å; Q104-T123 PolarHBondContact O-N 2.99Å; Q104-T123 PolarHBondContact O-OG1 3.15Å; Q104-T123 VanDerWaalsContact O-OG1 3.14Å; Q106-T123 HydrophobicContact CG-CG2 3.87Å
124	T	91.3	Very high	94.8	Very high	71 Å²	71	48.3 Å²	48.3	44%	0.436	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-31.6	175.5	68.7	0	0	0	0	112.6	C102 Q104 D122	C102-T124 WeakPolarHBondContact O-CG2 3.25Å; Q104-T124 HydrophobicContact CB-CG2 3.97Å; Q104-T124 HydrophobicContact CG-CG2 4.08Å; D122-T124 PolarHBondContact O-N 2.77Å; D122-T124 VanDerWaalsContact O-N 3.17Å; D122-T124 PolarHBondContact OD1-N 2.79Å; D122-T124 PolarHBondContact OD1-OG1 3.17Å; D122-T124 PolarHBondContact OD2-OG1 3.32Å
125	T	91.2	Very high	93.6	Very high	64 Å²	64	46 Å²	46	39%	0.393	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-3.6	-178.5	62.1	0	0	0	0	113.7	D122 K127	D122-T125 WeakPolarHBondContact CB-OG1 3.49Å; D122-T125 VanDerWaalsContact CG-OG1 3.3Å; D122-T125 PolarHBondContact O-N 3.46Å; D122-T125 WeakPolarHBondContact OD2-CG2 3.43Å; D122-T125 PolarHBondContact OD2-OG1 3.07Å; T125-K127 PolarHBondContact O-N 3.21Å; T125-K127 WeakPolarHBondContact OG1-CD 3.48Å; T125-K127 WeakPolarHBondContact OG1-CG 3.34Å
126	D	92.6	Very high	92.6	Very high	141 Å²	141	49.4 Å²	49.4	75%	0.754	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	56	27.9	-174.8	-159.2	33	0	0	0	113	D122	D122-D126 WeakPolarHBondContact O-CA 3.19Å; D122-D126 PolarHBondContact O-N 2.72Å
127	K	94.9	Very high	92	Very high	76 Å²	76	54 Å²	54	33%	0.33	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	141.9	177.3	-67.7	177.4	-176.3	169.4	0	110.3	T121 D122 T125 P173 V174 P176	T121-K127 CarbonylContact C-O 3.28Å; T121-K127 WeakPolarHBondContact CA-O 3.44Å; D122-K127 PolarHBondContact N-O 2.94Å; D122-K127 PolarHBondContact O-N 3.27Å; T125-K127 PolarHBondContact O-N 3.21Å; T125-K127 WeakPolarHBondContact OG1-CD 3.48Å; T125-K127 WeakPolarHBondContact OG1-CG 3.34Å; K127-P173 WeakPolarHBondContact CD-O 3.49Å; K127-V174 WeakPolarHBondContact CD-O 3.32Å; K127-P176 HydrophobicContact CD-CG 4.15Å
128	F	96	Very high	91.4	Very high	111 Å²	111	52 Å²	52	49%	0.487	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	134.4	-172.9	178.9	-101.3	0	0	0	110.7	N119 V120 T121 H130	N119-F128 HydrophobicContact CB-CE2 3.86Å; N119-F128 HydrophobicContact CB-CZ 4.14Å; V120-F128 WeakPolarHBondContact O-CA 3.44Å; T121-F128 WeakPolarHBondContact OG1-CD2 3.2Å; F128-H130 HydrophobicContact CD1-CB 4.47Å; F128-H130 HydrophobicContact CE1-CB 3.61Å; F128-H130 HydrophobicContact CZ-CB 3.99Å
129	G	97.3	Very high	91	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.01	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	139.9	172.9	0	0	0	0	0	109.5	N119 V120 N169	N119-G129 WeakPolarHBondContact CA-O 3.47Å; V120-G129 PolarHBondContact N-O 3.12Å; V120-G129 PolarHBondContact O-N 2.98Å; G129-N169 VanDerWaalsContact CA-O 3.31Å; G129-N169 WeakPolarHBondContact CA-O 2.93Å
130	H	97.8	Very high	90.4	Very high	77 Å²	77	52 Å²	52	36%	0.356	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	136.3	-177.4	177.2	73.9	0	0	0	110	F117 V118 N119 F128 N169	F117-H130 AromaticContact CD1-CE1 3.76Å; V118-H130 CarbonylContact O-C 3.58Å; V118-H130 WeakPolarHBondContact O-CA 3.31Å; N119-H130 PolarHBondContact OD1-ND1 3.43Å; F128-H130 HydrophobicContact CD1-CB 4.47Å; F128-H130 HydrophobicContact CE1-CB 3.61Å; F128-H130 HydrophobicContact CZ-CB 3.99Å; H130-N169 PolarHBondContact N-O 2.81Å; H130-N169 WeakPolarHBondContact O-CB 3.24Å
131	L	97.2	Very high	89.8	Confident	12 Å²	12	54.3 Å²	54.3	6%	0.063	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	132.3	176.4	175.5	65.9	0	0	0	109.9	F117 V118 L133 F166 N169 L170	F117-L131 WeakPolarHBondContact CA-O 3.32Å; V118-L131 HydrophobicContact CB-CB 4.34Å; V118-L131 PolarHBondContact N-O 3.2Å; V118-L131 PolarHBondContact O-N 3.03Å; L131-L133 HydrophobicContact CD1-CD2 4.08Å; L131-L133 HydrophobicContact CD2-CD1 4.38Å; L131-L133 HydrophobicContact CD2-CD2 3.93Å; L131-L133 HydrophobicContact CD2-CG 4.16Å; L131-L133 HydrophobicContact CG-CD2 3.93Å; L131-L133 HydrophobicContact CG-CG 4.03Å; L131-F166 HydrophobicContact CD2-CD1 3.28Å; L131-F166 HydrophobicContact CD2-CE1 3.44Å; L131-F166 VanDerWaalsContact CD2-CE1 3.44Å; L131-N169 HydrophobicContact CB-CB 4.25Å; L131-N169 HydrophobicContact CD1-CB 4.15Å; L131-L170 HydrophobicContact CB-CD1 4.46Å; L131-L170 HydrophobicContact CB-CD2 3.82Å; L131-L170 HydrophobicContact CB-CG 4.14Å; L131-L170 HydrophobicContact CD2-CD1 4.27Å; L131-L170 HydrophobicContact CD2-CG 4.49Å
132	E	96.2	Very high	89	Confident	100 Å²	100	59.2 Å²	59.2	47%	0.467	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.3	172.8	-179.1	176.5	178.9	0	0	108.8	H115 F117	H115-E132 HydrophobicContact CB-CG 4.22Å; H115-E132 IonicContact CD2-OE1 3.69Å; H115-E132 IonicContact CE1-OE1 3.73Å; H115-E132 IonicContact CG-OE1 3.42Å; H115-E132 IonicContact ND1-OE1 3.46Å; H115-E132 PolarHBondContact ND1-OE1 3.28Å; H115-E132 IonicContact NE2-OE1 3.92Å; F117-E132 HydrophobicContact CD1-CB 4.08Å; F117-E132 HydrophobicContact CD1-CG 3.97Å; F117-E132 HydrophobicContact CE1-CB 4.08Å; F117-E132 VanDerWaalsContact CE1-CD 3.47Å; F117-E132 HydrophobicContact CE1-CG 3.55Å; F117-E132 HydrophobicContact CZ-CG 4.26Å
133	L	94.4	Very high	87.7	Confident	6 Å²	6	61.2 Å²	61.2	3%	0.031	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138	-177	-65.2	176.2	0	0	0	109.4	I48 H115 I116 L131 G135 L162 F166	I48-L133 HydrophobicContact CD1-CD1 4.02Å; I48-L133 HydrophobicContact CG1-CD1 4.39Å; I48-L133 HydrophobicContact CG2-CD1 4.26Å; H115-L133 CarbonylContact C-O 3.51Å; H115-L133 WeakPolarHBondContact CA-O 3.42Å; I116-L133 HydrophobicContact CB-CB 4.26Å; I116-L133 PolarHBondContact N-O 3.07Å; I116-L133 PolarHBondContact O-N 2.76Å; L131-L133 HydrophobicContact CD1-CD2 4.08Å; L131-L133 HydrophobicContact CD2-CD1 4.38Å; L131-L133 HydrophobicContact CD2-CD2 3.93Å; L131-L133 HydrophobicContact CD2-CG 4.16Å; L131-L133 HydrophobicContact CG-CD2 3.93Å; L131-L133 HydrophobicContact CG-CG 4.03Å; L133-G135 PolarHBondContact O-N 3.42Å; L133-L162 HydrophobicContact CD1-CD1 3.51Å; L133-L162 HydrophobicContact CD2-CD1 3.65Å; L133-L162 HydrophobicContact CG-CD1 4.24Å; L133-F166 HydrophobicContact CD1-CE1 4.5Å
134	S	88.1	Confident	86.6	Confident	55 Å²	55	59.4 Å²	59.4	39%	0.385	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	113.2	172	-59.5	0	0	0	0	108.6	I136 E137 H138	S134-I136 VanDerWaalsContact C-N 3.33Å; S134-I136 PolarHBondContact O-N 3.42Å; S134-I136 VanDerWaalsContact O-N 3.1Å; S134-E137 WeakPolarHBondContact O-CG 3.41Å; S134-H138 PolarHBondContact O-CD2 3.24Å
135	G	65.6	Low	85.2	Confident	5 Å²	5	62.1 Å²	62.1	5%	0.052	33%	0.327	C	S	.	.	H	α-helix	trans	-61	-32.6	-155.4	0	0	0	0	0	115.8	R44 A114 L133	R44-G135 WeakPolarHBondContact CD-O 3.44Å; R44-G135 PolarHBondContact NE-O 3.46Å; A114-G135 PolarHBondContact O-N 3.23Å; L133-G135 PolarHBondContact O-N 3.42Å
136	I	73	Confident	83.5	Confident	130 Å²	130	64.8 Å²	64.8	67%	0.667	34%	0.339	S	S	*	.	H	α-helix	trans	-76	-32.2	-166.8	-57.8	168.9	0	0	0	112.9	S134	S134-I136 VanDerWaalsContact C-N 3.33Å; S134-I136 PolarHBondContact O-N 3.42Å; S134-I136 VanDerWaalsContact O-N 3.1Å
137	E	82.5	Confident	81.6	Confident	98 Å²	98	65.8 Å²	65.8	46%	0.458	34%	0.344	S	S	.	.	H	α-helix	trans	-82.6	-27.3	-170.8	57.3	-175.6	172.2	0	0	113.7	S134 Q158	S134-E137 WeakPolarHBondContact O-CG 3.41Å; E137-Q158 PolarHBondContact O-OE1 3.01Å
138	H	83.7	Confident	79.8	Confident	11 Å²	11	67.9 Å²	67.9	5%	0.051	36%	0.363	C	S	.	.	H	α-helix	trans	-90.6	-22.5	-172.5	-55.7	-55.6	0	0	0	114.6	S134 F156 Q158	S134-H138 PolarHBondContact O-CD2 3.24Å; H138-F156 WeakPolarHBondContact O-CA 3.34Å; H138-Q158 PolarHBondContact CE1-OE1 3.37Å; H138-Q158 PolarHBondContact ND1-OE1 2.82Å
139	V	88.9	Confident	78.4	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.006	35%	0.349	C	S	.	.			trans	-132.3	118.2	-179.7	-176.3	0	0	0	0	111.1	R44 F47 I48 L141 V155 F156	R44-V139 HydrophobicContact CB-CB 4.04Å; R44-V139 HydrophobicContact CB-CG1 4.33Å; R44-V139 HydrophobicContact CB-CG2 4.25Å; R44-V139 HydrophobicContact CG-CB 4Å; R44-V139 HydrophobicContact CG-CG1 4.2Å; R44-V139 PolarHBondContact NE-O 2.84Å; F47-V139 HydrophobicContact CB-CG1 3.84Å; F47-V139 HydrophobicContact CB-CG2 4.32Å; F47-V139 HydrophobicContact CD2-CG1 4.08Å; F47-V139 HydrophobicContact CG-CG1 4.11Å; I48-V139 HydrophobicContact CD1-CG2 3.58Å; I48-V139 HydrophobicContact CG1-CG2 3.82Å; V139-L141 HydrophobicContact CG1-CD2 4.04Å; V139-V155 WeakPolarHBondContact CA-O 3.26Å; V139-V155 HydrophobicContact CG1-CG1 4.47Å; V139-F156 HydrophobicContact CG2-CD1 4.11Å; V139-F156 HydrophobicContact CG2-CE1 4.02Å
140	C	86	Confident	76.7	Confident	37 Å²	37	68.2 Å²	68.2	25%	0.25	38%	0.383	C	S	.	.			trans	-90.7	106.7	173.5	-173.8	0	0	0	0	110.4	S143 T154 V155 P157	C140-S143 PolarHBondContact SG-OG 2.82Å; C140-T154 WeakPolarHBondContact CB-O 3.32Å; C140-V155 PolarHBondContact N-O 2.87Å; C140-P157 HydrophobicContact CB-CG 3.97Å
141	L	85.3	Confident	75.8	Confident	48 Å²	48	67.9 Å²	67.9	25%	0.251	38%	0.384	S	S	.	.	S	Bend	trans	-77.3	-23.2	178.8	-64.2	179.4	0	0	0	113.1	R44 F47 V139 S143 V144	R44-L141 HydrophobicContact CG-CD1 3.87Å; R44-L141 HydrophobicContact CG-CD2 4.05Å; R44-L141 HydrophobicContact CG-CG 3.96Å; F47-L141 HydrophobicContact CD2-CD2 3.95Å; F47-L141 HydrophobicContact CE2-CD2 4Å; V139-L141 HydrophobicContact CG1-CD2 4.04Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 2.82Å; L141-V144 WeakPolarHBondContact O-CB 3.49Å; L141-V144 PolarHBondContact O-N 2.94Å
142	D	79.1	Confident	75.2	Confident	138 Å²	138	67.6 Å²	67.6	74%	0.738	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-66.6	-31.5	-176.6	-63.3	-26	0	0	0	112.2	V144	D142-V144 VanDerWaalsContact C-N 3.27Å; D142-V144 PolarHBondContact O-N 2.89Å
143	S	68.3	Low	74.7	Confident	44 Å²	44	65 Å²	65	31%	0.308	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-70.9	-19.9	179	-55.2	0	0	0	0	113.7	C140 L141 N145 T154	C140-S143 PolarHBondContact SG-OG 2.82Å; L141-S143 VanDerWaalsContact C-N 3.27Å; L141-S143 PolarHBondContact O-N 2.82Å; S143-N145 VanDerWaalsContact C-N 3.31Å; S143-N145 PolarHBondContact O-N 2.86Å; S143-T154 VanDerWaalsContact CB-O 3.31Å; S143-T154 WeakPolarHBondContact CB-O 3.29Å; S143-T154 PolarHBondContact OG-O 3.39Å
144	V	69.9	Low	74.3	Confident	22 Å²	22	67.7 Å²	67.7	13%	0.133	39%	0.389	C	S	.	.	G	3₁₀ helix	trans	-74.3	-21.9	-169.4	176.3	0	0	0	0	112.5	F47 L141 D142 N146 Y149	F47-V144 HydrophobicContact CE1-CG1 4.45Å; F47-V144 HydrophobicContact CE1-CG2 4.17Å; F47-V144 HydrophobicContact CE2-CG1 4.07Å; F47-V144 HydrophobicContact CE2-CG2 3.78Å; F47-V144 HydrophobicContact CZ-CB 4.17Å; F47-V144 HydrophobicContact CZ-CG1 3.48Å; F47-V144 VanDerWaalsContact CZ-CG1 3.48Å; F47-V144 HydrophobicContact CZ-CG2 3.52Å; L141-V144 WeakPolarHBondContact O-CB 3.49Å; L141-V144 PolarHBondContact O-N 2.94Å; D142-V144 VanDerWaalsContact C-N 3.27Å; D142-V144 PolarHBondContact O-N 2.89Å; V144-N146 PolarHBondContact O-N 2.84Å; V144-Y149 HydrophobicContact CG1-CE1 4.44Å
145	N	62.2	Low	74.3	Confident	128 Å²	128	65.1 Å²	65.1	68%	0.684	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-70.9	-17.9	-173.6	-69.2	-30.3	0	0	0	114.2	S143	S143-N145 VanDerWaalsContact C-N 3.31Å; S143-N145 PolarHBondContact O-N 2.86Å
146	N	54.5	Low	75.6	Confident	119 Å²	119	64.9 Å²	64.9	64%	0.636	37%	0.369	S	S	*	.	S	Bend	trans	-96.5	105.6	175.8	-65.7	-35.2	0	0	0	107.6	V144 T148	V144-N146 PolarHBondContact O-N 2.84Å; N146-T148 CarbonylContact O-C 3.54Å; N146-T148 PolarHBondContact O-N 2.8Å
147	L	53.6	Low	76.4	Confident	163 Å²	163	62.3 Å²	62.3	85%	0.853	36%	0.36	S	S	*	.	S	Bend	trans	-47.8	3.6	-176.6	-94	78.7	0	0	0	117.3
148	T	56.9	Low	76.7	Confident	120 Å²	120	60 Å²	60	74%	0.736	35%	0.35	S	S	*	.			trans	-106.3	93.5	173.8	-7.1	0	0	0	0	108.2	N146 G150	N146-T148 CarbonylContact O-C 3.54Å; N146-T148 PolarHBondContact O-N 2.8Å; T148-G150 PolarHBondContact O-N 3.17Å
149	Y	64.9	Low	77.1	Confident	48 Å²	48	59.8 Å²	59.8	19%	0.188	35%	0.349	C	S	.	.			trans	-66.9	75.2	163.2	-62	-77.6	0	0	0	108	L34 G38 F47 V144 D151 V155	L34-Y149 HydrophobicContact CB-CD1 4.49Å; L34-Y149 HydrophobicContact CB-CG 4.32Å; G38-Y149 WeakPolarHBondContact CA-OH 3.34Å; G38-Y149 PolarHBondContact O-OH 3.41Å; G38-Y149 VanDerWaalsContact O-OH 3.05Å; F47-Y149 HydrophobicContact CE1-CE1 4.21Å; V144-Y149 HydrophobicContact CG1-CE1 4.44Å; Y149-D151 VanDerWaalsContact C-N 3.33Å; Y149-V155 HydrophobicContact CD1-CG2 3.89Å; Y149-V155 HydrophobicContact CE1-CG2 4.16Å
150	G	62.6	Low	77.2	Confident	70 Å²	70	61.6 Å²	61.6	72%	0.722	36%	0.358	S	S	*	.			trans	-78.3	-19.7	-174.2	0	0	0	0	0	113.2	T148	T148-G150 PolarHBondContact O-N 3.17Å
151	D	78.8	Confident	77.5	Confident	70 Å²	70	65 Å²	65	37%	0.374	37%	0.371	S	S	.	.			trans	-158.7	126.7	177.7	-178.2	4.6	0	0	0	109.5	Y149 N153 T154	Y149-D151 VanDerWaalsContact C-N 3.33Å; D151-N153 PolarHBondContact O-N 3.39Å; D151-N153 VanDerWaalsContact O-N 3.16Å; D151-N153 PolarHBondContact OD1-N 3.45Å; D151-N153 VanDerWaalsContact OD1-N 3.08Å; D151-N153 PolarHBondContact OD1-ND2 3.15Å; D151-N153 VanDerWaalsContact OD1-ND2 3.07Å; D151-N153 PolarHBondContact OD2-ND2 2.98Å; D151-T154 HydrophobicContact CB-CG2 4.14Å; D151-T154 WeakPolarHBondContact O-CB 3.44Å; D151-T154 PolarHBondContact O-N 3.42Å; D151-T154 PolarHBondContact O-OG1 3.1Å
152	A	85	Confident	77.9	Confident	6 Å²	6	62.8 Å²	62.8	5%	0.05	36%	0.359	C	S	.	.	H	α-helix	trans	-56.3	-29.1	176.6	0	0	0	0	0	112.7	L30 L34 T154 V155 F156 L159	L30-A152 HydrophobicContact CD2-CB 3.62Å; L30-A152 HydrophobicContact CG-CB 4.26Å; L34-A152 HydrophobicContact CD1-CB 4.22Å; A152-T154 PolarHBondContact O-N 2.93Å; A152-V155 PolarHBondContact O-N 2.84Å; A152-V155 VanDerWaalsContact O-N 3.12Å; A152-F156 PolarHBondContact O-N 2.84Å; A152-L159 HydrophobicContact CB-CD2 4.28Å
153	N	85	Confident	78.6	Confident	45 Å²	45	57 Å²	57	24%	0.241	33%	0.328	C	S	.	.	H	α-helix	trans	-65.9	-20	178.4	-64.1	-50	0	0	0	113.3	N20 D151 V155 F156	N20-N153 PolarHBondContact OD1-ND2 3.35Å; D151-N153 PolarHBondContact O-N 3.39Å; D151-N153 VanDerWaalsContact O-N 3.16Å; D151-N153 PolarHBondContact OD1-N 3.45Å; D151-N153 VanDerWaalsContact OD1-N 3.08Å; D151-N153 PolarHBondContact OD1-ND2 3.15Å; D151-N153 VanDerWaalsContact OD1-ND2 3.07Å; D151-N153 PolarHBondContact OD2-ND2 2.98Å; N153-V155 VanDerWaalsContact C-N 3.35Å; N153-F156 CarbonylContact O-C 3.59Å
154	T	86	Confident	79.7	Confident	63 Å²	63	58.1 Å²	58.1	39%	0.387	33%	0.331	S	S	.	.	H	α-helix	trans	-73.7	-29.1	174.9	63.3	0	0	0	0	112.7	C140 S143 D151 A152	C140-T154 WeakPolarHBondContact CB-O 3.32Å; S143-T154 VanDerWaalsContact CB-O 3.31Å; S143-T154 WeakPolarHBondContact CB-O 3.29Å; S143-T154 PolarHBondContact OG-O 3.39Å; D151-T154 HydrophobicContact CB-CG2 4.14Å; D151-T154 WeakPolarHBondContact O-CB 3.44Å; D151-T154 PolarHBondContact O-N 3.42Å; D151-T154 PolarHBondContact O-OG1 3.1Å; A152-T154 PolarHBondContact O-N 2.93Å
155	V	89.2	Confident	80.9	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.006	33%	0.332	C	S	.	.	H	α-helix	trans	-88.6	-39.3	176.9	179.3	0	0	0	0	110.2	F47 V139 C140 Y149 A152 N153 P157	F47-V155 HydrophobicContact CB-CG1 4.46Å; F47-V155 HydrophobicContact CD1-CG1 3.6Å; F47-V155 HydrophobicContact CE1-CG1 4.08Å; F47-V155 HydrophobicContact CG-CG1 4.08Å; V139-V155 WeakPolarHBondContact CA-O 3.26Å; V139-V155 HydrophobicContact CG1-CG1 4.47Å; C140-V155 PolarHBondContact N-O 2.87Å; Y149-V155 HydrophobicContact CD1-CG2 3.89Å; Y149-V155 HydrophobicContact CE1-CG2 4.16Å; A152-V155 PolarHBondContact O-N 2.84Å; A152-V155 VanDerWaalsContact O-N 3.12Å; N153-V155 VanDerWaalsContact C-N 3.35Å; V155-P157 WeakPolarHBondContact O-CD 3.46Å
156	F	91.7	Very high	82.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.299	C	S	.	.			trans	-118.1	84.7	-179.1	-54.3	-74.9	0	0	0	111	L30 L34 F47 I48 L51 H138 V139 A152 N153 Q158 L159 L162	L30-F156 HydrophobicContact CD1-CE2 4.38Å; L34-F156 HydrophobicContact CD1-CE2 4.24Å; L34-F156 HydrophobicContact CD2-CE2 4.2Å; F47-F156 HydrophobicContact CB-CE1 4.07Å; F47-F156 HydrophobicContact CB-CZ 4.07Å; F47-F156 WeakPolarHBondContact O-CZ 3.3Å; I48-F156 HydrophobicContact CD1-CE1 4.29Å; L51-F156 HydrophobicContact CB-CE1 4.22Å; L51-F156 HydrophobicContact CB-CZ 3.95Å; L51-F156 HydrophobicContact CD2-CD1 4.37Å; L51-F156 HydrophobicContact CD2-CE1 4.33Å; H138-F156 WeakPolarHBondContact O-CA 3.34Å; V139-F156 HydrophobicContact CG2-CD1 4.11Å; V139-F156 HydrophobicContact CG2-CE1 4.02Å; A152-F156 PolarHBondContact O-N 2.84Å; N153-F156 CarbonylContact O-C 3.59Å; F156-Q158 PolarHBondContact O-N 3.38Å; F156-Q158 VanDerWaalsContact O-N 3.16Å; F156-L159 HydrophobicContact CB-CB 3.94Å; F156-L159 HydrophobicContact CB-CD1 4Å; F156-L159 HydrophobicContact CB-CG 4.49Å; F156-L159 HydrophobicContact CD2-CD1 4.3Å; F156-L159 HydrophobicContact CG-CD1 4.25Å; F156-L159 WeakPolarHBondContact O-CB 3.46Å; F156-L159 PolarHBondContact O-N 3.41Å; F156-L159 VanDerWaalsContact O-N 3.12Å; F156-L162 HydrophobicContact CD1-CD2 4.2Å
157	P	89.6	Confident	84.3	Confident	76 Å²	76	49.9 Å²	49.9	49%	0.494	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-32.4	-178.3	-26.2	35.1	0	0	0	113.8	C140 V155	C140-P157 HydrophobicContact CB-CG 3.97Å; V155-P157 WeakPolarHBondContact O-CD 3.46Å
158	Q	89.3	Confident	86.3	Confident	51 Å²	51	47 Å²	47	24%	0.238	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	36.6	179.3	-71.7	175.5	-50.9	0	0	112.4	E137 H138 F156 N160 E161 L162	E137-Q158 PolarHBondContact O-OE1 3.01Å; H138-Q158 PolarHBondContact CE1-OE1 3.37Å; H138-Q158 PolarHBondContact ND1-OE1 2.82Å; F156-Q158 PolarHBondContact O-N 3.38Å; F156-Q158 VanDerWaalsContact O-N 3.16Å; Q158-N160 VanDerWaalsContact C-N 3.29Å; Q158-N160 PolarHBondContact O-N 3.42Å; Q158-N160 VanDerWaalsContact O-N 3.17Å; Q158-E161 HydrophobicContact CB-CB 4.31Å; Q158-E161 PolarHBondContact NE2-OE2 3.12Å; Q158-E161 PolarHBondContact O-N 2.91Å; Q158-E161 VanDerWaalsContact O-N 3.13Å; Q158-L162 WeakPolarHBondContact O-CB 3.37Å; Q158-L162 PolarHBondContact O-N 2.74Å
159	L	91.6	Very high	88.1	Confident	6 Å²	6	44.7 Å²	44.7	3%	0.031	25%	0.251	C	S	.	.	H	α-helix	trans	-50.8	-45.3	-174.3	-177.4	59.3	0	0	0	113.3	L30 L51 A152 F156 L162 L163	L30-L159 HydrophobicContact CD2-CD1 4.45Å; L30-L159 HydrophobicContact CD2-CD2 4.39Å; L51-L159 HydrophobicContact CD1-CD1 3.81Å; L51-L159 HydrophobicContact CD2-CD1 4.02Å; A152-L159 HydrophobicContact CB-CD2 4.28Å; F156-L159 HydrophobicContact CB-CB 3.94Å; F156-L159 HydrophobicContact CB-CD1 4Å; F156-L159 HydrophobicContact CB-CG 4.49Å; F156-L159 HydrophobicContact CD2-CD1 4.3Å; F156-L159 HydrophobicContact CG-CD1 4.25Å; F156-L159 WeakPolarHBondContact O-CB 3.46Å; F156-L159 PolarHBondContact O-N 3.41Å; F156-L159 VanDerWaalsContact O-N 3.12Å; L159-L162 PolarHBondContact O-N 3.03Å; L159-L163 HydrophobicContact CD1-CD1 4.18Å; L159-L163 HydrophobicContact CD1-CG 4.25Å; L159-L163 HydrophobicContact CG-CD1 4.02Å; L159-L163 WeakPolarHBondContact O-CG 3.34Å; L159-L163 PolarHBondContact O-N 3.4Å
160	N	91.7	Very high	89.6	Confident	38 Å²	38	42.4 Å²	42.4	20%	0.203	24%	0.242	C	C	.	.	H	α-helix	trans	-65.9	-40.9	-178.3	-68.5	-46.8	0	0	0	113	K21 Q158 L163 D164	K21-N160 PolarHBondContact N-OD1 3.3Å; K21-N160 VanDerWaalsContact N-OD1 3.08Å; Q158-N160 VanDerWaalsContact C-N 3.29Å; Q158-N160 PolarHBondContact O-N 3.42Å; Q158-N160 VanDerWaalsContact O-N 3.17Å; N160-L163 PolarHBondContact O-N 3.49Å; N160-D164 PolarHBondContact O-N 3.47Å
161	E	91.9	Very high	91.1	Very high	109 Å²	109	39.3 Å²	39.3	51%	0.509	21%	0.208	S	C	.	.	H	α-helix	trans	-66.6	-40.8	177.4	180	175.7	-171.2	0	0	110.9	Q158 L163 D164 S165	Q158-E161 HydrophobicContact CB-CB 4.31Å; Q158-E161 PolarHBondContact NE2-OE2 3.12Å; Q158-E161 PolarHBondContact O-N 2.91Å; Q158-E161 VanDerWaalsContact O-N 3.13Å; E161-L163 VanDerWaalsContact C-N 3.35Å; E161-L163 PolarHBondContact O-N 2.93Å; E161-D164 PolarHBondContact O-N 3.1Å; E161-S165 PolarHBondContact O-N 2.64Å
162	L	93.2	Very high	91.8	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-42.3	176	-173.4	58.6	0	0	0	111.6	I48 L51 L133 F156 Q158 L159 S165 F166	I48-L162 HydrophobicContact CD1-CD1 4.48Å; I48-L162 HydrophobicContact CD1-CD2 3.72Å; L51-L162 HydrophobicContact CD2-CD2 3.23Å; L51-L162 HydrophobicContact CD2-CG 3.8Å; L133-L162 HydrophobicContact CD1-CD1 3.51Å; L133-L162 HydrophobicContact CD2-CD1 3.65Å; L133-L162 HydrophobicContact CG-CD1 4.24Å; F156-L162 HydrophobicContact CD1-CD2 4.2Å; Q158-L162 WeakPolarHBondContact O-CB 3.37Å; Q158-L162 PolarHBondContact O-N 2.74Å; L159-L162 PolarHBondContact O-N 3.03Å; L162-S165 PolarHBondContact O-N 3.15Å; L162-S165 PolarHBondContact O-OG 2.93Å; L162-F166 HydrophobicContact CD1-CD1 4.13Å; L162-F166 HydrophobicContact CD1-CE1 3.52Å; L162-F166 HydrophobicContact CD1-CZ 4.06Å; L162-F166 HydrophobicContact CD2-CZ 4.5Å; L162-F166 HydrophobicContact CG-CD1 4.41Å; L162-F166 HydrophobicContact CG-CE1 3.91Å; L162-F166 HydrophobicContact CG-CZ 4.06Å; L162-F166 VanDerWaalsContact O-CD1 3.26Å; L162-F166 WeakPolarHBondContact O-CD1 3.47Å; L162-F166 WeakPolarHBondContact O-CG 3.36Å; L162-F166 PolarHBondContact O-N 3.39Å
163	L	93.8	Very high	92.2	Very high	17 Å²	17	42.9 Å²	42.9	9%	0.089	23%	0.225	C	C	.	.	H	α-helix	trans	-66.3	-39.8	176.5	-68.1	168.1	0	0	0	112.8	R22 L51 E55 L159 N160 E161 S165 F166 E167	R22-L163 HydrophobicContact CG-CD1 3.39Å; L51-L163 HydrophobicContact CD1-CD2 4.48Å; E55-L163 VanDerWaalsContact CD-CD2 3.49Å; E55-L163 HydrophobicContact CG-CD2 3.93Å; E55-L163 WeakPolarHBondContact OE1-CD2 3.3Å; L159-L163 HydrophobicContact CD1-CD1 4.18Å; L159-L163 HydrophobicContact CD1-CG 4.25Å; L159-L163 HydrophobicContact CG-CD1 4.02Å; L159-L163 WeakPolarHBondContact O-CG 3.34Å; L159-L163 PolarHBondContact O-N 3.4Å; N160-L163 PolarHBondContact O-N 3.49Å; E161-L163 VanDerWaalsContact C-N 3.35Å; E161-L163 PolarHBondContact O-N 2.93Å; L163-S165 VanDerWaalsContact C-N 3.31Å; L163-F166 PolarHBondContact O-N 3.39Å; L163-E167 PolarHBondContact O-N 2.83Å
164	D	93.3	Very high	92.5	Very high	68 Å²	68	40.9 Å²	40.9	36%	0.364	21%	0.214	S	C	.	.	H	α-helix	trans	-63	-41.1	174.2	-73.4	-23.7	0	0	0	110.4	K21 N160 E161 F166 E167 E168	K21-D164 IonicContact NZ-OD1 3.65Å; K21-D164 PolarHBondContact NZ-OD1 3.08Å; K21-D164 IonicContact NZ-OD2 3.62Å; K21-D164 PolarHBondContact NZ-OD2 3.12Å; N160-D164 PolarHBondContact O-N 3.47Å; E161-D164 PolarHBondContact O-N 3.1Å; D164-F166 VanDerWaalsContact C-N 3.34Å; D164-F166 PolarHBondContact O-N 3.23Å; D164-E167 PolarHBondContact O-N 3.03Å; D164-E168 WeakPolarHBondContact O-CG 3.33Å; D164-E168 PolarHBondContact O-N 3.16Å
165	S	94.2	Very high	92.6	Very high	23 Å²	23	39.7 Å²	39.7	16%	0.161	21%	0.205	C	C	.	.	H	α-helix	trans	-64.2	-36.5	175.3	81.2	0	0	0	0	112.9	E161 L162 L163 N169	E161-S165 PolarHBondContact O-N 2.64Å; L162-S165 PolarHBondContact O-N 3.15Å; L162-S165 PolarHBondContact O-OG 2.93Å; L163-S165 VanDerWaalsContact C-N 3.31Å; S165-N169 VanDerWaalsContact O-CB 3.3Å; S165-N169 WeakPolarHBondContact O-CB 3.4Å; S165-N169 PolarHBondContact O-N 3.11Å; S165-N169 PolarHBondContact O-ND2 2.78Å
166	F	95.2	Very high	92.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66.4	-43.1	175.3	-76.6	10.7	0	0	0	111	I48 L51 V52 E55 L131 L133 L162 L163 D164 L170 W171	I48-F166 HydrophobicContact CG2-CZ 4.29Å; L51-F166 HydrophobicContact CB-CE2 4.41Å; L51-F166 HydrophobicContact CD2-CE2 3.82Å; L51-F166 HydrophobicContact CD2-CZ 4.06Å; L51-F166 HydrophobicContact CG-CE2 3.86Å; L51-F166 HydrophobicContact CG-CZ 4.45Å; V52-F166 HydrophobicContact CB-CE2 4.45Å; V52-F166 HydrophobicContact CG2-CD2 4.41Å; V52-F166 HydrophobicContact CG2-CE1 4.48Å; V52-F166 HydrophobicContact CG2-CE2 3.52Å; V52-F166 HydrophobicContact CG2-CZ 3.56Å; E55-F166 HydrophobicContact CG-CD2 4.26Å; L131-F166 HydrophobicContact CD2-CD1 3.28Å; L131-F166 HydrophobicContact CD2-CE1 3.44Å; L131-F166 VanDerWaalsContact CD2-CE1 3.44Å; L133-F166 HydrophobicContact CD1-CE1 4.5Å; L162-F166 HydrophobicContact CD1-CD1 4.13Å; L162-F166 HydrophobicContact CD1-CE1 3.52Å; L162-F166 HydrophobicContact CD1-CZ 4.06Å; L162-F166 HydrophobicContact CD2-CZ 4.5Å; L162-F166 HydrophobicContact CG-CD1 4.41Å; L162-F166 HydrophobicContact CG-CE1 3.91Å; L162-F166 HydrophobicContact CG-CZ 4.06Å; L162-F166 VanDerWaalsContact O-CD1 3.26Å; L162-F166 WeakPolarHBondContact O-CD1 3.47Å; L162-F166 WeakPolarHBondContact O-CG 3.36Å; L162-F166 PolarHBondContact O-N 3.39Å; L163-F166 PolarHBondContact O-N 3.39Å; D164-F166 VanDerWaalsContact C-N 3.34Å; D164-F166 PolarHBondContact O-N 3.23Å; F166-L170 HydrophobicContact CB-CD1 4.37Å; F166-L170 HydrophobicContact CD1-CD1 3.91Å; F166-L170 HydrophobicContact CE1-CD1 4.31Å; F166-L170 HydrophobicContact CG-CD1 4.07Å; F166-L170 WeakPolarHBondContact O-CA 3.35Å; F166-L170 VanDerWaalsContact O-CB 3.28Å; F166-L170 WeakPolarHBondContact O-CB 3.45Å; F166-L170 PolarHBondContact O-N 2.83Å; F166-W171 HydrophobicContact CD2-CZ2 4.33Å; F166-W171 PolarHBondContact O-N 3.02Å
167	E	93.7	Very high	91	Very high	72 Å²	72	47.7 Å²	47.7	34%	0.336	26%	0.26	S	S	.	.	I	π-helix	trans	-62.1	-48	178.7	-170.5	62.1	-155.1	0	0	111.7	R59 L163 D164 W171 K172	R59-E167 IonicContact CZ-OE2 2.69Å; R59-E167 IonicContact NH2-OE2 3.17Å; R59-E167 PolarHBondContact NH2-OE2 3.04Å; L163-E167 PolarHBondContact O-N 2.83Å; D164-E167 PolarHBondContact O-N 3.03Å; E167-W171 VanDerWaalsContact OE2-CD1 3.32Å; E167-K172 WeakPolarHBondContact O-CB 3.37Å; E167-K172 VanDerWaalsContact O-CG 3.28Å; E167-K172 WeakPolarHBondContact O-CG 3.45Å; E167-K172 PolarHBondContact O-N 3.34Å
168	E	94.3	Very high	89.4	Confident	103 Å²	103	49.6 Å²	49.6	48%	0.481	27%	0.272	S	S	.	.	I	π-helix	trans	-69.2	-44.2	-179.2	-64.1	-57.9	151.1	0	0	113.3	D164 K172 P173	D164-E168 WeakPolarHBondContact O-CG 3.33Å; D164-E168 PolarHBondContact O-N 3.16Å; E168-K172 WeakPolarHBondContact OE1-CE 3.47Å; E168-K172 IonicContact OE1-NZ 2.9Å; E168-K172 PolarHBondContact OE1-NZ 2.88Å; E168-K172 WeakPolarHBondContact OE2-CD 3.31Å; E168-K172 WeakPolarHBondContact OE2-CE 3.15Å; E168-K172 IonicContact OE2-NZ 2.58Å; E168-K172 PolarHBondContact OE2-NZ 2.9Å; E168-P173 WeakPolarHBondContact O-CD 3.37Å
169	N	95.9	Very high	86.9	Confident	72 Å²	72	51.6 Å²	51.6	39%	0.385	30%	0.297	S	S	.	.	I	π-helix	trans	-100.8	-22.2	-167.1	-60.1	-65.8	0	0	0	114.5	G129 H130 L131 S165	G129-N169 VanDerWaalsContact CA-O 3.31Å; G129-N169 WeakPolarHBondContact CA-O 2.93Å; H130-N169 PolarHBondContact N-O 2.81Å; H130-N169 WeakPolarHBondContact O-CB 3.24Å; L131-N169 HydrophobicContact CB-CB 4.25Å; L131-N169 HydrophobicContact CD1-CB 4.15Å; S165-N169 VanDerWaalsContact O-CB 3.3Å; S165-N169 WeakPolarHBondContact O-CB 3.4Å; S165-N169 PolarHBondContact O-N 3.11Å; S165-N169 PolarHBondContact O-ND2 2.78Å
170	L	96	Very high	84.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.337	C	S	.	.	I	π-helix	trans	-111.1	-53.7	-179.2	-53.8	179.3	0	0	0	111.4	V118 V120 L131 F166 V174	V118-L170 HydrophobicContact CB-CD1 4.35Å; V118-L170 HydrophobicContact CG1-CD1 3.64Å; V118-L170 HydrophobicContact CG1-CD2 4.32Å; V120-L170 HydrophobicContact CG2-CB 4.37Å; V120-L170 HydrophobicContact CG2-CD1 4.28Å; V120-L170 HydrophobicContact CG2-CD2 4.21Å; L131-L170 HydrophobicContact CB-CD1 4.46Å; L131-L170 HydrophobicContact CB-CD2 3.82Å; L131-L170 HydrophobicContact CB-CG 4.14Å; L131-L170 HydrophobicContact CD2-CD1 4.27Å; L131-L170 HydrophobicContact CD2-CG 4.49Å; F166-L170 HydrophobicContact CB-CD1 4.37Å; F166-L170 HydrophobicContact CD1-CD1 3.91Å; F166-L170 HydrophobicContact CE1-CD1 4.31Å; F166-L170 HydrophobicContact CG-CD1 4.07Å; F166-L170 WeakPolarHBondContact O-CA 3.35Å; F166-L170 VanDerWaalsContact O-CB 3.28Å; F166-L170 WeakPolarHBondContact O-CB 3.45Å; F166-L170 PolarHBondContact O-N 2.83Å; L170-V174 VanDerWaalsContact O-CB 3.24Å; L170-V174 WeakPolarHBondContact O-CB 3.36Å; L170-V174 WeakPolarHBondContact O-CG2 3.37Å; L170-V174 PolarHBondContact O-N 2.95Å
171	W	94.1	Very high	81.2	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.015	37%	0.365	C	S	.	.	I	π-helix	trans	-81	-45.7	-168.1	-49.9	138.1	0	0	0	113.7	V52 E55 L56 V120 F166 E167 V174 L175	V52-W171 HydrophobicContact CG1-CH2 4.02Å; E55-W171 HydrophobicContact CB-CZ2 3.89Å; L56-W171 HydrophobicContact CD1-CH2 4.49Å; L56-W171 HydrophobicContact CD2-CH2 3.82Å; L56-W171 HydrophobicContact CD2-CZ3 3.76Å; L56-W171 HydrophobicContact CG-CH2 3.89Å; L56-W171 HydrophobicContact CG-CZ3 4.35Å; V120-W171 HydrophobicContact CG1-CZ3 4.18Å; V120-W171 HydrophobicContact CG2-CH2 4.32Å; V120-W171 HydrophobicContact CG2-CZ3 4.04Å; F166-W171 HydrophobicContact CD2-CZ2 4.33Å; F166-W171 PolarHBondContact O-N 3.02Å; E167-W171 VanDerWaalsContact OE2-CD1 3.32Å; W171-V174 PolarHBondContact O-N 3.38Å; W171-L175 HydrophobicContact CE3-CD1 4.49Å; W171-L175 CarbonylContact O-C 3.5Å; W171-L175 VanDerWaalsContact O-C 3.28Å; W171-L175 VanDerWaalsContact O-CA 3.3Å; W171-L175 WeakPolarHBondContact O-CA 3.31Å; W171-L175 WeakPolarHBondContact O-CB 3.38Å; W171-L175 PolarHBondContact O-N 3.3Å
172	K	92.3	Very high	78.4	Confident	98 Å²	98	69.7 Å²	69.7	43%	0.426	38%	0.38	S	S	.	.	H	α-helix	trans	-60.1	-42.5	176	-73.4	179.2	-168.8	-179.3	0	113.2	E167 E168 P176	E167-K172 WeakPolarHBondContact O-CB 3.37Å; E167-K172 VanDerWaalsContact O-CG 3.28Å; E167-K172 WeakPolarHBondContact O-CG 3.45Å; E167-K172 PolarHBondContact O-N 3.34Å; E168-K172 WeakPolarHBondContact OE1-CE 3.47Å; E168-K172 IonicContact OE1-NZ 2.9Å; E168-K172 PolarHBondContact OE1-NZ 2.88Å; E168-K172 WeakPolarHBondContact OE2-CD 3.31Å; E168-K172 WeakPolarHBondContact OE2-CE 3.15Å; E168-K172 IonicContact OE2-NZ 2.58Å; E168-K172 PolarHBondContact OE2-NZ 2.9Å; K172-P176 WeakPolarHBondContact O-CA 3.4Å
173	P	93.5	Very high	75.7	Confident	54 Å²	54	75.2 Å²	75.2	35%	0.351	42%	0.416	S	S	.	.	H	α-helix	trans	-70	-43.5	178	-23.5	37.1	0	0	0	113.3	K127 E168	K127-P173 WeakPolarHBondContact CD-O 3.49Å; E168-P173 WeakPolarHBondContact O-CD 3.37Å
174	V	92.9	Very high	73	Confident	2 Å²	2	80.1 Å²	80.1	1%	0.012	45%	0.447	C	S	.	.	H	α-helix	trans	-82.9	-40.9	-173.5	-179.4	0	0	0	0	112.2	L105 V120 D122 K127 L170 W171 P176	L105-V174 HydrophobicContact CD2-CG1 3.92Å; V120-V174 HydrophobicContact CB-CG2 4.13Å; V120-V174 HydrophobicContact CG1-CB 4.49Å; V120-V174 HydrophobicContact CG1-CG1 4.02Å; V120-V174 HydrophobicContact CG1-CG2 4.17Å; V120-V174 WeakPolarHBondContact O-CG2 3.5Å; D122-V174 HydrophobicContact CB-CG1 3.68Å; K127-V174 WeakPolarHBondContact CD-O 3.32Å; L170-V174 VanDerWaalsContact O-CB 3.24Å; L170-V174 WeakPolarHBondContact O-CB 3.36Å; L170-V174 WeakPolarHBondContact O-CG2 3.37Å; L170-V174 PolarHBondContact O-N 2.95Å; W171-V174 PolarHBondContact O-N 3.38Å; V174-P176 WeakPolarHBondContact O-CD 3.35Å
175	L	88.2	Confident	70.7	Confident	39 Å²	39	86.1 Å²	86.1	20%	0.204	47%	0.473	C	S	.	.	S	Bend	trans	-123	58.3	-174.4	-58.9	176.4	0	0	0	110.7	L89 L105 W171 S177	L89-L175 HydrophobicContact CD2-CD1 3.74Å; L89-L175 HydrophobicContact CD2-CD2 3.65Å; L89-L175 HydrophobicContact CD2-CG 4.35Å; L105-L175 HydrophobicContact CD1-CD1 4.35Å; L105-L175 HydrophobicContact CD2-CD2 4.13Å; W171-L175 HydrophobicContact CE3-CD1 4.49Å; W171-L175 CarbonylContact O-C 3.5Å; W171-L175 VanDerWaalsContact O-C 3.28Å; W171-L175 VanDerWaalsContact O-CA 3.3Å; W171-L175 WeakPolarHBondContact O-CA 3.31Å; W171-L175 WeakPolarHBondContact O-CB 3.38Å; W171-L175 PolarHBondContact O-N 3.3Å; L175-S177 PolarHBondContact O-N 2.85Å
176	P	78	Confident	68	Low	60 Å²	60	90.7 Å²	90.7	39%	0.39	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-61	132.9	177.9	25.8	-31.9	0	0	0	108.4	K127 K172 V174	K127-P176 HydrophobicContact CD-CG 4.15Å; K172-P176 WeakPolarHBondContact O-CA 3.4Å; V174-P176 WeakPolarHBondContact O-CD 3.35Å
177	S	67.3	Low	65.5	Low	108 Å²	108	97.8 Å²	97.8	76%	0.755	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-50.1	133.5	170.8	-71.1	0	0	0	0	108.2	L175 A179	L175-S177 PolarHBondContact O-N 2.85Å; S177-A179 PolarHBondContact O-N 3.45Å; S177-A179 VanDerWaalsContact O-N 3.12Å
178	P	57.1	Low	63.2	Low	116 Å²	116	106 Å²	106	75%	0.753	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-52.4	129.6	176.4	21.9	-31.4	0	0	0	107.1	F180	P178-F180 PolarHBondContact O-N 2.81Å
179	A	37.1	Very low	60.7	Low	93 Å²	93	107.8 Å²	107.8	77%	0.769	58%	0.579	S	S	*	*			trans	-51.6	113.9	177.3	0	0	0	0	0	106.4	S177 C181	S177-A179 PolarHBondContact O-N 3.45Å; S177-A179 VanDerWaalsContact O-N 3.12Å; A179-C181 PolarHBondContact O-N 3.3Å
180	F	35.5	Very low	58.4	Low	198 Å²	198	113.1 Å²	113.1	87%	0.868	60%	0.601	S	S	*	*			trans	-52.7	114.2	164.8	-102	-92.3	0	0	0	104.5	P178 R182	P178-F180 PolarHBondContact O-N 2.81Å; F180-R182 PolarHBondContact O-N 3.46Å
181	C	28.2	Very low	56.1	Low	118 Å²	118	118.5 Å²	118.5	80%	0.797	64%	0.636	S	S	*	*			trans	-53.5	100.2	162.8	-73.5	0	0	0	0	104.6	A179 P183	A179-C181 PolarHBondContact O-N 3.3Å; C181-P183 WeakPolarHBondContact O-CD 3.25Å
182	R	31.8	Very low	53.9	Low	217 Å²	217	129.6 Å²	129.6	82%	0.819	68%	0.678	S	S	*	*			trans	-51.9	126.9	162.1	-75.9	-177.5	178	169.1	-0.2	103.8	F180 T184	F180-R182 PolarHBondContact O-N 3.46Å; R182-T184 PolarHBondContact O-N 3.35Å
183	P	36.5	Very low	51.9	Low	117 Å²	117	130.8 Å²	130.8	76%	0.76	70%	0.696	S	S	*	*			trans	-56.8	106.3	163.1	23.4	-28.1	0	0	0	104.5	C181 E185	C181-P183 WeakPolarHBondContact O-CD 3.25Å; P183-E185 VanDerWaalsContact C-N 3.31Å; P183-E185 PolarHBondContact O-N 3.01Å
184	T	38.3	Very low	49.7	Very low	120 Å²	120	135.6 Å²	135.6	74%	0.736	72%	0.718	S	S	*	*			trans	-59.6	106.9	166.9	33.9	0	0	0	0	104.8	R182 T186	R182-T184 PolarHBondContact O-N 3.35Å; T184-T186 PolarHBondContact O-N 3.28Å
185	E	43.7	Very low	47.3	Very low	195 Å²	195	142.9 Å²	142.9	91%	0.911	76%	0.757	S	S	*	*			trans	-60.4	69.4	166	-66.1	-179.4	137.6	0	0	108.7	P183	P183-E185 VanDerWaalsContact C-N 3.31Å; P183-E185 PolarHBondContact O-N 3.01Å
186	T	38.6	Very low	45.2	Very low	118 Å²	118	147.3 Å²	147.3	72%	0.724	78%	0.781	S	S	*	*			trans	-150.7	54.6	178.2	-23.4	0	0	0	0	110.5	T184	T184-T186 PolarHBondContact O-N 3.28Å
187	D	42.9	Very low	43.6	Very low	149 Å²	149	152.9 Å²	152.9	80%	0.797	80%	0.799	S	S	*	*			trans	-145.7	57.8	145.4	-143.9	0.3	0	0	0	110.3	N189	D187-N189 VanDerWaalsContact C-N 3.34Å
188	R	44.6	Very low	42.4	Very low	246 Å²	246	155.9 Å²	155.9	93%	0.928	80%	0.801	S	S	*	*			trans	-100.9	59.7	157.2	-84.6	-174	169.6	165.5	-0.9	108.2
189	N	42.2	Very low	41.7	Very low	140 Å²	140	158.1 Å²	158.1	75%	0.749	81%	0.807	S	S	*	*			trans	-127.6	73.1	160.4	-97.2	-18.3	0	0	0	107.3	D187 P191	D187-N189 VanDerWaalsContact C-N 3.34Å; N189-P191 VanDerWaalsContact O-CD 3.31Å; N189-P191 WeakPolarHBondContact O-CD 3.24Å
190	E	48.3	Very low	42.1	Very low	184 Å²	184	163.6 Å²	163.6	86%	0.86	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-58.8	121.2	157.5	-95.6	-144.8	142.1	0	0	107.9	R192	E190-R192 PolarHBondContact O-N 2.97Å
191	P	47.1	Very low	42.7	Very low	112 Å²	112	160.2 Å²	160.2	73%	0.727	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-71.2	118.4	169.1	10	3	0	0	0	107.3	N189 P193	N189-P191 VanDerWaalsContact O-CD 3.31Å; N189-P191 WeakPolarHBondContact O-CD 3.24Å; P191-P193 WeakPolarHBondContact O-CD 3.18Å; P191-P193 VanDerWaalsContact O-N 3.14Å
192	R	47.4	Very low	43.4	Very low	237 Å²	237	166 Å²	166	89%	0.894	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-53	117.3	167	-64.8	-179.9	-179.4	-176.4	-0.4	108.3	E190 N194	E190-R192 PolarHBondContact O-N 2.97Å; R192-N194 PolarHBondContact O-N 3.16Å
193	P	50	Low	44.1	Very low	124 Å²	124	166.3 Å²	166.3	81%	0.805	82%	0.817	S	S	*	*			trans	-75.9	111.1	169.5	-4.7	22.7	0	0	0	106.6	P191 D195	P191-P193 WeakPolarHBondContact O-CD 3.18Å; P191-P193 VanDerWaalsContact O-N 3.14Å; P193-D195 PolarHBondContact O-N 3.3Å
194	N	47.9	Very low	44.2	Very low	155 Å²	155	166.6 Å²	166.6	83%	0.829	82%	0.819	S	S	*	*			trans	-53.6	132.1	167	-86.8	-33.8	0	0	0	109.3	R192 D196	R192-N194 PolarHBondContact O-N 3.16Å; N194-D196 PolarHBondContact O-N 3.47Å
195	D	43.2	Very low	44.3	Very low	155 Å²	155	169.5 Å²	169.5	83%	0.829	82%	0.822	S	S	*	*	S	Bend	trans	-48.6	114.6	158.9	-88.1	-40.3	0	0	0	109.1	P193	P193-D195 PolarHBondContact O-N 3.3Å
196	D	42.7	Very low	44	Very low	132 Å²	132	167 Å²	167	71%	0.706	82%	0.819	S	S	*	*				169.8	144.5	128.8	-91.2	-32.2	0	0	0	110.9	N194	N194-D196 PolarHBondContact O-N 3.47Å
197	F	44.8	Very low	44.1	Very low	176 Å²	176	166.6 Å²	166.6	77%	0.772	81%	0.813	S	S	*	*			trans	84.1	89.8	169.2	-53.5	-72.5	0	0	0	118.4
198	H	42	Very low	43.7	Very low	172 Å²	172	166.5 Å²	166.5	80%	0.796	81%	0.812	S	S	*	*			trans	45.8	87.4	131.6	-68.9	-53.1	0	0	0	118.2
199	N	42.2	Very low	43.3	Very low	162 Å²	162	164 Å²	164	87%	0.866	81%	0.809	S	S	*	*			trans	-163.9	112.3	136.8	-98.7	-27.6	0	0	0	110.1	P201	N199-P201 WeakPolarHBondContact O-CD 3.14Å
200	K	46.9	Very low	43	Very low	209 Å²	209	164.9 Å²	164.9	91%	0.909	81%	0.812	S	S	*	*			trans	-95.4	110.6	171.3	-77	-177.9	176.1	178.7	0	109.3
201	P	48	Very low	42.1	Very low	126 Å²	126	167.5 Å²	167.5	82%	0.818	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-79.2	124.2	157.4	-3.3	22.2	0	0	0	108.2	N199	N199-P201 WeakPolarHBondContact O-CD 3.14Å
202	R	41.9	Very low	41.5	Very low	241 Å²	241	166.6 Å²	166.6	91%	0.909	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-61.6	133.7	-177.3	-68.4	173.8	173.2	-178.9	-3.5	110.9
203	R	46.5	Very low	40.7	Very low	223 Å²	223	159.4 Å²	159.4	84%	0.842	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-59.6	139	164.7	-63.8	-177.2	178.3	-163.2	-1.7	109.2	F205	R203-F205 PolarHBondContact O-N 3.4Å; R203-F205 VanDerWaalsContact O-N 3.16Å
204	P	40.1	Very low	40.1	Very low	122 Å²	122	158 Å²	158	79%	0.792	81%	0.814	S	S	*	*			trans	-66.8	114.7	165.3	-7.2	23.2	0	0	0	107.4	V206	P204-V206 PolarHBondContact O-N 3.22Å
205	F	39.2	Very low	39.6	Very low	181 Å²	181	157.6 Å²	157.6	79%	0.794	82%	0.817	S	S	*	*			trans	-56.9	114.1	169.9	-98.6	-103.1	0	0	0	109.1	R203 D207	R203-F205 PolarHBondContact O-N 3.4Å; R203-F205 VanDerWaalsContact O-N 3.16Å; F205-D207 HydrophobicContact CD1-CB 4.29Å
206	V	38.7	Very low	39.5	Very low	142 Å²	142	156.8 Å²	156.8	86%	0.861	82%	0.818	S	S	*	*			trans	-105.6	87.4	153.4	-179.2	0	0	0	0	104.2	P204	P204-V206 PolarHBondContact O-N 3.22Å
207	D	39.8	Very low	40	Very low	110 Å²	110	153 Å²	153	59%	0.588	81%	0.81	S	S	*	*			trans	-147.6	113.2	165.2	-123	-7.4	0	0	0	107.4	F205	F205-D207 HydrophobicContact CD1-CB 4.29Å
208	D	33.8	Very low	40.6	Very low	147 Å²	147	150.4 Å²	150.4	79%	0.786	81%	0.811	S	S	*	*			trans	17	96.1	157.4	-67.3	-23.4	0	0	0	118.5
209	F	37.7	Very low	41.7	Very low	194 Å²	194	147.5 Å²	147.5	85%	0.851	81%	0.807	S	S	*	*			trans	-111.9	90	152.6	-71.1	-76.4	0	0	0	110	R211	F209-R211 PolarHBondContact O-N 2.99Å
210	I	34.8	Very low	42.8	Very low	159 Å²	159	145.1 Å²	145.1	82%	0.815	80%	0.801	S	S	*	*			trans	-59.9	126	150.8	-65.9	-172.7	0	0	0	107.3
211	R	29.8	Very low	43.6	Very low	238 Å²	238	139.3 Å²	139.3	90%	0.898	78%	0.784	S	S	*	*			trans	115.1	128	149.7	-151.1	169.4	-164.6	162.9	2.9	115.9	F209	F209-R211 PolarHBondContact O-N 2.99Å
212	A	35.2	Very low	44.4	Very low	94 Å²	94	139.1 Å²	139.1	78%	0.777	78%	0.776	S	S	*	*			trans	91.9	80.5	161	0	0	0	0	0	117.3
213	G	29.8	Very low	45.1	Very low	85 Å²	85	137.2 Å²	137.2	88%	0.876	77%	0.771	S	S	*	*				50.4	92.1	124.3	0	0	0	0	0	118.2
214	A	36.3	Very low	45.9	Very low	95 Å²	95	128.6 Å²	128.6	79%	0.785	75%	0.751	S	S	*	*			trans	-144.2	130.4	152.8	0	0	0	0	0	109.3	V216	A214-V216 PolarHBondContact O-N 3.33Å
215	T	37.5	Very low	47.1	Very low	146 Å²	146	131.3 Å²	131.3	90%	0.896	75%	0.745	S	S	*	*			trans	-45.4	125.1	-173.3	-50.4	0	0	0	0	113.8	G217	T215-G217 PolarHBondContact O-N 3.13Å; T215-G217 VanDerWaalsContact O-N 3.14Å
216	V	42.1	Very low	48.2	Very low	139 Å²	139	127.2 Å²	127.2	84%	0.842	74%	0.739	S	S	*	*			trans	-66.7	103	178.3	177.4	0	0	0	0	109.7	A214	A214-V216 PolarHBondContact O-N 3.33Å
217	G	52	Low	49.4	Very low	52 Å²	52	127.1 Å²	127.1	54%	0.536	73%	0.734	S	S	.	*	P	Polyproline II helix	trans	-77.1	149.7	160.5	0	0	0	0	0	110.2	T215	T215-G217 PolarHBondContact O-N 3.13Å; T215-G217 VanDerWaalsContact O-N 3.14Å
218	P	58.5	Low	50.8	Low	121 Å²	121	129 Å²	129	79%	0.786	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-63.2	145.4	176.1	26.9	-32.1	0	0	0	110.2
219	P	64.8	Low	52.1	Low	112 Å²	112	126 Å²	126	73%	0.727	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-58.8	149.9	175.4	25.8	-33.2	0	0	0	110.4
220	P	65	Low	53.2	Low	112 Å²	112	121.2 Å²	121.2	73%	0.727	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-58.7	148.5	174.7	25.9	-33.2	0	0	0	110.1
221	P	63.9	Low	54.6	Low	86 Å²	86	119.2 Å²	119.2	56%	0.558	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-67.4	138.2	-177.6	-12.1	27.1	0	0	0	110.7	Y223	P221-Y223 HydrophobicContact CB-CD2 3.77Å; P221-Y223 HydrophobicContact CB-CE2 3.41Å; P221-Y223 VanDerWaalsContact CB-CE2 3.41Å; P221-Y223 HydrophobicContact CG-CD2 4.19Å; P221-Y223 HydrophobicContact CG-CE2 3.49Å; P221-Y223 VanDerWaalsContact CG-CE2 3.49Å; P221-Y223 WeakPolarHBondContact O-CD2 3.45Å; P221-Y223 PolarHBondContact O-N 3.44Å
222	D	65.2	Low	55.9	Low	122 Å²	122	110.9 Å²	110.9	65%	0.652	69%	0.688	S	S	*	*			trans	-68.9	66.6	175.8	-93.1	-1.1	0	0	0	111	R225	D222-R225 IonicContact OD2-NH1 3.36Å; D222-R225 PolarHBondContact OD2-NH1 3.35Å
223	Y	57	Low	56.9	Low	202 Å²	202	110.9 Å²	110.9	79%	0.792	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	129.1	171.7	-67.8	-71.4	0	0	0	110.1	P221	P221-Y223 HydrophobicContact CB-CD2 3.77Å; P221-Y223 HydrophobicContact CB-CE2 3.41Å; P221-Y223 VanDerWaalsContact CB-CE2 3.41Å; P221-Y223 HydrophobicContact CG-CD2 4.19Å; P221-Y223 HydrophobicContact CG-CE2 3.49Å; P221-Y223 VanDerWaalsContact CG-CE2 3.49Å; P221-Y223 WeakPolarHBondContact O-CD2 3.45Å; P221-Y223 PolarHBondContact O-N 3.44Å
224	G	62.5	Low	58.3	Low	41 Å²	41	113 Å²	113	42%	0.423	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	100.3	-11.4	173.5	0	0	0	0	0	115.7	S226 D227	G224-S226 VanDerWaalsContact C-N 3.28Å; G224-S226 PolarHBondContact O-N 2.92Å; G224-D227 WeakPolarHBondContact O-CB 3.43Å; G224-D227 PolarHBondContact O-N 3.27Å
225	R	65.4	Low	58.8	Low	179 Å²	179	112.1 Å²	112.1	68%	0.675	67%	0.672	S	S	*	*	H	α-helix	trans	-67.2	-30.9	179.6	-149.8	176.1	177.6	-170.5	-4.3	113.1	D222 D227 D229	D222-R225 IonicContact OD2-NH1 3.36Å; D222-R225 PolarHBondContact OD2-NH1 3.35Å; R225-D227 VanDerWaalsContact C-N 3.29Å; R225-D227 PolarHBondContact O-N 2.98Å; R225-D229 PolarHBondContact O-N 3.29Å
226	S	62.9	Low	59.4	Low	96 Å²	96	107.4 Å²	107.4	67%	0.671	65%	0.653	S	S	*	*	H	α-helix	trans	-70.7	-20.1	175.5	49.9	0	0	0	0	114.1	G224	G224-S226 VanDerWaalsContact C-N 3.28Å; G224-S226 PolarHBondContact O-N 2.92Å
227	D	62.9	Low	59.5	Low	139 Å²	139	107.4 Å²	107.4	74%	0.743	66%	0.656	S	S	*	*	H	α-helix	trans	-81.1	-32.6	177.7	-163.4	41.1	0	0	0	111.4	G224 R225	G224-D227 WeakPolarHBondContact O-CB 3.43Å; G224-D227 PolarHBondContact O-N 3.27Å; R225-D227 VanDerWaalsContact C-N 3.29Å; R225-D227 PolarHBondContact O-N 2.98Å
228	L	69.5	Low	59.5	Low	151 Å²	151	110.2 Å²	110.2	79%	0.791	67%	0.667	S	S	*	*	H	α-helix	trans	-84.9	-14.1	179.9	-61	179.1	0	0	0	113.7
229	D	62.1	Low	58.9	Low	83 Å²	83	116.7 Å²	116.7	44%	0.444	68%	0.676	S	S	.	*			trans	-142	81.3	-179.6	-164.6	-8.7	0	0	0	112.1	R225 L231 A232	R225-D229 PolarHBondContact O-N 3.29Å; D229-L231 PolarHBondContact O-N 2.88Å; D229-L231 VanDerWaalsContact O-N 3.16Å; D229-L231 PolarHBondContact OD1-N 2.88Å; D229-A232 HydrophobicContact CB-CB 4.09Å; D229-A232 PolarHBondContact O-N 2.61Å; D229-A232 PolarHBondContact OD1-N 3.38Å; D229-A232 VanDerWaalsContact OD1-N 3.14Å
230	P	60.2	Low	57.9	Low	93 Å²	93	115.4 Å²	115.4	60%	0.604	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.7	-9.1	179.1	28.3	-35.1	0	0	0	113.3
231	L	64.6	Low	57	Low	117 Å²	117	113.1 Å²	113.1	61%	0.613	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.7	-6.4	-178.7	-66.7	172.1	0	0	0	113.1	D229 S233 I234	D229-L231 PolarHBondContact O-N 2.88Å; D229-L231 VanDerWaalsContact O-N 3.16Å; D229-L231 PolarHBondContact OD1-N 2.88Å; L231-S233 PolarHBondContact O-N 3.42Å; L231-I234 HydrophobicContact CD2-CD1 3.79Å; L231-I234 PolarHBondContact O-N 3.05Å
232	A	56.5	Low	56.4	Low	64 Å²	64	112.3 Å²	112.3	53%	0.529	69%	0.687	S	S	.	*	G	3₁₀ helix	trans	-55.2	-24.5	177.7	0	0	0	0	0	113.6	D229 I234	D229-A232 HydrophobicContact CB-CB 4.09Å; D229-A232 PolarHBondContact O-N 2.61Å; D229-A232 PolarHBondContact OD1-N 3.38Å; D229-A232 VanDerWaalsContact OD1-N 3.14Å; A232-I234 VanDerWaalsContact C-N 3.35Å
233	S	55.3	Low	55.9	Low	94 Å²	94	113.9 Å²	113.9	66%	0.657	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-79.9	-8.3	178.1	-174.9	0	0	0	0	114.6	L231	L231-S233 PolarHBondContact O-N 3.42Å
234	I	59.6	Low	55.8	Low	128 Å²	128	110.6 Å²	110.6	66%	0.656	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-94.7	-9.6	-173.4	-66.3	-178.3	0	0	0	112.7	L231 A232	L231-I234 HydrophobicContact CD2-CD1 3.79Å; L231-I234 PolarHBondContact O-N 3.05Å; A232-I234 VanDerWaalsContact C-N 3.35Å
235	G	46.7	Very low	55.5	Low	77 Å²	77	115.1 Å²	115.1	79%	0.794	70%	0.701	S	S	*	*	S	Bend	trans	-137	4.3	-164.9	0	0	0	0	0	119.8
236	G	49.7	Very low	55	Low	48 Å²	48	109.8 Å²	109.8	50%	0.495	69%	0.686	S	S	.	*	S	Bend	trans	-155.1	155.4	-174	0	0	0	0	0	116.6	S238	G236-S238 VanDerWaalsContact C-N 3.26Å; G236-S238 PolarHBondContact O-N 2.9Å
237	P	45.4	Very low	54.6	Low	138 Å²	138	111.4 Å²	111.4	90%	0.896	69%	0.694	S	S	*	*			trans	-77.6	78.7	178.1	33.7	-32	0	0	0	108.6
238	S	51.1	Low	54.4	Low	111 Å²	111	115.7 Å²	115.7	78%	0.776	70%	0.7	S	S	*	*			trans	-137.1	107.4	170.6	-76.4	0	0	0	0	109.8	G236 G240	G236-S238 VanDerWaalsContact C-N 3.26Å; G236-S238 PolarHBondContact O-N 2.9Å; S238-G240 PolarHBondContact O-N 2.87Å
239	R	47	Very low	53.4	Low	258 Å²	258	117.7 Å²	117.7	97%	0.974	70%	0.697	S	S	*	*			trans	-37.8	122.2	165.6	-98.6	167.7	160.2	-136.3	-1.1	112.2
240	G	44.3	Very low	52.7	Low	84 Å²	84	121.4 Å²	121.4	87%	0.866	72%	0.715	S	S	*	*			trans	91	110.2	146.1	0	0	0	0	0	116	S238	S238-G240 PolarHBondContact O-N 2.87Å
241	G	44.5	Very low	52.3	Low	64 Å²	64	124.2 Å²	124.2	66%	0.66	72%	0.723	S	S	*	*			trans	153.6	57.8	168.5	0	0	0	0	0	114
242	G	51.4	Low	50.8	Low	69 Å²	69	124.6 Å²	124.6	71%	0.711	73%	0.733	S	S	*	*			trans	-73.6	155.9	166.9	0	0	0	0	0	110.3
243	M	55.3	Low	50	Low	155 Å²	155	125 Å²	125	76%	0.764	74%	0.743	S	S	*	*			cis	-153.6	121.8	47.2	-58.5	-164.3	-62.5	0	0	111.7	L245	M243-L245 HydrophobicContact CB-CG 4.29Å; M243-L245 HydrophobicContact CE-CD1 4.33Å; M243-L245 HydrophobicContact CE-CD2 4.04Å; M243-L245 HydrophobicContact CE-CG 4.32Å; M243-L245 PolarHBondContact O-N 2.95Å; M243-L245 HydrophobicContact SD-CD2 4.35Å
244	I	54	Low	49.3	Very low	133 Å²	133	125.8 Å²	125.8	68%	0.682	75%	0.749	S	S	*	*			trans	-85.6	99.2	156.9	-63.5	169	0	0	0	105.8	D246	I244-D246 PolarHBondContact O-N 2.81Å; I244-D246 VanDerWaalsContact O-N 3.09Å
245	L	57.7	Low	48	Very low	137 Å²	137	131.4 Å²	131.4	72%	0.717	76%	0.762	S	S	*	*			trans	-72.6	95.4	176.3	-69.9	164.7	0	0	0	108.9	M243 P247	M243-L245 HydrophobicContact CB-CG 4.29Å; M243-L245 HydrophobicContact CE-CD1 4.33Å; M243-L245 HydrophobicContact CE-CD2 4.04Å; M243-L245 HydrophobicContact CE-CG 4.32Å; M243-L245 PolarHBondContact O-N 2.95Å; M243-L245 HydrophobicContact SD-CD2 4.35Å; L245-P247 VanDerWaalsContact O-CD 3.29Å; L245-P247 WeakPolarHBondContact O-CD 3.3Å
246	D	54	Low	47.7	Very low	66 Å²	66	133.1 Å²	133.1	35%	0.353	76%	0.757	S	S	.	*			trans	-72.3	113.7	168.4	-176.8	-14.4	0	0	0	108.8	I244 R248 R249	I244-D246 PolarHBondContact O-N 2.81Å; I244-D246 VanDerWaalsContact O-N 3.09Å; D246-R248 PolarHBondContact O-N 3.29Å; D246-R248 PolarHBondContact OD1-N 2.94Å; D246-R249 HydrophobicContact CB-CB 4.04Å; D246-R249 HydrophobicContact CB-CG 3.92Å; D246-R249 PolarHBondContact O-N 2.96Å; D246-R249 VanDerWaalsContact O-N 3.09Å; D246-R249 VanDerWaalsContact OD2-CD 3.23Å; D246-R249 WeakPolarHBondContact OD2-CD 3.39Å; D246-R249 VanDerWaalsContact OD2-CG 3.28Å; D246-R249 WeakPolarHBondContact OD2-CG 3.15Å; D246-R249 IonicContact OD2-NE 2.93Å; D246-R249 PolarHBondContact OD2-NE 2.77Å
247	P	54.1	Low	47	Very low	131 Å²	131	138 Å²	138	85%	0.851	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-6.9	-177.4	-18.6	31.2	0	0	0	114	L245	L245-P247 VanDerWaalsContact O-CD 3.29Å; L245-P247 WeakPolarHBondContact O-CD 3.3Å
248	R	58.9	Low	46.8	Very low	229 Å²	229	138.3 Å²	138.3	86%	0.864	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	1.7	-178.2	-51.9	-175	85.4	127.1	0.2	113	D246	D246-R248 PolarHBondContact O-N 3.29Å; D246-R248 PolarHBondContact OD1-N 2.94Å
249	R	49.4	Very low	46	Very low	192 Å²	192	139.5 Å²	139.5	73%	0.725	76%	0.764	S	S	*	*			trans	-100.9	88.2	175	-73.6	178.7	-171.5	-108.6	0.8	110.9	D246 I251	D246-R249 HydrophobicContact CB-CB 4.04Å; D246-R249 HydrophobicContact CB-CG 3.92Å; D246-R249 PolarHBondContact O-N 2.96Å; D246-R249 VanDerWaalsContact O-N 3.09Å; D246-R249 VanDerWaalsContact OD2-CD 3.23Å; D246-R249 WeakPolarHBondContact OD2-CD 3.39Å; D246-R249 VanDerWaalsContact OD2-CG 3.28Å; D246-R249 WeakPolarHBondContact OD2-CG 3.15Å; D246-R249 IonicContact OD2-NE 2.93Å; D246-R249 PolarHBondContact OD2-NE 2.77Å; R249-I251 PolarHBondContact O-N 2.89Å; R249-I251 VanDerWaalsContact O-N 3.15Å
250	I	46	Very low	45.6	Very low	162 Å²	162	135.9 Å²	135.9	83%	0.831	76%	0.755	S	S	*	*			trans	-63.9	107.9	156.6	-61.8	169.7	0	0	0	106.1	P252	I250-P252 WeakPolarHBondContact O-CD 3.37Å
251	I	52.1	Low	45.5	Very low	152 Å²	152	142.5 Å²	142.5	78%	0.779	76%	0.76	S	S	*	*			trans	-62.6	114.5	175.6	-60.9	173	0	0	0	107.9	R249 G253	R249-I251 PolarHBondContact O-N 2.89Å; R249-I251 VanDerWaalsContact O-N 3.15Å; I251-G253 PolarHBondContact O-N 3.38Å
252	P	33.8	Very low	45.5	Very low	124 Å²	124	146.9 Å²	146.9	81%	0.805	77%	0.768	S	S	*	*			trans	-88.6	103.8	175.7	30.4	-19.7	0	0	0	107.6	I250	I250-P252 WeakPolarHBondContact O-CD 3.37Å
253	G	40	Very low	44.8	Very low	72 Å²	72	146 Å²	146	74%	0.742	76%	0.759	S	S	*	*			trans	-179.7	-8.8	179.4	0	0	0	0	0	120.7	I251	I251-G253 PolarHBondContact O-N 3.38Å
254	S	39.5	Very low	44.5	Very low	112 Å²	112	141.1 Å²	141.1	78%	0.783	75%	0.748	S	S	*	*			trans	-113.6	77.3	-178.6	-162.2	0	0	0	0	111.8
255	R	33.2	Very low	44.5	Very low	245 Å²	245	141.1 Å²	141.1	93%	0.925	76%	0.757	S	S	*	*			trans	-87.6	96.7	159.3	-70.7	179.1	100.6	98.2	-2.3	107.5
256	T	40.7	Very low	44.4	Very low	113 Å²	113	139.7 Å²	139.7	69%	0.693	75%	0.75	S	S	*	*			trans	-155.7	96.7	154.4	43.9	0	0	0	0	107.4	N258	T256-N258 PolarHBondContact O-N 3.27Å
257	D	33.9	Very low	44.7	Very low	150 Å²	150	141.3 Å²	141.3	80%	0.802	76%	0.762	S	S	*	*			trans	16.2	100.4	137.8	-50.7	-32.1	0	0	0	115.2
258	N	40.9	Very low	45	Very low	146 Å²	146	139.1 Å²	139.1	78%	0.781	74%	0.743	S	S	*	*			trans	165.8	104.3	139.3	-82.7	-24.2	0	0	0	107.9	T256	T256-N258 PolarHBondContact O-N 3.27Å
259	D	35.8	Very low	45.5	Very low	136 Å²	136	132.5 Å²	132.5	73%	0.727	73%	0.73	S	S	*	*			trans	28.1	142.7	139.4	-55.7	-23.5	0	0	0	119.9
260	F	39.2	Very low	46.2	Very low	181 Å²	181	130 Å²	130	79%	0.794	74%	0.738	S	S	*	*			trans	99	48.7	173.4	-49.9	-72	0	0	0	117.6	L262	F260-L262 VanDerWaalsContact C-N 3.28Å; F260-L262 PolarHBondContact O-N 3.36Å
261	F	40.3	Very low	47.1	Very low	223 Å²	223	125.9 Å²	125.9	98%	0.978	74%	0.736	S	S	*	*			trans	-84.5	77.1	144.9	-79.7	-81.1	0	0	0	109.3
262	L	44.5	Very low	48	Very low	157 Å²	157	120.9 Å²	120.9	82%	0.822	72%	0.717	S	S	*	*			trans	-131.9	78.5	173.5	-101.1	154	0	0	0	107.9	F260	F260-L262 VanDerWaalsContact C-N 3.28Å; F260-L262 PolarHBondContact O-N 3.36Å
263	G	38.6	Very low	49.8	Very low	50 Å²	50	117.3 Å²	117.3	52%	0.515	69%	0.693	S	S	.	*			trans	169.5	121.3	175.3	0	0	0	0	0	110.1
264	G	47.1	Very low	51.4	Low	53 Å²	53	118 Å²	118	55%	0.546	68%	0.684	S	S	.	*			trans	-65.3	-159.9	-178.8	0	0	0	0	0	113.4	D266 V267	G264-D266 PolarHBondContact O-N 3.26Å; G264-V267 PolarHBondContact O-N 2.69Å
265	P	54.6	Low	53	Low	133 Å²	133	119.4 Å²	119.4	86%	0.864	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	-2.6	179.3	25.8	-34.6	0	0	0	114.8
266	D	55.5	Low	54.6	Low	107 Å²	107	111.4 Å²	111.4	57%	0.572	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	17.9	-178.4	-69.2	-25.9	0	0	0	114.4	G264 F282	G264-D266 PolarHBondContact O-N 3.26Å; D266-F282 VanDerWaalsContact CA-CZ 3.48Å; D266-F282 HydrophobicContact CB-CD1 4.02Å; D266-F282 HydrophobicContact CB-CE1 3.41Å; D266-F282 VanDerWaalsContact CB-CE1 3.41Å; D266-F282 HydrophobicContact CB-CZ 4.17Å; D266-F282 WeakPolarHBondContact O-CD1 3.21Å; D266-F282 WeakPolarHBondContact O-CE1 3.07Å; D266-F282 VanDerWaalsContact O-CG 3.25Å; D266-F282 WeakPolarHBondContact O-CG 3.16Å
267	V	59.9	Low	56.1	Low	100 Å²	100	108.1 Å²	108.1	61%	0.606	67%	0.669	S	S	*	*			trans	-129.8	103.1	174	-174.2	0	0	0	0	109.7	G264	G264-V267 PolarHBondContact O-N 2.69Å
268	L	61.6	Low	57.6	Low	84 Å²	84	111.3 Å²	111.3	44%	0.44	67%	0.67	S	S	.	*	P	Polyproline II helix	trans	-71.5	147	173.6	-70.7	169.7	0	0	0	111	A272 V273 F282	L268-A272 HydrophobicContact CB-CB 3.65Å; L268-A272 HydrophobicContact CD1-CB 4.23Å; L268-A272 HydrophobicContact CD2-CB 4.37Å; L268-A272 HydrophobicContact CG-CB 4.3Å; L268-V273 HydrophobicContact CD1-CG2 4.45Å; L268-F282 HydrophobicContact CB-CE2 4.48Å; L268-F282 HydrophobicContact CD1-CD2 4.1Å; L268-F282 HydrophobicContact CD1-CE2 3.78Å; L268-F282 HydrophobicContact CG-CD2 4.13Å; L268-F282 HydrophobicContact CG-CE2 3.68Å
269	P	68.5	Low	58.5	Low	91 Å²	91	113.3 Å²	113.3	59%	0.591	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-58.1	145.3	174.7	19.4	-27.3	0	0	0	111	G271 A272	P269-G271 PolarHBondContact O-N 3.37Å; P269-A272 HydrophobicContact CG-CB 4.13Å; P269-A272 WeakPolarHBondContact O-CB 3.33Å; P269-A272 PolarHBondContact O-N 3.45Å
270	P	63.7	Low	59.9	Low	138 Å²	138	110 Å²	110	90%	0.896	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.4	126.4	177.5	-26.6	33.9	0	0	0	111.8
271	G	66.2	Low	60.9	Low	76 Å²	76	105.8 Å²	105.8	78%	0.784	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	90.4	0.5	-176.7	0	0	0	0	0	115.5	P269 V273	P269-G271 PolarHBondContact O-N 3.37Å; G271-V273 PolarHBondContact O-N 3.23Å
272	A	71.5	Confident	61.9	Low	48 Å²	48	99 Å²	99	40%	0.397	62%	0.615	S	S	.	*			trans	-71	-14.6	172	0	0	0	0	0	113.9	L268 P269 P274	L268-A272 HydrophobicContact CB-CB 3.65Å; L268-A272 HydrophobicContact CD1-CB 4.23Å; L268-A272 HydrophobicContact CD2-CB 4.37Å; L268-A272 HydrophobicContact CG-CB 4.3Å; P269-A272 HydrophobicContact CG-CB 4.13Å; P269-A272 WeakPolarHBondContact O-CB 3.33Å; P269-A272 PolarHBondContact O-N 3.45Å; A272-P274 WeakPolarHBondContact O-CD 3.22Å
273	V	71.3	Confident	62.5	Low	48 Å²	48	92.9 Å²	92.9	29%	0.291	59%	0.59	S	S	.	*	S	Bend	trans	-95.4	114.6	172.8	-178	0	0	0	0	108.2	L268 G271 A277 D280	L268-V273 HydrophobicContact CD1-CG2 4.45Å; G271-V273 PolarHBondContact O-N 3.23Å; V273-A277 HydrophobicContact CG1-CB 3.63Å; V273-D280 HydrophobicContact CG1-CB 4.38Å
274	P	72.2	Confident	63.2	Low	87 Å²	87	96.8 Å²	96.8	57%	0.565	61%	0.606	S	S	*	*			trans	-58.3	142.3	177.5	-25.1	34.4	0	0	0	111.8	A272 G276 A277	A272-P274 WeakPolarHBondContact O-CD 3.22Å; P274-G276 PolarHBondContact O-N 3.27Å; P274-G276 VanDerWaalsContact O-N 3.12Å; P274-A277 WeakPolarHBondContact O-CB 3.41Å; P274-A277 PolarHBondContact O-N 3.34Å
275	P	73.4	Confident	63.4	Low	141 Å²	141	97.4 Å²	97.4	92%	0.916	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	120.6	171.7	-22.4	31.9	0	0	0	110.4
276	G	67.6	Low	62.9	Low	78 Å²	78	99.8 Å²	99.8	80%	0.804	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	92.4	6.1	-178	0	0	0	0	0	115.8	P274 R278	P274-G276 PolarHBondContact O-N 3.27Å; P274-G276 VanDerWaalsContact O-N 3.12Å; G276-R278 PolarHBondContact O-N 3.44Å
277	A	72	Confident	62.5	Low	43 Å²	43	97.2 Å²	97.2	36%	0.355	62%	0.615	S	S	.	*			trans	-61.9	122.1	169.2	0	0	0	0	0	110.4	V273 P274 F279	V273-A277 HydrophobicContact CG1-CB 3.63Å; P274-A277 WeakPolarHBondContact O-CB 3.41Å; P274-A277 PolarHBondContact O-N 3.34Å; A277-F279 VanDerWaalsContact C-N 3.32Å
278	R	66.2	Low	61.6	Low	217 Å²	217	98.5 Å²	98.5	82%	0.819	63%	0.626	S	S	*	*	S	Bend	trans	-76	-23.1	176.7	-67.3	-177.3	66.5	-161.7	1.3	113	G276	G276-R278 PolarHBondContact O-N 3.44Å
279	F	59.2	Low	60.5	Low	189 Å²	189	103 Å²	103	83%	0.829	65%	0.649	S	S	*	*			trans	-110.2	93.6	175.3	-86.2	-89.7	0	0	0	108.2	A277 P281	A277-F279 VanDerWaalsContact C-N 3.32Å; F279-P281 WeakPolarHBondContact O-CD 3.38Å
280	D	65.8	Low	59.3	Low	67 Å²	67	108.8 Å²	108.8	36%	0.358	66%	0.659	S	S	.	*			trans	-92.4	102.3	157.6	179.6	-3.2	0	0	0	106.4	V273 F282 G283	V273-D280 HydrophobicContact CG1-CB 4.38Å; D280-F282 PolarHBondContact O-N 3.23Å; D280-F282 VanDerWaalsContact O-N 3.09Å; D280-F282 PolarHBondContact OD1-N 3.05Å; D280-F282 VanDerWaalsContact OD1-N 3.09Å; D280-G283 VanDerWaalsContact CG-N 3.28Å; D280-G283 PolarHBondContact O-N 3.04Å; D280-G283 PolarHBondContact OD1-N 3.17Å; D280-G283 VanDerWaalsContact OD1-N 3.14Å; D280-G283 PolarHBondContact OD2-N 2.8Å
281	P	58.2	Low	57.9	Low	92 Å²	92	108.1 Å²	108.1	60%	0.597	66%	0.655	S	S	*	*	S	Bend	trans	-65.3	-12.6	-176	25.9	-32.3	0	0	0	113.1	F279	F279-P281 WeakPolarHBondContact O-CD 3.38Å
282	F	62.5	Low	56.8	Low	80 Å²	80	112.2 Å²	112.2	35%	0.351	65%	0.653	S	S	.	*	S	Bend	trans	-109.2	-15	-179.4	-56	-58.6	0	0	0	113.1	D266 L268 D280	D266-F282 VanDerWaalsContact CA-CZ 3.48Å; D266-F282 HydrophobicContact CB-CD1 4.02Å; D266-F282 HydrophobicContact CB-CE1 3.41Å; D266-F282 VanDerWaalsContact CB-CE1 3.41Å; D266-F282 HydrophobicContact CB-CZ 4.17Å; D266-F282 WeakPolarHBondContact O-CD1 3.21Å; D266-F282 WeakPolarHBondContact O-CE1 3.07Å; D266-F282 VanDerWaalsContact O-CG 3.25Å; D266-F282 WeakPolarHBondContact O-CG 3.16Å; L268-F282 HydrophobicContact CB-CE2 4.48Å; L268-F282 HydrophobicContact CD1-CD2 4.1Å; L268-F282 HydrophobicContact CD1-CE2 3.78Å; L268-F282 HydrophobicContact CG-CD2 4.13Å; L268-F282 HydrophobicContact CG-CE2 3.68Å; D280-F282 PolarHBondContact O-N 3.23Å; D280-F282 VanDerWaalsContact O-N 3.09Å; D280-F282 PolarHBondContact OD1-N 3.05Å; D280-F282 VanDerWaalsContact OD1-N 3.09Å
283	G	55.8	Low	55.1	Low	28 Å²	28	115.2 Å²	115.2	29%	0.289	67%	0.669	S	S	.	*			trans	56.3	175.4	176.4	0	0	0	0	0	113.4	D280 G285	D280-G283 VanDerWaalsContact CG-N 3.28Å; D280-G283 PolarHBondContact O-N 3.04Å; D280-G283 PolarHBondContact OD1-N 3.17Å; D280-G283 VanDerWaalsContact OD1-N 3.14Å; D280-G283 PolarHBondContact OD2-N 2.8Å; G283-G285 VanDerWaalsContact C-N 3.34Å; G283-G285 PolarHBondContact O-N 3.2Å
284	P	54.9	Low	53.6	Low	132 Å²	132	119.1 Å²	119.1	86%	0.857	70%	0.698	S	S	*	*	S	Bend	trans	-65.7	98.6	171.6	26.6	-30.7	0	0	0	108.7	I286	P284-I286 PolarHBondContact O-N 2.93Å
285	G	50.9	Low	51.6	Low	66 Å²	66	118.7 Å²	118.7	68%	0.68	71%	0.71	S	S	*	*			trans	-48.2	135.4	-176.6	0	0	0	0	0	113	G283 G287	G283-G285 VanDerWaalsContact C-N 3.34Å; G283-G285 PolarHBondContact O-N 3.2Å; G285-G287 PolarHBondContact O-N 3.34Å
286	I	43.2	Very low	49.7	Very low	183 Å²	183	115.3 Å²	115.3	94%	0.938	70%	0.7	S	S	*	*			trans	-65.8	77.7	168.6	-56.1	162.6	0	0	0	107.2	P284	P284-I286 PolarHBondContact O-N 2.93Å
287	G	47.3	Very low	48.4	Very low	54 Å²	54	123.1 Å²	123.1	56%	0.557	71%	0.705	S	S	*	*			trans	-81.3	149.3	171	0	0	0	0	0	110.8	G285 L289	G285-G287 PolarHBondContact O-N 3.34Å; G287-L289 PolarHBondContact O-N 3.4Å
288	P	42	Very low	46.9	Very low	127 Å²	127	132.2 Å²	132.2	83%	0.825	73%	0.73	S	S	*	*			trans	-62.7	137.3	-175.4	25.9	-32.2	0	0	0	111.4	R290	P288-R290 PolarHBondContact O-N 3.24Å; P288-R290 VanDerWaalsContact O-N 3.1Å
289	L	37.2	Very low	46	Very low	178 Å²	178	130.5 Å²	130.5	93%	0.932	73%	0.731	S	S	*	*			trans	-44.2	110.6	-177.2	-69.6	110.1	0	0	0	112.6	G287	G287-L289 PolarHBondContact O-N 3.4Å
290	R	43.3	Very low	45.2	Very low	213 Å²	213	128.9 Å²	128.9	80%	0.804	73%	0.73	S	S	*	*			trans	-87.6	124.8	158.6	-80.4	-171.9	179.3	-167.2	1.5	109.1	P288 H292	P288-R290 PolarHBondContact O-N 3.24Å; P288-R290 VanDerWaalsContact O-N 3.1Å; R290-H292 PolarHBondContact O-N 3.39Å; R290-H292 VanDerWaalsContact O-N 3.17Å
291	P	35.4	Very low	44.3	Very low	124 Å²	124	131.2 Å²	131.2	81%	0.805	75%	0.749	S	S	*	*			trans	-76.7	105.4	177.7	30.3	-29.3	0	0	0	108.3
292	H	43.3	Very low	44	Very low	161 Å²	161	130.8 Å²	130.8	75%	0.745	74%	0.741	S	S	*	*			trans	-101.8	123.8	164.1	-82.7	-73.2	0	0	0	110.1	R290	R290-H292 PolarHBondContact O-N 3.39Å; R290-H292 VanDerWaalsContact O-N 3.17Å
293	P	35.5	Very low	43.8	Very low	112 Å²	112	132.7 Å²	132.7	73%	0.727	76%	0.761	S	S	*	*			trans	-78.9	150.9	177.7	33.8	-31.6	0	0	0	109.4
294	S	38.9	Very low	43.9	Very low	130 Å²	130	137.1 Å²	137.1	91%	0.909	78%	0.779	S	S	*	*			trans	87.2	112.4	167.1	-153.6	0	0	0	0	116.9
295	G	30.8	Very low	44.1	Very low	78 Å²	78	137.5 Å²	137.5	80%	0.804	77%	0.769	S	S	*	*			trans	110.6	75.1	136	0	0	0	0	0	118.3
296	G	33.3	Very low	44.5	Very low	69 Å²	69	138.7 Å²	138.7	71%	0.711	77%	0.772	S	S	*	*			trans	97.5	111.1	133.8	0	0	0	0	0	118.9
297	R	41.3	Very low	45.4	Very low	243 Å²	243	136.1 Å²	136.1	92%	0.917	76%	0.758	S	S	*	*			trans	62.8	82.8	145.3	-56.2	-177	179.1	-172.6	-0.6	115.6
298	R	40.4	Very low	46	Very low	233 Å²	233	137.3 Å²	137.3	88%	0.879	76%	0.755	S	S	*	*				46.3	116	90.3	-64.4	-171.3	-177.7	162.6	1	114
299	H	46.4	Very low	47.1	Very low	181 Å²	181	137.7 Å²	137.7	84%	0.838	76%	0.758	S	S	*	*			trans	87.9	105.1	156.1	-77.5	-77.5	0	0	0	120.5
300	I	42.6	Very low	48.1	Very low	155 Å²	155	132.2 Å²	132.2	80%	0.795	75%	0.745	S	S	*	*			trans	-49.8	144.9	155.9	-64.9	129.6	0	0	0	112.1
301	P	47.2	Very low	49	Very low	117 Å²	117	128 Å²	128	76%	0.76	73%	0.732	S	S	*	*				-134.7	145.9	109.2	18	3.5	0	0	0	114.7
302	D	51.5	Low	50.3	Low	82 Å²	82	128.6 Å²	128.6	44%	0.439	73%	0.729	S	S	.	*			trans	-49	139.3	175.6	-166.2	-0.7	0	0	0	114.5	D304 H305	D302-D304 PolarHBondContact O-N 2.64Å; D302-H305 IonicContact OD2-CE1 4Å; D302-H305 IonicContact OD2-NE2 3.71Å
303	P	57.8	Low	51.1	Low	120 Å²	120	127.8 Å²	127.8	78%	0.779	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-12.4	176	-22.7	34.3	0	0	0	115.9
304	D	59.9	Low	52.3	Low	121 Å²	121	129.3 Å²	129.3	65%	0.647	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	20.3	-176.1	-72.8	-15.5	0	0	0	113.9	D302	D302-D304 PolarHBondContact O-N 2.64Å
305	H	58.6	Low	53.1	Low	140 Å²	140	133.5 Å²	133.5	65%	0.648	72%	0.723	S	S	*	*			trans	-109.7	23.4	175.6	-69.5	-30.3	0	0	0	115	D302 M307	D302-H305 IonicContact OD2-CE1 4Å; D302-H305 IonicContact OD2-NE2 3.71Å; H305-M307 PolarHBondContact O-N 3.16Å; H305-M307 VanDerWaalsContact O-N 3.07Å
306	A	59.7	Low	53.6	Low	91 Å²	91	142.4 Å²	142.4	75%	0.752	75%	0.747	S	S	*	*			trans	-72	102.4	169.3	0	0	0	0	0	109.9
307	M	61.8	Low	54.6	Low	129 Å²	129	146.1 Å²	146.1	64%	0.635	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-58.4	133.8	166	-75.2	-177.1	63.4	0	0	108.9	H305 F311	H305-M307 PolarHBondContact O-N 3.16Å; H305-M307 VanDerWaalsContact O-N 3.07Å; M307-F311 HydrophobicContact CE-CB 4.04Å
308	P	59.2	Low	55.3	Low	79 Å²	79	141 Å²	141	51%	0.513	74%	0.74	S	S	.	*	P	Polyproline II helix	trans	-59	139.8	176.8	22.4	-30.7	0	0	0	109.8	G310 F311	P308-G310 PolarHBondContact O-N 2.86Å; P308-F311 HydrophobicContact CB-CD2 4.47Å; P308-F311 HydrophobicContact CG-CD2 3.78Å; P308-F311 HydrophobicContact CG-CE2 4.09Å
309	P	64.4	Low	56.1	Low	136 Å²	136	135.9 Å²	135.9	88%	0.883	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	124.8	179.9	-20.2	30	0	0	0	110.7
310	G	59.6	Low	56.7	Low	63 Å²	63	133.2 Å²	133.2	65%	0.649	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	108.8	17.6	172.8	0	0	0	0	0	117.3	P308	P308-G310 PolarHBondContact O-N 2.86Å
311	F	61.6	Low	57.6	Low	123 Å²	123	131.9 Å²	131.9	54%	0.539	72%	0.722	S	S	.	*			trans	-104	11.6	180	-94.8	-91.9	0	0	0	115.9	M307 P308 N313 F314	M307-F311 HydrophobicContact CE-CB 4.04Å; P308-F311 HydrophobicContact CB-CD2 4.47Å; P308-F311 HydrophobicContact CG-CD2 3.78Å; P308-F311 HydrophobicContact CG-CE2 4.09Å; F311-N313 VanDerWaalsContact C-N 3.3Å; F311-N313 PolarHBondContact O-N 3.32Å; F311-F314 HydrophobicContact CD1-CD2 4.21Å; F311-F314 HydrophobicContact CD1-CE2 4.43Å
312	D	62.5	Low	58.3	Low	138 Å²	138	132.9 Å²	132.9	74%	0.738	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-1.1	-171.6	-65	-26.3	0	0	0	115.5
313	N	59.6	Low	58.8	Low	143 Å²	143	136.5 Å²	136.5	77%	0.765	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128	18.3	-164	-65.3	-5.8	0	0	0	116.8	F311	F311-N313 VanDerWaalsContact C-N 3.3Å; F311-N313 PolarHBondContact O-N 3.32Å
314	F	60.5	Low	58.9	Low	145 Å²	145	137.8 Å²	137.8	64%	0.636	74%	0.736	S	S	*	*	S	Bend	trans	-92.5	-10.9	-175.2	-76.2	-76.2	0	0	0	115.9	F311	F311-F314 HydrophobicContact CD1-CD2 4.21Å; F311-F314 HydrophobicContact CD1-CE2 4.43Å
315	Y	56.9	Low	58.8	Low	218 Å²	218	139.2 Å²	139.2	86%	0.855	74%	0.743	S	S	*	*			trans	-155.6	79.3	179.5	-66.5	-86	0	0	0	110.4
316	M	41	Very low	58.8	Low	265 Å²	265	139.1 Å²	139.1	100%	1.305	75%	0.752	S	S	*	*			trans	161.9	0	151.7	-90.2	169.9	-164.8	0	0	111.7

Retrieved 316 of 316 residues in 393.6 ms (Link to these results)

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