A0A077Z587_TRITR Loading...

Kelch 3 and Kelch 4 and Cytochrom B561 domain con taining protein

AlphaFold DB , UniProt , Accession A0A077Z587, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 772 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.4	Very low	32.8	Very low	256 Å²	256	149.1 Å²	149.1	100%	1.261	85%	0.848	S	S	*	*				0	137.3	0	-85.1	-179.8	171.2	0	0	108.2
2	G	34.5	Very low	34.4	Very low	69 Å²	69	147.2 Å²	147.2	71%	0.711	82%	0.823	S	S	*	*			trans	112.5	60.1	179	0	0	0	0	0	112.3
3	S	29.2	Very low	36.3	Very low	112 Å²	112	143.3 Å²	143.3	78%	0.783	81%	0.805	S	S	*	*				55.3	104	89.4	72.9	0	0	0	0	114.5
4	Q	26.3	Very low	39	Very low	186 Å²	186	138.1 Å²	138.1	87%	0.869	78%	0.777	S	S	*	*			trans	20	117.1	134.7	-66.4	175.5	-18.7	0	0	117.4
5	Q	31.8	Very low	41.8	Very low	200 Å²	200	135.3 Å²	135.3	94%	0.935	76%	0.756	S	S	*	*			trans	-144.1	93.6	132.4	-106.8	171.5	-2.5	0	0	107.5	A7	Q5-A7 PolarHBondContact O-N 3.17Å
6	A	30.6	Very low	44.5	Very low	103 Å²	103	136.7 Å²	136.7	85%	0.851	75%	0.746	S	S	*	*			trans	-67.8	103.2	167.1	0	0	0	0	0	107.5	D8	A6-D8 PolarHBondContact O-N 3.3Å
7	A	33.7	Very low	46.9	Very low	93 Å²	93	130.6 Å²	130.6	77%	0.769	71%	0.712	S	S	*	*			trans	-81.3	107.7	161.5	0	0	0	0	0	106.8	Q5 E9	Q5-A7 PolarHBondContact O-N 3.17Å; A7-E9 PolarHBondContact O-N 2.83Å
8	D	32	Very low	49.2	Very low	144 Å²	144	129.5 Å²	129.5	77%	0.77	70%	0.704	S	S	*	*			trans	-62.3	88.8	177.7	-160.7	11.9	0	0	0	109.9	A6 T10	A6-D8 PolarHBondContact O-N 3.3Å; D8-T10 VanDerWaalsContact C-N 3.34Å; D8-T10 PolarHBondContact O-N 3.28Å
9	E	33.8	Very low	51.2	Low	185 Å²	185	123.8 Å²	123.8	86%	0.864	67%	0.673	S	S	*	*			trans	-85	83.7	165.4	-79.1	-165.4	164.1	0	0	108.3	A7 Q11	A7-E9 PolarHBondContact O-N 2.83Å; E9-Q11 PolarHBondContact O-N 3.13Å
10	T	37.8	Very low	53.1	Low	100 Å²	100	123.5 Å²	123.5	61%	0.613	67%	0.67	S	S	*	*			trans	-45.8	113.5	167.8	43.4	0	0	0	0	110	D8 K12	D8-T10 VanDerWaalsContact C-N 3.34Å; D8-T10 PolarHBondContact O-N 3.28Å; T10-K12 PolarHBondContact O-N 3.08Å
11	Q	43.8	Very low	54.7	Low	192 Å²	192	117.7 Å²	117.7	90%	0.897	64%	0.639	S	S	*	*			trans	-60.8	104.1	175.8	-137.4	175	7.4	0	0	108.3	E9 V13	E9-Q11 PolarHBondContact O-N 3.13Å; Q11-V13 PolarHBondContact O-N 3.13Å
12	K	51.5	Low	57.4	Low	126 Å²	126	108.8 Å²	108.8	55%	0.548	60%	0.597	S	S	.	*			trans	-71.9	118.4	-179.7	-66.4	-175.4	173.7	-167.7	0	108.9	T10 V14 E93	T10-K12 PolarHBondContact O-N 3.08Å; K12-V14 PolarHBondContact O-N 3.47Å; K12-E93 HydrophobicContact CD-CG 4.29Å; K12-E93 WeakPolarHBondContact CD-OE1 3.33Å; K12-E93 WeakPolarHBondContact CD-OE2 3.26Å; K12-E93 IonicContact NZ-OE1 2.98Å; K12-E93 PolarHBondContact NZ-OE1 3.47Å; K12-E93 IonicContact NZ-OE2 2.72Å; K12-E93 PolarHBondContact NZ-OE2 3.04Å
13	V	59.7	Low	59.7	Low	97 Å²	97	107.4 Å²	107.4	59%	0.588	57%	0.574	S	S	*	*			trans	-70.2	115.9	172.7	-179	0	0	0	0	107.9	Q11 L94	Q11-V13 PolarHBondContact O-N 3.13Å; V13-L94 HydrophobicContact CG1-CD1 4.27Å; V13-L94 PolarHBondContact O-N 3.13Å
14	V	73.6	Confident	61.9	Low	70 Å²	70	111.8 Å²	111.8	42%	0.424	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.7	122.1	180	-178.3	0	0	0	0	108.5	K12 E91 R92 E93	K12-V14 PolarHBondContact O-N 3.47Å; V14-E91 HydrophobicContact CG1-CB 3.51Å; V14-E91 HydrophobicContact CG1-CG 3.67Å; V14-R92 WeakPolarHBondContact CA-O 3.45Å; V14-E93 HydrophobicContact CG2-CG 4.4Å
15	E	81.2	Confident	64.3	Low	97 Å²	97	111.7 Å²	111.7	45%	0.453	57%	0.57	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-89.5	136.9	172.2	-173.1	-178	-166.6	0	0	109.6	I17 E91 R92 L94	E15-I17 HydrophobicContact CG-CD1 4.43Å; E15-I17 HydrophobicContact CG-CG1 3.94Å; E15-E91 WeakPolarHBondContact O-CA 3.41Å; E15-R92 PolarHBondContact N-O 3.25Å; E15-R92 PolarHBondContact O-N 3.26Å; E15-L94 HydrophobicContact CB-CD1 3.96Å
16	R	84.7	Confident	66.5	Low	157 Å²	157	104.2 Å²	104.2	59%	0.592	54%	0.537	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	118.5	175	-173.8	176.4	-77	-157.7	0.5	109.7	T89 V90 E91	R16-T89 HydrophobicContact CG-CG2 3.47Å; R16-T89 VanDerWaalsContact CG-CG2 3.47Å; R16-V90 CarbonylContact C-O 3.58Å; R16-V90 WeakPolarHBondContact CA-O 3.17Å; R16-E91 HydrophobicContact CB-CG 4.49Å; R16-E91 IonicContact CZ-OE1 2.74Å; R16-E91 IonicContact NE-OE1 2.96Å; R16-E91 PolarHBondContact NE-OE1 3.46Å; R16-E91 IonicContact NH2-OE1 3.31Å; R16-E91 PolarHBondContact NH2-OE1 3.29Å
17	I	86	Confident	68.8	Low	34 Å²	34	109.8 Å²	109.8	17%	0.174	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	133.1	-172.4	-54.5	169.6	0	0	0	109.2	E15 L19 T89 V90 R92	E15-I17 HydrophobicContact CG-CD1 4.43Å; E15-I17 HydrophobicContact CG-CG1 3.94Å; I17-L19 HydrophobicContact CG2-CD2 3.88Å; I17-L19 HydrophobicContact CG2-CG 4.4Å; I17-T89 CarbonylContact O-C 3.54Å; I17-T89 WeakPolarHBondContact O-CA 3.39Å; I17-V90 HydrophobicContact CB-CG2 3.91Å; I17-V90 PolarHBondContact N-O 3.08Å; I17-V90 PolarHBondContact O-N 3.29Å; I17-R92 HydrophobicContact CD1-CB 4.24Å
18	I	88	Confident	71.1	Confident	110 Å²	110	110.1 Å²	110.1	56%	0.564	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	118.6	174.9	-57.2	174.8	0	0	0	109	T87 T89	I18-T87 HydrophobicContact CG2-CG2 3.54Å; I18-T89 HydrophobicContact CG1-CG2 4.41Å
19	L	87.6	Confident	73.5	Confident	21 Å²	21	106.1 Å²	106.1	11%	0.11	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	119.6	-178.4	-58.2	173	0	0	0	110.6	I17 I21 H55 F56 T87 V88 V90	I17-L19 HydrophobicContact CG2-CD2 3.88Å; I17-L19 HydrophobicContact CG2-CG 4.4Å; L19-I21 HydrophobicContact CB-CG1 4.41Å; L19-H55 HydrophobicContact CD1-CB 4.42Å; L19-H55 WeakPolarHBondContact CD1-O 3.41Å; L19-F56 HydrophobicContact CD1-CD1 3.99Å; L19-F56 HydrophobicContact CD1-CE1 3.81Å; L19-F56 HydrophobicContact CD1-CG 4.49Å; L19-F56 HydrophobicContact CD1-CZ 4.17Å; L19-T87 CarbonylContact O-C 3.59Å; L19-T87 WeakPolarHBondContact O-CA 3.49Å; L19-V88 HydrophobicContact CB-CB 4.44Å; L19-V88 WeakPolarHBondContact CB-O 3.47Å; L19-V88 PolarHBondContact N-O 3.34Å; L19-V88 PolarHBondContact O-N 2.84Å; L19-V90 HydrophobicContact CD1-CG1 3.94Å; L19-V90 HydrophobicContact CD1-CG2 3.78Å; L19-V90 HydrophobicContact CG-CG2 4.15Å
20	N	88.4	Confident	76	Confident	117 Å²	117	98.9 Å²	98.9	63%	0.626	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	109.8	174	-70.4	-42.2	0	0	0	110.6	L86 T87	N20-L86 CarbonylContact C-O 3.51Å; N20-L86 WeakPolarHBondContact CA-O 3.44Å; N20-T87 WeakPolarHBondContact OD1-CG2 2.99Å; N20-T87 PolarHBondContact OD1-OG1 3.42Å
21	I	87.2	Confident	78.3	Confident	2 Å²	2	95.2 Å²	95.2	1%	0.01	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.8	-172.7	-50	175.3	0	0	0	109.9	L19 V23 F30 I51 H55 F56 V85 L86	L19-I21 HydrophobicContact CB-CG1 4.41Å; I21-V23 HydrophobicContact CG2-CG2 4.2Å; I21-F30 HydrophobicContact CD1-CE2 4.27Å; I21-F30 HydrophobicContact CD1-CZ 4.35Å; I21-F30 HydrophobicContact CG2-CE2 4.22Å; I21-I51 HydrophobicContact CG2-CG2 3.64Å; I21-H55 HydrophobicContact CD1-CB 3.95Å; I21-H55 HydrophobicContact CG1-CB 4.3Å; I21-F56 HydrophobicContact CD1-CE2 3.5Å; I21-F56 VanDerWaalsContact CD1-CE2 3.5Å; I21-F56 HydrophobicContact CD1-CZ 3.82Å; I21-V85 WeakPolarHBondContact O-CA 3.22Å; I21-L86 HydrophobicContact CB-CB 4.37Å; I21-L86 PolarHBondContact N-O 3.44Å; I21-L86 PolarHBondContact O-N 2.99Å
22	N	84.7	Confident	80.5	Confident	70 Å²	70	87.5 Å²	87.5	37%	0.374	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	92	177.3	-169.4	-20.4	0	0	0	111.4	R24	N22-R24 PolarHBondContact O-N 3.35Å; N22-R24 WeakPolarHBondContact OD1-CB 3.38Å; N22-R24 PolarHBondContact OD1-N 3.15Å; N22-R24 VanDerWaalsContact OD1-N 3.14Å
23	V	81.2	Confident	82.2	Confident	40 Å²	40	82.4 Å²	82.4	24%	0.242	40%	0.402	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-18.2	-179.7	-170.4	0	0	0	0	112	I21 K25 D26 F30 I51 K84 L86	I21-V23 HydrophobicContact CG2-CG2 4.2Å; V23-K25 VanDerWaalsContact C-N 3.31Å; V23-K25 PolarHBondContact O-N 2.92Å; V23-D26 PolarHBondContact O-N 3.34Å; V23-F30 HydrophobicContact CG2-CD2 4.14Å; V23-F30 HydrophobicContact CG2-CE2 4.35Å; V23-I51 HydrophobicContact CG1-CD1 3.98Å; V23-K84 WeakPolarHBondContact CA-O 3.47Å; V23-K84 WeakPolarHBondContact CB-O 3.49Å; V23-K84 PolarHBondContact N-O 3.46Å; V23-L86 HydrophobicContact CG2-CD1 4Å
24	R	77.1	Confident	83.7	Confident	204 Å²	204	78.2 Å²	78.2	77%	0.77	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-31.6	-179.2	-168.8	176.2	179.2	169.6	-0.2	113	N22 K84	N22-R24 PolarHBondContact O-N 3.35Å; N22-R24 WeakPolarHBondContact OD1-CB 3.38Å; N22-R24 PolarHBondContact OD1-N 3.15Å; N22-R24 VanDerWaalsContact OD1-N 3.14Å; R24-K84 HydrophobicContact CB-CB 4.22Å; R24-K84 HydrophobicContact CG-CD 4.44Å; R24-K84 PolarHBondContact N-O 2.88Å
25	K	76.9	Confident	84.3	Confident	183 Å²	183	80.9 Å²	80.9	80%	0.796	38%	0.382	S	S	*	.	S	Bend	trans	-87.3	-16	-175.8	-71.2	-171.6	177.3	-177.6	0	113.2	V23	V23-K25 VanDerWaalsContact C-N 3.31Å; V23-K25 PolarHBondContact O-N 2.92Å
26	D	76.7	Confident	84.5	Confident	44 Å²	44	80.1 Å²	80.1	24%	0.235	38%	0.38	C	S	.	.			trans	-110.8	125.6	-172.1	-159.5	-30.4	0	0	0	111.1	V23 R28 I51	V23-D26 PolarHBondContact O-N 3.34Å; D26-R28 VanDerWaalsContact C-N 3.32Å; D26-R28 VanDerWaalsContact OD1-CB 3.27Å; D26-R28 WeakPolarHBondContact OD1-CB 3.49Å; D26-R28 VanDerWaalsContact OD1-CG 3.24Å; D26-R28 WeakPolarHBondContact OD1-CG 2.8Å; D26-R28 PolarHBondContact OD1-N 3.47Å; D26-R28 IonicContact OD1-NE 2.74Å; D26-R28 PolarHBondContact OD1-NE 3.37Å; D26-R28 VanDerWaalsContact OD1-NE 3.12Å; D26-R28 IonicContact OD2-CZ 3.52Å; D26-R28 VanDerWaalsContact OD2-CZ 3.22Å; D26-R28 IonicContact OD2-NE 3.68Å; D26-R28 PolarHBondContact OD2-NE 3.38Å; D26-R28 IonicContact OD2-NH2 3.66Å; D26-R28 PolarHBondContact OD2-NH2 3.42Å; D26-I51 HydrophobicContact CB-CD1 3.79Å; D26-I51 HydrophobicContact CB-CG1 4.11Å
27	K	78.8	Confident	84.1	Confident	220 Å²	220	79.4 Å²	79.4	96%	0.957	38%	0.381	S	S	*	.			trans	-83.6	-7.5	179	-67.5	-174.9	-179.7	179.6	0	112.8
28	R	82.3	Confident	83.7	Confident	99 Å²	99	87.2 Å²	87.2	37%	0.374	41%	0.414	S	S	.	.	S	Bend	trans	-69.2	151.9	177.8	-63.7	178.3	-67.2	165.6	-0.1	110.6	D26 G49 I51 D54	D26-R28 VanDerWaalsContact C-N 3.32Å; D26-R28 VanDerWaalsContact OD1-CB 3.27Å; D26-R28 WeakPolarHBondContact OD1-CB 3.49Å; D26-R28 VanDerWaalsContact OD1-CG 3.24Å; D26-R28 WeakPolarHBondContact OD1-CG 2.8Å; D26-R28 PolarHBondContact OD1-N 3.47Å; D26-R28 IonicContact OD1-NE 2.74Å; D26-R28 PolarHBondContact OD1-NE 3.37Å; D26-R28 VanDerWaalsContact OD1-NE 3.12Å; D26-R28 IonicContact OD2-CZ 3.52Å; D26-R28 VanDerWaalsContact OD2-CZ 3.22Å; D26-R28 IonicContact OD2-NE 3.68Å; D26-R28 PolarHBondContact OD2-NE 3.38Å; D26-R28 IonicContact OD2-NH2 3.66Å; D26-R28 PolarHBondContact OD2-NH2 3.42Å; R28-G49 WeakPolarHBondContact CD-O 3.45Å; R28-I51 HydrophobicContact CB-CG1 4.08Å; R28-I51 WeakPolarHBondContact O-CD1 3.49Å; R28-D54 IonicContact CZ-OD2 2.78Å; R28-D54 IonicContact NH1-OD2 3.29Å; R28-D54 PolarHBondContact NH1-OD2 3.27Å; R28-D54 VanDerWaalsContact NH1-OD2 3.09Å; R28-D54 IonicContact NH2-OD2 2.65Å; R28-D54 PolarHBondContact NH2-OD2 3.39Å
29	S	82.6	Confident	83.2	Confident	61 Å²	61	84.6 Å²	84.6	43%	0.427	41%	0.414	S	S	.	.			trans	-66.4	148.6	171.3	67.3	0	0	0	0	110.6	G31 S50 I51	S29-G31 VanDerWaalsContact C-N 3.32Å; S29-G31 PolarHBondContact O-N 3.25Å; S29-S50 WeakPolarHBondContact O-CA 3.41Å; S29-S50 VanDerWaalsContact O-CB 3.26Å; S29-S50 WeakPolarHBondContact O-CB 3.45Å; S29-I51 PolarHBondContact O-N 3.11Å
30	F	86	Confident	82.9	Confident	33 Å²	33	86.5 Å²	86.5	15%	0.145	43%	0.425	C	S	.	.			trans	-60	-39.7	178.8	-167.6	-103.9	0	0	0	112.8	I21 V23 L32 S50 I51 A52 F56 I80 L86	I21-F30 HydrophobicContact CD1-CE2 4.27Å; I21-F30 HydrophobicContact CD1-CZ 4.35Å; I21-F30 HydrophobicContact CG2-CE2 4.22Å; V23-F30 HydrophobicContact CG2-CD2 4.14Å; V23-F30 HydrophobicContact CG2-CE2 4.35Å; F30-L32 VanDerWaalsContact C-N 3.34Å; F30-L32 HydrophobicContact CD1-CB 3.56Å; F30-L32 HydrophobicContact CE1-CB 3.48Å; F30-L32 VanDerWaalsContact CE1-CB 3.48Å; F30-L32 HydrophobicContact CE1-CD2 3.7Å; F30-L32 HydrophobicContact CE1-CG 4.2Å; F30-L32 HydrophobicContact CZ-CD2 4.47Å; F30-L32 PolarHBondContact O-N 3.01Å; F30-S50 PolarHBondContact O-OG 2.75Å; F30-I51 HydrophobicContact CD2-CB 4.38Å; F30-I51 HydrophobicContact CD2-CG2 4.43Å; F30-A52 WeakPolarHBondContact O-CB 3.36Å; F30-A52 PolarHBondContact O-N 2.96Å; F30-F56 HydrophobicContact CE1-CE2 4.41Å; F30-F56 AromaticContact CZ-CE2 3.86Å; F30-F56 HydrophobicContact CZ-CE2 3.86Å; F30-F56 HydrophobicContact CZ-CZ 4.37Å; F30-I80 HydrophobicContact CD1-CG2 3.78Å; F30-I80 HydrophobicContact CD2-CG2 4.38Å; F30-I80 HydrophobicContact CE1-CD1 3.98Å; F30-I80 HydrophobicContact CE1-CG2 3.72Å; F30-I80 HydrophobicContact CE2-CG2 4.34Å; F30-I80 HydrophobicContact CG-CG2 4.12Å; F30-I80 HydrophobicContact CZ-CD1 4.41Å; F30-I80 HydrophobicContact CZ-CG2 4.02Å; F30-L86 HydrophobicContact CE2-CD1 3.89Å; F30-L86 HydrophobicContact CZ-CD1 4.23Å
31	G	86.2	Confident	82.8	Confident	22 Å²	22	81 Å²	81	23%	0.227	40%	0.395	C	S	.	.			trans	68.7	16.6	166.6	0	0	0	0	0	117.8	S29 R47	S29-G31 VanDerWaalsContact C-N 3.32Å; S29-G31 PolarHBondContact O-N 3.25Å; G31-R47 PolarHBondContact O-N 3.02Å
32	L	89.9	Confident	83	Confident	31 Å²	31	82.4 Å²	82.4	16%	0.162	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.2	178	-165.5	72.3	0	0	0	112.5	F30 I34 V43 I46 A52 F56 I62 I80	F30-L32 VanDerWaalsContact C-N 3.34Å; F30-L32 HydrophobicContact CD1-CB 3.56Å; F30-L32 HydrophobicContact CE1-CB 3.48Å; F30-L32 VanDerWaalsContact CE1-CB 3.48Å; F30-L32 HydrophobicContact CE1-CD2 3.7Å; F30-L32 HydrophobicContact CE1-CG 4.2Å; F30-L32 HydrophobicContact CZ-CD2 4.47Å; F30-L32 PolarHBondContact O-N 3.01Å; L32-I34 HydrophobicContact CD2-CG2 3.9Å; L32-I34 HydrophobicContact CG-CG2 4.12Å; L32-V43 HydrophobicContact CD1-CB 4.36Å; L32-V43 HydrophobicContact CD1-CG1 3.59Å; L32-V43 HydrophobicContact CD1-CG2 3.88Å; L32-I46 HydrophobicContact CD1-CG1 4.49Å; L32-A52 HydrophobicContact CB-CB 3.9Å; L32-A52 HydrophobicContact CD1-CB 3.79Å; L32-A52 HydrophobicContact CG-CB 4.47Å; L32-F56 HydrophobicContact CD1-CB 4.02Å; L32-F56 HydrophobicContact CD1-CD1 4.34Å; L32-F56 HydrophobicContact CD1-CD2 3.82Å; L32-F56 HydrophobicContact CD1-CE2 4.37Å; L32-F56 HydrophobicContact CD1-CG 3.8Å; L32-F56 HydrophobicContact CD2-CD2 4.45Å; L32-F56 HydrophobicContact CD2-CE1 4.41Å; L32-F56 HydrophobicContact CD2-CE2 4.2Å; L32-F56 HydrophobicContact CD2-CZ 4.18Å; L32-I62 HydrophobicContact CD2-CD1 4.02Å; L32-I80 HydrophobicContact CD2-CD1 4.46Å
33	G	87.5	Confident	83.3	Confident	18 Å²	18	79.1 Å²	79.1	19%	0.186	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.2	170.2	0	0	0	0	0	111.8	S44 S45	G33-S44 WeakPolarHBondContact O-CA 3.25Å; G33-S44 PolarHBondContact O-N 2.98Å; G33-S44 PolarHBondContact O-OG 2.88Å; G33-S45 WeakPolarHBondContact CA-O 3.45Å; G33-S45 WeakPolarHBondContact CA-OG 3.5Å; G33-S45 PolarHBondContact N-O 2.98Å; G33-S45 PolarHBondContact O-N 2.72Å
34	I	90.9	Very high	83.7	Confident	9 Å²	9	78.7 Å²	78.7	5%	0.046	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	144.3	-177	54.7	171.1	0	0	0	112.7	L32 V41 F42 I62 R73 C76	L32-I34 HydrophobicContact CD2-CG2 3.9Å; L32-I34 HydrophobicContact CG-CG2 4.12Å; I34-V41 HydrophobicContact CB-CG1 3.9Å; I34-V41 HydrophobicContact CD1-CG1 4.2Å; I34-V41 HydrophobicContact CG2-CG1 4.13Å; I34-F42 WeakPolarHBondContact CA-O 3.19Å; I34-I62 HydrophobicContact CG2-CD1 4Å; I34-R73 HydrophobicContact CD1-CG 3.83Å; I34-R73 HydrophobicContact CG1-CG 4.01Å; I34-R73 PolarHBondContact O-NE 3.1Å; I34-C76 HydrophobicContact CD1-CB 3.78Å
35	K	86.5	Confident	84.1	Confident	127 Å²	127	71.9 Å²	71.9	55%	0.552	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.4	156.7	171.4	-75.6	-178.4	-178.2	179.7	0	110.2	F42	K35-F42 HydrophobicContact CB-CE1 3.77Å; K35-F42 HydrophobicContact CB-CE2 4.33Å; K35-F42 HydrophobicContact CB-CZ 3.65Å; K35-F42 PolarHBondContact N-O 3.31Å; K35-F42 VanDerWaalsContact N-O 3.11Å; K35-F42 VanDerWaalsContact O-CD1 3.22Å; K35-F42 WeakPolarHBondContact O-CD1 3.47Å; K35-F42 WeakPolarHBondContact O-CE1 3.24Å; K35-F42 PolarHBondContact O-N 3.03Å
36	I	84.4	Confident	84.9	Confident	80 Å²	80	65.3 Å²	65.3	41%	0.41	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	133.2	173.4	-61.5	168	0	0	0	109	N40 V41 R73	I36-N40 WeakPolarHBondContact CA-O 3.43Å; I36-V41 HydrophobicContact CG1-CG2 4.08Å; I36-R73 HydrophobicContact CD1-CB 3.75Å; I36-R73 HydrophobicContact CG1-CB 4.08Å
37	K	77.5	Confident	85.3	Confident	142 Å²	142	71 Å²	71	62%	0.617	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.5	128.7	169	-177.4	176.4	-177.6	-176.8	0	109.3	G39 N40 F42	K37-G39 VanDerWaalsContact C-N 3.27Å; K37-G39 PolarHBondContact O-N 3.27Å; K37-N40 PolarHBondContact N-O 3.05Å; K37-N40 PolarHBondContact O-N 3.22Å; K37-F42 HydrophobicContact CB-CD1 3.93Å; K37-F42 HydrophobicContact CB-CE1 3.38Å; K37-F42 HydrophobicContact CB-CZ 4.26Å; K37-F42 HydrophobicContact CD-CE1 4.49Å
38	K	77.4	Confident	85.5	Confident	198 Å²	198	65.7 Å²	65.7	86%	0.861	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.2	43.4	-177.3	-62.3	-175.5	175.2	-174.5	0	113.4	N40	K38-N40 PolarHBondContact O-N 2.95Å
39	G	77	Confident	85.5	Confident	55 Å²	55	63.1 Å²	63.1	57%	0.567	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	0.9	179.7	0	0	0	0	0	115.9	K37	K37-G39 VanDerWaalsContact C-N 3.27Å; K37-G39 PolarHBondContact O-N 3.27Å
40	N	82.2	Confident	85.9	Confident	62 Å²	62	60.2 Å²	60.2	33%	0.332	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	139.7	175.1	-69	-62.4	0	0	0	110.8	I36 K37 K38 V61 K63	I36-N40 WeakPolarHBondContact CA-O 3.43Å; K37-N40 PolarHBondContact N-O 3.05Å; K37-N40 PolarHBondContact O-N 3.22Å; K38-N40 PolarHBondContact O-N 2.95Å; N40-V61 HydrophobicContact CB-CG1 3.88Å; N40-K63 PolarHBondContact OD1-NZ 3.14Å
41	V	86.7	Confident	85.9	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.006	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	124	171.3	-178.3	0	0	0	0	108.7	I34 I36 I62 I70	I34-V41 HydrophobicContact CB-CG1 3.9Å; I34-V41 HydrophobicContact CD1-CG1 4.2Å; I34-V41 HydrophobicContact CG2-CG1 4.13Å; I36-V41 HydrophobicContact CG1-CG2 4.08Å; V41-I62 PolarHBondContact O-N 2.81Å; V41-I70 HydrophobicContact CB-CG2 4.1Å; V41-I70 HydrophobicContact CG2-CG2 3.52Å
42	F	90.2	Very high	86	Confident	32 Å²	32	57.8 Å²	57.8	14%	0.14	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	156.2	178.2	69.4	-80.5	0	0	0	112.1	I34 K35 K37 S44 Y59 D60 V61	I34-F42 WeakPolarHBondContact CA-O 3.19Å; K35-F42 HydrophobicContact CB-CE1 3.77Å; K35-F42 HydrophobicContact CB-CE2 4.33Å; K35-F42 HydrophobicContact CB-CZ 3.65Å; K35-F42 PolarHBondContact N-O 3.31Å; K35-F42 VanDerWaalsContact N-O 3.11Å; K35-F42 VanDerWaalsContact O-CD1 3.22Å; K35-F42 WeakPolarHBondContact O-CD1 3.47Å; K35-F42 WeakPolarHBondContact O-CE1 3.24Å; K35-F42 PolarHBondContact O-N 3.03Å; K37-F42 HydrophobicContact CB-CD1 3.93Å; K37-F42 HydrophobicContact CB-CE1 3.38Å; K37-F42 HydrophobicContact CB-CZ 4.26Å; K37-F42 HydrophobicContact CD-CE1 4.49Å; F42-S44 PolarHBondContact O-N 3.23Å; F42-Y59 HydrophobicContact CD2-CD1 4.08Å; F42-Y59 HydrophobicContact CE2-CD1 4.16Å; F42-Y59 HydrophobicContact CE2-CE1 4.44Å; F42-D60 CarbonylContact C-O 3.53Å; F42-D60 WeakPolarHBondContact CA-O 3.25Å; F42-D60 WeakPolarHBondContact CB-O 3.48Å; F42-V61 HydrophobicContact CB-CG2 4.33Å
43	V	90.8	Very high	86	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	111.5	177.9	-178.7	0	0	0	0	109.5	L32 I46 F56 Y59 D60 I62	L32-V43 HydrophobicContact CD1-CB 4.36Å; L32-V43 HydrophobicContact CD1-CG1 3.59Å; L32-V43 HydrophobicContact CD1-CG2 3.88Å; V43-I46 HydrophobicContact CG1-CD1 4.02Å; V43-I46 HydrophobicContact CG1-CG1 3.67Å; V43-F56 HydrophobicContact CG2-CB 4.32Å; V43-F56 HydrophobicContact CG2-CD1 3.92Å; V43-F56 HydrophobicContact CG2-CG 4.37Å; V43-Y59 WeakPolarHBondContact O-CA 3.48Å; V43-Y59 PolarHBondContact O-N 2.95Å; V43-D60 HydrophobicContact CB-CB 4.5Å; V43-D60 HydrophobicContact CG2-CB 4.03Å; V43-D60 PolarHBondContact N-O 2.88Å; V43-I62 HydrophobicContact CG2-CD1 4.25Å; V43-I62 HydrophobicContact CG2-CG1 4.41Å
44	S	89.4	Confident	86	Confident	31 Å²	31	64.9 Å²	64.9	22%	0.217	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-25.7	-176.3	65.6	0	0	0	0	114.3	G33 F42	G33-S44 WeakPolarHBondContact O-CA 3.25Å; G33-S44 PolarHBondContact O-N 2.98Å; G33-S44 PolarHBondContact O-OG 2.88Å; F42-S44 PolarHBondContact O-N 3.23Å
45	S	87	Confident	85.9	Confident	62 Å²	62	67.4 Å²	67.4	43%	0.434	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	145.1	177.7	62.6	0	0	0	0	109.8	G33	G33-S45 WeakPolarHBondContact CA-O 3.45Å; G33-S45 WeakPolarHBondContact CA-OG 3.5Å; G33-S45 PolarHBondContact N-O 2.98Å; G33-S45 PolarHBondContact O-N 2.72Å
46	I	92	Very high	86.2	Confident	44 Å²	44	61.7 Å²	61.7	23%	0.226	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.3	175	-61.1	171.1	0	0	0	107.2	L32 V43 A52 E53 F56	L32-I46 HydrophobicContact CD1-CG1 4.49Å; V43-I46 HydrophobicContact CG1-CD1 4.02Å; V43-I46 HydrophobicContact CG1-CG1 3.67Å; I46-A52 HydrophobicContact CG2-CB 4.19Å; I46-E53 HydrophobicContact CG2-CB 3.98Å; I46-F56 HydrophobicContact CD1-CB 4.13Å; I46-F56 VanDerWaalsContact CD1-O 3.25Å; I46-F56 WeakPolarHBondContact CD1-O 3.18Å
47	R	85.2	Confident	86.4	Confident	164 Å²	164	63.9 Å²	63.9	62%	0.619	34%	0.337	S	S	*	.			trans	-78.2	127.9	177.9	-169.3	178.9	-175.5	-179.5	3.2	109.5	G31 S50	G31-R47 PolarHBondContact O-N 3.02Å; R47-S50 WeakPolarHBondContact O-CB 3.39Å; R47-S50 PolarHBondContact O-N 3.19Å; R47-S50 PolarHBondContact O-OG 3.27Å
48	P	83	Confident	86.8	Confident	108 Å²	108	61.2 Å²	61.2	70%	0.701	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	139.4	174.5	-22.8	33	0	0	0	111.6
49	G	83.7	Confident	87.3	Confident	46 Å²	46	59.7 Å²	59.7	47%	0.474	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	18.5	-176.8	0	0	0	0	0	114.7	R28 E53	R28-G49 WeakPolarHBondContact CD-O 3.45Å; G49-E53 WeakPolarHBondContact CA-OE2 3.31Å; G49-E53 PolarHBondContact N-OE2 3.21Å
50	S	89.4	Confident	87.9	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.292	C	S	.	.	S	Bend	trans	-104.3	164.1	-180	72.7	0	0	0	0	112.8	S29 F30 R47 A52 E53	S29-S50 WeakPolarHBondContact O-CA 3.41Å; S29-S50 VanDerWaalsContact O-CB 3.26Å; S29-S50 WeakPolarHBondContact O-CB 3.45Å; F30-S50 PolarHBondContact O-OG 2.75Å; R47-S50 WeakPolarHBondContact O-CB 3.39Å; R47-S50 PolarHBondContact O-N 3.19Å; R47-S50 PolarHBondContact O-OG 3.27Å; S50-A52 PolarHBondContact O-N 2.8Å; S50-E53 WeakPolarHBondContact O-CB 3.45Å; S50-E53 PolarHBondContact O-N 3.38Å; S50-E53 VanDerWaalsContact O-N 3.16Å
51	I	86.7	Confident	88.3	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.015	29%	0.286	C	S	.	.	H	α-helix	trans	-59.4	-34.2	176.3	-56.6	172.9	0	0	0	110.7	I21 V23 D26 R28 S29 F30 E53 D54 H55	I21-I51 HydrophobicContact CG2-CG2 3.64Å; V23-I51 HydrophobicContact CG1-CD1 3.98Å; D26-I51 HydrophobicContact CB-CD1 3.79Å; D26-I51 HydrophobicContact CB-CG1 4.11Å; R28-I51 HydrophobicContact CB-CG1 4.08Å; R28-I51 WeakPolarHBondContact O-CD1 3.49Å; S29-I51 PolarHBondContact O-N 3.11Å; F30-I51 HydrophobicContact CD2-CB 4.38Å; F30-I51 HydrophobicContact CD2-CG2 4.43Å; I51-E53 PolarHBondContact O-N 3.12Å; I51-D54 PolarHBondContact O-N 3.2Å; I51-H55 PolarHBondContact O-CD2 3.45Å
52	A	89.2	Confident	88.5	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.4	-25.8	-179.9	0	0	0	0	0	114	F30 L32 I46 S50 D54 H55 F56	F30-A52 WeakPolarHBondContact O-CB 3.36Å; F30-A52 PolarHBondContact O-N 2.96Å; L32-A52 HydrophobicContact CB-CB 3.9Å; L32-A52 HydrophobicContact CD1-CB 3.79Å; L32-A52 HydrophobicContact CG-CB 4.47Å; I46-A52 HydrophobicContact CG2-CB 4.19Å; S50-A52 PolarHBondContact O-N 2.8Å; A52-D54 VanDerWaalsContact C-N 3.3Å; A52-D54 PolarHBondContact O-N 3.2Å; A52-H55 PolarHBondContact O-N 3.35Å; A52-F56 HydrophobicContact CB-CD2 4Å; A52-F56 PolarHBondContact O-N 2.87Å
53	E	88.3	Confident	88.4	Confident	100 Å²	100	56.5 Å²	56.5	47%	0.467	29%	0.289	S	S	.	.	H	α-helix	trans	-65.5	-34	179	-172.4	171.7	-153.5	0	0	112.4	I46 G49 S50 I51 H55	I46-E53 HydrophobicContact CG2-CB 3.98Å; G49-E53 WeakPolarHBondContact CA-OE2 3.31Å; G49-E53 PolarHBondContact N-OE2 3.21Å; S50-E53 WeakPolarHBondContact O-CB 3.45Å; S50-E53 PolarHBondContact O-N 3.38Å; S50-E53 VanDerWaalsContact O-N 3.16Å; I51-E53 PolarHBondContact O-N 3.12Å; E53-H55 VanDerWaalsContact C-N 3.3Å; E53-H55 PolarHBondContact O-N 3.26Å
54	D	87.9	Confident	88.3	Confident	98 Å²	98	58.1 Å²	58.1	52%	0.524	30%	0.297	S	S	.	.	H	α-helix	trans	-76.3	-19.6	-179.3	-61.1	-28.6	0	0	0	112.5	R28 I51 A52	R28-D54 IonicContact CZ-OD2 2.78Å; R28-D54 IonicContact NH1-OD2 3.29Å; R28-D54 PolarHBondContact NH1-OD2 3.27Å; R28-D54 VanDerWaalsContact NH1-OD2 3.09Å; R28-D54 IonicContact NH2-OD2 2.65Å; R28-D54 PolarHBondContact NH2-OD2 3.39Å; I51-D54 PolarHBondContact O-N 3.2Å; A52-D54 VanDerWaalsContact C-N 3.3Å; A52-D54 PolarHBondContact O-N 3.2Å
55	H	89.8	Confident	88.2	Confident	62 Å²	62	56.6 Å²	56.6	29%	0.287	29%	0.287	S	S	.	.	H	α-helix	trans	-121.3	-33	-167.6	-65.5	-67.4	0	0	0	115.1	L19 I21 I51 A52 E53	L19-H55 HydrophobicContact CD1-CB 4.42Å; L19-H55 WeakPolarHBondContact CD1-O 3.41Å; I21-H55 HydrophobicContact CD1-CB 3.95Å; I21-H55 HydrophobicContact CG1-CB 4.3Å; I51-H55 PolarHBondContact O-CD2 3.45Å; A52-H55 PolarHBondContact O-N 3.35Å; E53-H55 VanDerWaalsContact C-N 3.3Å; E53-H55 PolarHBondContact O-N 3.26Å
56	F	92	Very high	88.2	Confident	8 Å²	8	56.3 Å²	56.3	4%	0.035	28%	0.281	C	S	.	.			trans	-110.7	152.8	-174.6	-64.2	-87	0	0	0	112	L19 I21 F30 L32 V43 I46 A52 I62 V88 V90	L19-F56 HydrophobicContact CD1-CD1 3.99Å; L19-F56 HydrophobicContact CD1-CE1 3.81Å; L19-F56 HydrophobicContact CD1-CG 4.49Å; L19-F56 HydrophobicContact CD1-CZ 4.17Å; I21-F56 HydrophobicContact CD1-CE2 3.5Å; I21-F56 VanDerWaalsContact CD1-CE2 3.5Å; I21-F56 HydrophobicContact CD1-CZ 3.82Å; F30-F56 HydrophobicContact CE1-CE2 4.41Å; F30-F56 AromaticContact CZ-CE2 3.86Å; F30-F56 HydrophobicContact CZ-CE2 3.86Å; F30-F56 HydrophobicContact CZ-CZ 4.37Å; L32-F56 HydrophobicContact CD1-CB 4.02Å; L32-F56 HydrophobicContact CD1-CD1 4.34Å; L32-F56 HydrophobicContact CD1-CD2 3.82Å; L32-F56 HydrophobicContact CD1-CE2 4.37Å; L32-F56 HydrophobicContact CD1-CG 3.8Å; L32-F56 HydrophobicContact CD2-CD2 4.45Å; L32-F56 HydrophobicContact CD2-CE1 4.41Å; L32-F56 HydrophobicContact CD2-CE2 4.2Å; L32-F56 HydrophobicContact CD2-CZ 4.18Å; V43-F56 HydrophobicContact CG2-CB 4.32Å; V43-F56 HydrophobicContact CG2-CD1 3.92Å; V43-F56 HydrophobicContact CG2-CG 4.37Å; I46-F56 HydrophobicContact CD1-CB 4.13Å; I46-F56 VanDerWaalsContact CD1-O 3.25Å; I46-F56 WeakPolarHBondContact CD1-O 3.18Å; A52-F56 HydrophobicContact CB-CD2 4Å; A52-F56 PolarHBondContact O-N 2.87Å; F56-I62 HydrophobicContact CE1-CD1 4.37Å; F56-I62 HydrophobicContact CE1-CG1 4.41Å; F56-V88 HydrophobicContact CE1-CG1 4.03Å; F56-V88 HydrophobicContact CZ-CB 4.39Å; F56-V88 HydrophobicContact CZ-CG1 4.11Å; F56-V88 HydrophobicContact CZ-CG2 4.43Å; F56-V90 HydrophobicContact CD1-CG1 4.04Å; F56-V90 HydrophobicContact CE1-CG1 3.74Å
57	K	89.5	Confident	87.8	Confident	126 Å²	126	57.5 Å²	57.5	55%	0.548	30%	0.303	S	S	.	.			trans	-112.3	157	165.4	-67.6	-172.4	-170.8	179.6	0	110.3	Y59 D60	K57-Y59 PolarHBondContact O-N 3.41Å; K57-D60 PolarHBondContact N-OD2 2.81Å; K57-D60 WeakPolarHBondContact O-CB 3.43Å; K57-D60 PolarHBondContact O-N 3.4Å
58	L	86.3	Confident	87.7	Confident	86 Å²	86	52.3 Å²	52.3	45%	0.45	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	136.9	175.4	-146	80.5	0	0	0	109.3	D60	L58-D60 VanDerWaalsContact C-N 3.28Å; L58-D60 PolarHBondContact O-N 3.25Å
59	Y	86.6	Confident	87.8	Confident	165 Å²	165	57 Å²	57	65%	0.647	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.8	5.7	-176.9	-50.1	-71.6	0	0	0	117.3	F42 V43 K57 V61	F42-Y59 HydrophobicContact CD2-CD1 4.08Å; F42-Y59 HydrophobicContact CE2-CD1 4.16Å; F42-Y59 HydrophobicContact CE2-CE1 4.44Å; V43-Y59 WeakPolarHBondContact O-CA 3.48Å; V43-Y59 PolarHBondContact O-N 2.95Å; K57-Y59 PolarHBondContact O-N 3.41Å; Y59-V61 PolarHBondContact O-N 2.84Å
60	D	90.5	Very high	87.7	Confident	3 Å²	3	55.2 Å²	55.2	2%	0.016	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-56.2	135.7	167.5	-77	-10.8	0	0	0	110.4	F42 V43 K57 L58 V90 R92	F42-D60 CarbonylContact C-O 3.53Å; F42-D60 WeakPolarHBondContact CA-O 3.25Å; F42-D60 WeakPolarHBondContact CB-O 3.48Å; V43-D60 HydrophobicContact CB-CB 4.5Å; V43-D60 HydrophobicContact CG2-CB 4.03Å; V43-D60 PolarHBondContact N-O 2.88Å; K57-D60 PolarHBondContact N-OD2 2.81Å; K57-D60 WeakPolarHBondContact O-CB 3.43Å; K57-D60 PolarHBondContact O-N 3.4Å; L58-D60 VanDerWaalsContact C-N 3.28Å; L58-D60 PolarHBondContact O-N 3.25Å; D60-V90 HydrophobicContact CB-CB 4.35Å; D60-R92 WeakPolarHBondContact OD1-CG 3.24Å; D60-R92 IonicContact OD1-CZ 3.5Å; D60-R92 IonicContact OD1-NE 3.46Å; D60-R92 PolarHBondContact OD1-NE 3.28Å; D60-R92 IonicContact OD1-NH2 3.43Å; D60-R92 IonicContact OD2-CZ 2.83Å; D60-R92 IonicContact OD2-NE 3.39Å; D60-R92 PolarHBondContact OD2-NE 3.36Å; D60-R92 IonicContact OD2-NH2 2.76Å; D60-R92 PolarHBondContact OD2-NH2 3.27Å
61	V	89.5	Confident	87.2	Confident	32 Å²	32	60.5 Å²	60.5	19%	0.194	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	119.3	178.6	177.6	0	0	0	0	109.6	N40 F42 Y59 K63 V90 E91	N40-V61 HydrophobicContact CB-CG1 3.88Å; F42-V61 HydrophobicContact CB-CG2 4.33Å; Y59-V61 PolarHBondContact O-N 2.84Å; V61-K63 HydrophobicContact CG1-CD 4.3Å; V61-V90 CarbonylContact O-C 3.5Å; V61-V90 VanDerWaalsContact O-CA 3.24Å; V61-V90 WeakPolarHBondContact O-CA 3.21Å; V61-E91 HydrophobicContact CB-CB 4.17Å; V61-E91 PolarHBondContact N-O 2.62Å; V61-E91 PolarHBondContact O-N 2.91Å
62	I	90.8	Very high	86.9	Confident	2 Å²	2	62 Å²	62	1%	0.01	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	119	179.9	-57.2	172.1	0	0	0	108.9	L32 I34 V41 V43 F56 V65 I70 V88 V90	L32-I62 HydrophobicContact CD2-CD1 4.02Å; I34-I62 HydrophobicContact CG2-CD1 4Å; V41-I62 PolarHBondContact O-N 2.81Å; V43-I62 HydrophobicContact CG2-CD1 4.25Å; V43-I62 HydrophobicContact CG2-CG1 4.41Å; F56-I62 HydrophobicContact CE1-CD1 4.37Å; F56-I62 HydrophobicContact CE1-CG1 4.41Å; I62-V65 HydrophobicContact CG2-CG2 4.05Å; I62-I70 HydrophobicContact CG2-CG1 4.31Å; I62-V88 HydrophobicContact CG2-CG1 3.77Å; I62-V90 HydrophobicContact CG1-CG1 4.2Å
63	K	89.6	Confident	86.5	Confident	46 Å²	46	66.5 Å²	66.5	20%	0.2	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-44	-179.4	-69.5	-61.3	-173.3	-178.2	0	113.1	N40 V61 I70 T89 E91	N40-K63 PolarHBondContact OD1-NZ 3.14Å; V61-K63 HydrophobicContact CG1-CD 4.3Å; K63-I70 PolarHBondContact O-N 3.48Å; K63-T89 PolarHBondContact N-O 3.01Å; K63-E91 VanDerWaalsContact CE-OE1 3.31Å; K63-E91 WeakPolarHBondContact CE-OE1 3.46Å; K63-E91 WeakPolarHBondContact CE-OE2 3.38Å; K63-E91 HydrophobicContact CG-CG 4.19Å; K63-E91 IonicContact NZ-OE2 3.65Å; K63-E91 PolarHBondContact NZ-OE2 2.95Å
64	D	88.4	Confident	86.2	Confident	34 Å²	34	66.7 Å²	66.7	18%	0.182	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	154.4	178.2	61.8	76.1	0	0	0	112.3	S68 V88 T89	D64-S68 VanDerWaalsContact CA-O 3.25Å; D64-S68 WeakPolarHBondContact CA-O 3.06Å; D64-S68 WeakPolarHBondContact CB-O 3.47Å; D64-V88 WeakPolarHBondContact O-CA 3.26Å; D64-T89 VanDerWaalsContact CG-CB 3.42Å; D64-T89 PolarHBondContact O-N 3.32Å; D64-T89 VanDerWaalsContact O-N 3.07Å; D64-T89 WeakPolarHBondContact OD1-CB 3.35Å; D64-T89 PolarHBondContact OD1-N 3.03Å; D64-T89 PolarHBondContact OD1-OG1 2.7Å; D64-T89 WeakPolarHBondContact OD2-CB 3.45Å; D64-T89 PolarHBondContact OD2-OG1 3.16Å
65	V	87.6	Confident	86.1	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	120.6	170.2	179.5	0	0	0	0	107.3	I62 G67 S68 I70 L79 L86 T87 V88	I62-V65 HydrophobicContact CG2-CG2 4.05Å; V65-G67 PolarHBondContact O-N 3.32Å; V65-S68 PolarHBondContact N-O 3.08Å; V65-S68 WeakPolarHBondContact O-CB 3.49Å; V65-S68 PolarHBondContact O-N 3.38Å; V65-I70 HydrophobicContact CB-CD1 4.1Å; V65-I70 HydrophobicContact CB-CG1 4.41Å; V65-I70 HydrophobicContact CG2-CD1 3.92Å; V65-I70 HydrophobicContact CG2-CG1 3.86Å; V65-L79 HydrophobicContact CB-CB 4.32Å; V65-L79 HydrophobicContact CB-CD1 4.17Å; V65-L79 HydrophobicContact CG1-CB 3.92Å; V65-L86 HydrophobicContact CG1-CD2 3.84Å; V65-T87 CarbonylContact C-O 3.6Å; V65-T87 WeakPolarHBondContact CA-O 3.36Å; V65-V88 HydrophobicContact CG1-CG2 4.36Å; V65-V88 HydrophobicContact CG2-CG1 4.23Å; V65-V88 HydrophobicContact CG2-CG2 4.27Å
66	N	87.1	Confident	85.8	Confident	56 Å²	56	62 Å²	62	30%	0.299	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.6	37.9	-175	-65.7	-12.6	0	0	0	112.7	S68 H83 V85 L86 T87	N66-S68 PolarHBondContact O-N 3.5Å; N66-H83 VanDerWaalsContact ND2-CG 3.3Å; N66-V85 PolarHBondContact ND2-O 3.34Å; N66-L86 WeakPolarHBondContact OD1-CA 3.33Å; N66-T87 PolarHBondContact N-O 3.07Å; N66-T87 PolarHBondContact OD1-N 3.47Å
67	G	81.8	Confident	85.5	Confident	68 Å²	68	66 Å²	66	70%	0.701	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	-7.5	-177.5	0	0	0	0	0	115.3	V65	V65-G67 PolarHBondContact O-N 3.32Å
68	S	83.1	Confident	85.2	Confident	55 Å²	55	64.2 Å²	64.2	39%	0.385	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	119.4	173.1	-64	0	0	0	0	110.3	D64 V65 N66 I70	D64-S68 VanDerWaalsContact CA-O 3.25Å; D64-S68 WeakPolarHBondContact CA-O 3.06Å; D64-S68 WeakPolarHBondContact CB-O 3.47Å; V65-S68 PolarHBondContact N-O 3.08Å; V65-S68 WeakPolarHBondContact O-CB 3.49Å; V65-S68 PolarHBondContact O-N 3.38Å; N66-S68 PolarHBondContact O-N 3.5Å; S68-I70 PolarHBondContact O-N 3.08Å
69	R	85.1	Confident	85.2	Confident	206 Å²	206	61.1 Å²	61.1	78%	0.777	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.5	130	175.4	-170.2	179.7	-175.2	-161.7	1.7	110.1
70	I	82.2	Confident	85.1	Confident	9 Å²	9	54.7 Å²	54.7	5%	0.046	28%	0.281	C	S	.	.			trans	-91.9	115.8	-179.2	-58.3	-56	0	0	0	110.1	V41 I62 K63 V65 S68 S72 L75 C76 L79	V41-I70 HydrophobicContact CB-CG2 4.1Å; V41-I70 HydrophobicContact CG2-CG2 3.52Å; I62-I70 HydrophobicContact CG2-CG1 4.31Å; K63-I70 PolarHBondContact O-N 3.48Å; V65-I70 HydrophobicContact CB-CD1 4.1Å; V65-I70 HydrophobicContact CB-CG1 4.41Å; V65-I70 HydrophobicContact CG2-CD1 3.92Å; V65-I70 HydrophobicContact CG2-CG1 3.86Å; S68-I70 PolarHBondContact O-N 3.08Å; I70-S72 WeakPolarHBondContact CG2-O 3.27Å; I70-L75 HydrophobicContact CD1-CD2 4.41Å; I70-L75 HydrophobicContact CD1-CG 4.28Å; I70-C76 HydrophobicContact CD1-CB 4.24Å; I70-C76 HydrophobicContact CG1-CB 4.46Å; I70-C76 HydrophobicContact CG2-CB 3.63Å; I70-L79 HydrophobicContact CD1-CD1 3.56Å
71	D	79.5	Confident	84.7	Confident	112 Å²	112	63.8 Å²	63.8	60%	0.599	32%	0.315	S	S	*	.			trans	-109.4	-24.1	175.6	58.4	-1.4	0	0	0	113.4	L75	D71-L75 WeakPolarHBondContact OD1-CD2 3.34Å
72	S	81.2	Confident	84.4	Confident	34 Å²	34	67.2 Å²	67.2	24%	0.238	34%	0.336	C	S	.	.	S	Bend	trans	-129.6	154.9	-176.3	59.6	0	0	0	0	111.9	I70 E74 L75 C76	I70-S72 WeakPolarHBondContact CG2-O 3.27Å; S72-E74 VanDerWaalsContact C-N 3.27Å; S72-E74 PolarHBondContact O-N 2.88Å; S72-L75 WeakPolarHBondContact OG-CB 3.42Å; S72-L75 PolarHBondContact OG-N 3.48Å; S72-C76 PolarHBondContact O-N 2.76Å
73	R	80.2	Confident	83.9	Confident	95 Å²	95	70.7 Å²	70.7	36%	0.358	35%	0.352	S	S	.	.	H	α-helix	trans	-69.5	-34	-180	-177.6	-175.7	-175.2	-163.2	-0	110.4	I34 I36 R77	I34-R73 HydrophobicContact CD1-CG 3.83Å; I34-R73 HydrophobicContact CG1-CG 4.01Å; I34-R73 PolarHBondContact O-NE 3.1Å; I36-R73 HydrophobicContact CD1-CB 3.75Å; I36-R73 HydrophobicContact CG1-CB 4.08Å; R73-R77 WeakPolarHBondContact O-CB 3.43Å; R73-R77 PolarHBondContact O-N 3.21Å; R73-R77 VanDerWaalsContact O-N 3.08Å
74	E	81.9	Confident	83.5	Confident	104 Å²	104	75.1 Å²	75.1	49%	0.486	37%	0.371	S	S	.	.	H	α-helix	trans	-65.8	-52.2	-179.7	-66.3	62.7	-136	0	0	109.7	S72 C76 R77 D78	S72-E74 VanDerWaalsContact C-N 3.27Å; S72-E74 PolarHBondContact O-N 2.88Å; E74-C76 VanDerWaalsContact C-N 3.32Å; E74-C76 PolarHBondContact O-N 2.76Å; E74-R77 PolarHBondContact O-N 3.44Å; E74-R77 VanDerWaalsContact O-N 3.08Å; E74-D78 PolarHBondContact O-N 3.13Å
75	L	85.1	Confident	83.3	Confident	62 Å²	62	77.4 Å²	77.4	33%	0.325	39%	0.387	S	S	.	.	H	α-helix	trans	-57.7	-43.2	177.3	-177.3	64.5	0	0	0	112.3	I70 D71 S72 R77 D78 L79	I70-L75 HydrophobicContact CD1-CD2 4.41Å; I70-L75 HydrophobicContact CD1-CG 4.28Å; D71-L75 WeakPolarHBondContact OD1-CD2 3.34Å; S72-L75 WeakPolarHBondContact OG-CB 3.42Å; S72-L75 PolarHBondContact OG-N 3.48Å; L75-R77 PolarHBondContact O-N 2.72Å; L75-D78 PolarHBondContact O-N 3.27Å; L75-L79 HydrophobicContact CD1-CD1 4.15Å; L75-L79 HydrophobicContact CD1-CG 4.31Å; L75-L79 HydrophobicContact CG-CD1 4.03Å; L75-L79 WeakPolarHBondContact O-CB 3.3Å; L75-L79 WeakPolarHBondContact O-CG 3.28Å; L75-L79 PolarHBondContact O-N 2.83Å
76	C	84.7	Confident	83.2	Confident	0 Å²	0	77.4 Å²	77.4	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-60.5	-46	176.2	-167.9	0	0	0	0	111.8	I34 I70 S72 E74 D78 L79 I80	I34-C76 HydrophobicContact CD1-CB 3.78Å; I70-C76 HydrophobicContact CD1-CB 4.24Å; I70-C76 HydrophobicContact CG1-CB 4.46Å; I70-C76 HydrophobicContact CG2-CB 3.63Å; S72-C76 PolarHBondContact O-N 2.76Å; E74-C76 VanDerWaalsContact C-N 3.32Å; E74-C76 PolarHBondContact O-N 2.76Å; C76-D78 VanDerWaalsContact C-N 3.33Å; C76-D78 PolarHBondContact O-N 3.33Å; C76-L79 PolarHBondContact O-N 2.89Å; C76-I80 WeakPolarHBondContact O-CD1 3.49Å; C76-I80 VanDerWaalsContact O-CG1 3.27Å; C76-I80 WeakPolarHBondContact O-CG1 3.31Å; C76-I80 PolarHBondContact O-N 3.43Å; C76-I80 VanDerWaalsContact O-N 3.14Å
77	R	84.4	Confident	83.2	Confident	91 Å²	91	77.2 Å²	77.2	34%	0.343	39%	0.387	S	S	.	.	H	α-helix	trans	-66.2	-37.4	-179.5	-171.7	-178.7	-80.4	141.1	-11.1	111.4	R73 E74 L75 R81	R73-R77 WeakPolarHBondContact O-CB 3.43Å; R73-R77 PolarHBondContact O-N 3.21Å; R73-R77 VanDerWaalsContact O-N 3.08Å; E74-R77 PolarHBondContact O-N 3.44Å; E74-R77 VanDerWaalsContact O-N 3.08Å; L75-R77 PolarHBondContact O-N 2.72Å; R77-R81 WeakPolarHBondContact O-CB 3.28Å; R77-R81 VanDerWaalsContact O-CG 3.28Å; R77-R81 WeakPolarHBondContact O-CG 3.36Å; R77-R81 PolarHBondContact O-N 2.79Å; R77-R81 VanDerWaalsContact O-N 3.13Å
78	D	84.6	Confident	83.6	Confident	88 Å²	88	74 Å²	74	47%	0.471	35%	0.354	S	S	.	.	H	α-helix	trans	-71.8	-41.7	179.2	-69.1	-16.5	0	0	0	111.7	E74 L75 C76 I80 R81 T82	E74-D78 PolarHBondContact O-N 3.13Å; L75-D78 PolarHBondContact O-N 3.27Å; C76-D78 VanDerWaalsContact C-N 3.33Å; C76-D78 PolarHBondContact O-N 3.33Å; D78-I80 PolarHBondContact O-N 2.74Å; D78-R81 PolarHBondContact O-N 2.84Å; D78-T82 WeakPolarHBondContact O-CB 3.46Å; D78-T82 PolarHBondContact O-N 2.88Å; D78-T82 PolarHBondContact O-OG1 3.46Å
79	L	85.8	Confident	83.9	Confident	22 Å²	22	72 Å²	72	12%	0.115	34%	0.339	C	S	.	.	H	α-helix	trans	-64	-41.6	177	-74.1	171.1	0	0	0	112.4	V65 I70 L75 C76 R81 H83	V65-L79 HydrophobicContact CB-CB 4.32Å; V65-L79 HydrophobicContact CB-CD1 4.17Å; V65-L79 HydrophobicContact CG1-CB 3.92Å; I70-L79 HydrophobicContact CD1-CD1 3.56Å; L75-L79 HydrophobicContact CD1-CD1 4.15Å; L75-L79 HydrophobicContact CD1-CG 4.31Å; L75-L79 HydrophobicContact CG-CD1 4.03Å; L75-L79 WeakPolarHBondContact O-CB 3.3Å; L75-L79 WeakPolarHBondContact O-CG 3.28Å; L75-L79 PolarHBondContact O-N 2.83Å; C76-L79 PolarHBondContact O-N 2.89Å; L79-R81 VanDerWaalsContact C-N 3.34Å; L79-H83 PolarHBondContact O-N 2.91Å; L79-H83 PolarHBondContact O-ND1 2.76Å
80	I	84	Confident	84.2	Confident	30 Å²	30	62.1 Å²	62.1	15%	0.154	30%	0.302	C	S	.	.	H	α-helix	trans	-66.6	-34.8	177.1	-67.7	168.4	0	0	0	111.6	F30 L32 C76 D78 L86	F30-I80 HydrophobicContact CD1-CG2 3.78Å; F30-I80 HydrophobicContact CD2-CG2 4.38Å; F30-I80 HydrophobicContact CE1-CD1 3.98Å; F30-I80 HydrophobicContact CE1-CG2 3.72Å; F30-I80 HydrophobicContact CE2-CG2 4.34Å; F30-I80 HydrophobicContact CG-CG2 4.12Å; F30-I80 HydrophobicContact CZ-CD1 4.41Å; F30-I80 HydrophobicContact CZ-CG2 4.02Å; L32-I80 HydrophobicContact CD2-CD1 4.46Å; C76-I80 WeakPolarHBondContact O-CD1 3.49Å; C76-I80 VanDerWaalsContact O-CG1 3.27Å; C76-I80 WeakPolarHBondContact O-CG1 3.31Å; C76-I80 PolarHBondContact O-N 3.43Å; C76-I80 VanDerWaalsContact O-N 3.14Å; D78-I80 PolarHBondContact O-N 2.74Å; I80-L86 HydrophobicContact CB-CD1 4.44Å; I80-L86 HydrophobicContact CG1-CD1 4.35Å; I80-L86 HydrophobicContact CG2-CD1 4.11Å
81	R	82.3	Confident	84.6	Confident	193 Å²	193	63.6 Å²	63.6	73%	0.728	31%	0.309	S	S	*	.	H	α-helix	trans	-76.4	-37.3	178.4	-78.5	176.9	172.8	-172.1	-3.8	112.9	R77 D78 L79	R77-R81 WeakPolarHBondContact O-CB 3.28Å; R77-R81 VanDerWaalsContact O-CG 3.28Å; R77-R81 WeakPolarHBondContact O-CG 3.36Å; R77-R81 PolarHBondContact O-N 2.79Å; R77-R81 VanDerWaalsContact O-N 3.13Å; D78-R81 PolarHBondContact O-N 2.84Å; L79-R81 VanDerWaalsContact C-N 3.34Å
82	T	83	Confident	84.9	Confident	104 Å²	104	60.4 Å²	60.4	64%	0.638	29%	0.288	S	S	*	.	H	α-helix	trans	-76.4	-34.9	-173.9	-47.2	0	0	0	0	111.9	D78	D78-T82 WeakPolarHBondContact O-CB 3.46Å; D78-T82 PolarHBondContact O-N 2.88Å; D78-T82 PolarHBondContact O-OG1 3.46Å
83	H	80.8	Confident	84.7	Confident	75 Å²	75	64.1 Å²	64.1	35%	0.347	30%	0.302	S	S	.	.			trans	-104	132.3	-174.6	-59.3	87.9	0	0	0	112.5	N66 L79 L86	N66-H83 VanDerWaalsContact ND2-CG 3.3Å; L79-H83 PolarHBondContact O-N 2.91Å; L79-H83 PolarHBondContact O-ND1 2.76Å; H83-L86 HydrophobicContact CB-CD2 3.79Å
84	K	80.2	Confident	84	Confident	140 Å²	140	64.7 Å²	64.7	61%	0.609	31%	0.311	S	S	*	.	S	Bend	trans	-86.5	-13.1	176	-62.9	-171.6	179	-178.3	0	113.7	V23 R24	V23-K84 WeakPolarHBondContact CA-O 3.47Å; V23-K84 WeakPolarHBondContact CB-O 3.49Å; V23-K84 PolarHBondContact N-O 3.46Å; R24-K84 HydrophobicContact CB-CB 4.22Å; R24-K84 HydrophobicContact CG-CD 4.44Å; R24-K84 PolarHBondContact N-O 2.88Å
85	V	84.1	Confident	82.5	Confident	82 Å²	82	64.8 Å²	64.8	50%	0.497	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.9	172.1	-176.2	0	0	0	0	106.6	I21 N66	I21-V85 WeakPolarHBondContact O-CA 3.22Å; N66-V85 PolarHBondContact ND2-O 3.34Å
86	L	86.6	Confident	80.5	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	128.2	-171.8	-62	163.6	0	0	0	109.2	N20 I21 V23 F30 V65 N66 I80 H83 V88	N20-L86 CarbonylContact C-O 3.51Å; N20-L86 WeakPolarHBondContact CA-O 3.44Å; I21-L86 HydrophobicContact CB-CB 4.37Å; I21-L86 PolarHBondContact N-O 3.44Å; I21-L86 PolarHBondContact O-N 2.99Å; V23-L86 HydrophobicContact CG2-CD1 4Å; F30-L86 HydrophobicContact CE2-CD1 3.89Å; F30-L86 HydrophobicContact CZ-CD1 4.23Å; V65-L86 HydrophobicContact CG1-CD2 3.84Å; N66-L86 WeakPolarHBondContact OD1-CA 3.33Å; I80-L86 HydrophobicContact CB-CD1 4.44Å; I80-L86 HydrophobicContact CG1-CD1 4.35Å; I80-L86 HydrophobicContact CG2-CD1 4.11Å; H83-L86 HydrophobicContact CB-CD2 3.79Å; L86-V88 HydrophobicContact CB-CG2 4.08Å
87	T	87	Confident	78	Confident	51 Å²	51	78.2 Å²	78.2	31%	0.313	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	114.3	163	-60.8	0	0	0	0	107.1	I18 L19 N20 V65 N66	I18-T87 HydrophobicContact CG2-CG2 3.54Å; L19-T87 CarbonylContact O-C 3.59Å; L19-T87 WeakPolarHBondContact O-CA 3.49Å; N20-T87 WeakPolarHBondContact OD1-CG2 2.99Å; N20-T87 PolarHBondContact OD1-OG1 3.42Å; V65-T87 CarbonylContact C-O 3.6Å; V65-T87 WeakPolarHBondContact CA-O 3.36Å; N66-T87 PolarHBondContact N-O 3.07Å; N66-T87 PolarHBondContact OD1-N 3.47Å
88	V	90.5	Very high	75.3	Confident	2 Å²	2	81.1 Å²	81.1	1%	0.012	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	121.6	-174.6	-174.4	0	0	0	0	109.3	L19 F56 I62 D64 V65 L86 V90	L19-V88 HydrophobicContact CB-CB 4.44Å; L19-V88 WeakPolarHBondContact CB-O 3.47Å; L19-V88 PolarHBondContact N-O 3.34Å; L19-V88 PolarHBondContact O-N 2.84Å; F56-V88 HydrophobicContact CE1-CG1 4.03Å; F56-V88 HydrophobicContact CZ-CB 4.39Å; F56-V88 HydrophobicContact CZ-CG1 4.11Å; F56-V88 HydrophobicContact CZ-CG2 4.43Å; I62-V88 HydrophobicContact CG2-CG1 3.77Å; D64-V88 WeakPolarHBondContact O-CA 3.26Å; V65-V88 HydrophobicContact CG1-CG2 4.36Å; V65-V88 HydrophobicContact CG2-CG1 4.23Å; V65-V88 HydrophobicContact CG2-CG2 4.27Å; L86-V88 HydrophobicContact CB-CG2 4.08Å; V88-V90 HydrophobicContact CG1-CG1 4.06Å
89	T	89.5	Confident	72.5	Confident	11 Å²	11	85.6 Å²	85.6	7%	0.067	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	122.8	173.9	-51.8	0	0	0	0	110.1	R16 I17 I18 K63 D64	R16-T89 HydrophobicContact CG-CG2 3.47Å; R16-T89 VanDerWaalsContact CG-CG2 3.47Å; I17-T89 CarbonylContact O-C 3.54Å; I17-T89 WeakPolarHBondContact O-CA 3.39Å; I18-T89 HydrophobicContact CG1-CG2 4.41Å; K63-T89 PolarHBondContact N-O 3.01Å; D64-T89 VanDerWaalsContact CG-CB 3.42Å; D64-T89 PolarHBondContact O-N 3.32Å; D64-T89 VanDerWaalsContact O-N 3.07Å; D64-T89 WeakPolarHBondContact OD1-CB 3.35Å; D64-T89 PolarHBondContact OD1-N 3.03Å; D64-T89 PolarHBondContact OD1-OG1 2.7Å; D64-T89 WeakPolarHBondContact OD2-CB 3.45Å; D64-T89 PolarHBondContact OD2-OG1 3.16Å
90	V	91.9	Very high	69.7	Low	0 Å²	0	93.2 Å²	93.2	0%	0	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	144.4	178.9	-61.8	0	0	0	0	111.8	R16 I17 L19 F56 D60 V61 I62 V88	R16-V90 CarbonylContact C-O 3.58Å; R16-V90 WeakPolarHBondContact CA-O 3.17Å; I17-V90 HydrophobicContact CB-CG2 3.91Å; I17-V90 PolarHBondContact N-O 3.08Å; I17-V90 PolarHBondContact O-N 3.29Å; L19-V90 HydrophobicContact CD1-CG1 3.94Å; L19-V90 HydrophobicContact CD1-CG2 3.78Å; L19-V90 HydrophobicContact CG-CG2 4.15Å; F56-V90 HydrophobicContact CD1-CG1 4.04Å; F56-V90 HydrophobicContact CE1-CG1 3.74Å; D60-V90 HydrophobicContact CB-CB 4.35Å; V61-V90 CarbonylContact O-C 3.5Å; V61-V90 VanDerWaalsContact O-CA 3.24Å; V61-V90 WeakPolarHBondContact O-CA 3.21Å; I62-V90 HydrophobicContact CG1-CG1 4.2Å; V88-V90 HydrophobicContact CG1-CG1 4.06Å
91	E	89.6	Confident	66.9	Low	40 Å²	40	97.8 Å²	97.8	19%	0.187	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124	170.1	-86.9	177.6	-165.8	0	0	109.3	V14 E15 R16 V61 K63	V14-E91 HydrophobicContact CG1-CB 3.51Å; V14-E91 HydrophobicContact CG1-CG 3.67Å; E15-E91 WeakPolarHBondContact O-CA 3.41Å; R16-E91 HydrophobicContact CB-CG 4.49Å; R16-E91 IonicContact CZ-OE1 2.74Å; R16-E91 IonicContact NE-OE1 2.96Å; R16-E91 PolarHBondContact NE-OE1 3.46Å; R16-E91 IonicContact NH2-OE1 3.31Å; R16-E91 PolarHBondContact NH2-OE1 3.29Å; V61-E91 HydrophobicContact CB-CB 4.17Å; V61-E91 PolarHBondContact N-O 2.62Å; V61-E91 PolarHBondContact O-N 2.91Å; K63-E91 VanDerWaalsContact CE-OE1 3.31Å; K63-E91 WeakPolarHBondContact CE-OE1 3.46Å; K63-E91 WeakPolarHBondContact CE-OE2 3.38Å; K63-E91 HydrophobicContact CG-CG 4.19Å; K63-E91 IonicContact NZ-OE2 3.65Å; K63-E91 PolarHBondContact NZ-OE2 2.95Å
92	R	86.7	Confident	64.3	Low	45 Å²	45	92.3 Å²	92.3	17%	0.17	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130.2	-177.6	-176.6	177.2	-67.9	157.4	1.7	110.6	V14 E15 I17 D60	V14-R92 WeakPolarHBondContact CA-O 3.45Å; E15-R92 PolarHBondContact N-O 3.25Å; E15-R92 PolarHBondContact O-N 3.26Å; I17-R92 HydrophobicContact CD1-CB 4.24Å; D60-R92 WeakPolarHBondContact OD1-CG 3.24Å; D60-R92 IonicContact OD1-CZ 3.5Å; D60-R92 IonicContact OD1-NE 3.46Å; D60-R92 PolarHBondContact OD1-NE 3.28Å; D60-R92 IonicContact OD1-NH2 3.43Å; D60-R92 IonicContact OD2-CZ 2.83Å; D60-R92 IonicContact OD2-NE 3.39Å; D60-R92 PolarHBondContact OD2-NE 3.36Å; D60-R92 IonicContact OD2-NH2 2.76Å; D60-R92 PolarHBondContact OD2-NH2 3.27Å
93	E	75.9	Confident	61.4	Low	112 Å²	112	97.1 Å²	97.1	52%	0.523	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	124.9	173.5	-64.6	-178.4	171.7	0	0	109.8	K12 V14 S95	K12-E93 HydrophobicContact CD-CG 4.29Å; K12-E93 WeakPolarHBondContact CD-OE1 3.33Å; K12-E93 WeakPolarHBondContact CD-OE2 3.26Å; K12-E93 IonicContact NZ-OE1 2.98Å; K12-E93 PolarHBondContact NZ-OE1 3.47Å; K12-E93 IonicContact NZ-OE2 2.72Å; K12-E93 PolarHBondContact NZ-OE2 3.04Å; V14-E93 HydrophobicContact CG2-CG 4.4Å; E93-S95 PolarHBondContact O-N 3.47Å
94	L	66	Low	58.8	Low	106 Å²	106	96.8 Å²	96.8	56%	0.555	53%	0.529	S	S	*	.			trans	-73.6	106.3	170.8	-89.3	124.3	0	0	0	109.5	V13 E15 K96	V13-L94 HydrophobicContact CG1-CD1 4.27Å; V13-L94 PolarHBondContact O-N 3.13Å; E15-L94 HydrophobicContact CB-CD1 3.96Å; L94-K96 PolarHBondContact O-N 3.14Å; L94-K96 VanDerWaalsContact O-N 3.12Å
95	S	49.6	Very low	56.2	Low	106 Å²	106	97.6 Å²	97.6	74%	0.741	54%	0.54	S	S	*	.			trans	-66.2	106.4	167.8	50.2	0	0	0	0	109.7	E93 N97	E93-S95 PolarHBondContact O-N 3.47Å; S95-N97 PolarHBondContact O-N 3.5Å
96	K	43	Very low	53.3	Low	185 Å²	185	105 Å²	105	80%	0.804	56%	0.558	S	S	*	*			trans	-62.4	124.7	164.8	-73.9	-176.6	178	-179.7	0	107.9	L94 I98	L94-K96 PolarHBondContact O-N 3.14Å; L94-K96 VanDerWaalsContact O-N 3.12Å; K96-I98 PolarHBondContact O-N 2.94Å
97	N	33	Very low	50.4	Low	159 Å²	159	114.8 Å²	114.8	85%	0.85	60%	0.601	S	S	*	*			trans	-57.5	112.1	171.9	-77.6	-24.1	0	0	0	108.6	S95 E99	S95-N97 PolarHBondContact O-N 3.5Å; N97-E99 PolarHBondContact O-N 2.91Å; N97-E99 VanDerWaalsContact O-N 3.14Å
98	I	27.9	Very low	47.5	Very low	153 Å²	153	118 Å²	118	79%	0.785	63%	0.625	S	S	*	*			trans	-79.2	91.7	175.9	-59.8	169.3	0	0	0	106.4	K96	K96-I98 PolarHBondContact O-N 2.94Å
99	E	26.3	Very low	44.6	Very low	182 Å²	182	122.9 Å²	122.9	85%	0.85	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-74.9	124.4	155	-78.7	-174.3	167.1	0	0	107.7	N97	N97-E99 PolarHBondContact O-N 2.91Å; N97-E99 VanDerWaalsContact O-N 3.14Å
100	Q	25.4	Very low	41.7	Very low	181 Å²	181	128.9 Å²	128.9	85%	0.846	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-65.6	138.9	-172.1	-71.1	177.6	-14.6	0	0	111.2
101	P	26.7	Very low	38.8	Very low	126 Å²	126	138.1 Å²	138.1	82%	0.818	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-88.2	118.7	-170.4	18.2	-3	0	0	0	111.3
102	G	26.2	Very low	35.7	Very low	78 Å²	78	142.1 Å²	142.1	80%	0.804	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-70.9	132.4	159.1	0	0	0	0	0	110.7
103	Q	23.8	Very low	33.3	Very low	205 Å²	205	146 Å²	146	96%	0.958	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-52.3	145.6	174.6	-74.1	164.3	-47.3	0	0	113.5
104	G	25	Very low	31	Very low	69 Å²	69	150.2 Å²	150.2	71%	0.711	81%	0.814	S	S	*	*			trans	153.5	85.6	156.2	0	0	0	0	0	116
105	D	25.2	Very low	29.2	Very low	157 Å²	157	153.6 Å²	153.6	84%	0.84	83%	0.832	S	S	*	*			trans	59.8	106.8	144.4	-64.5	-34.7	0	0	0	122.7
106	R	22.9	Very low	28.2	Very low	236 Å²	236	157.6 Å²	157.6	89%	0.891	84%	0.839	S	S	*	*				10.2	111.1	128.8	-71.1	176.6	174	177.6	-1.4	116.4
107	K	27.3	Very low	27.6	Very low	207 Å²	207	154.3 Å²	154.3	90%	0.9	83%	0.834	S	S	*	*				-165.6	126.3	113.1	-103.3	168.3	-172.5	-179.7	0	110.9
108	S	25.7	Very low	27.4	Very low	117 Å²	117	151.6 Å²	151.6	82%	0.818	83%	0.834	S	S	*	*			trans	-62.5	130.7	168.9	53.5	0	0	0	0	111.8
109	S	30.1	Very low	27.5	Very low	105 Å²	105	150.4 Å²	150.4	73%	0.734	83%	0.825	S	S	*	*			trans	-169.7	123.5	140.5	52.6	0	0	0	0	111
110	T	28.7	Very low	27.9	Very low	137 Å²	137	146 Å²	146	84%	0.84	81%	0.812	S	S	*	*			trans	66.2	79	149.2	49.2	0	0	0	0	118.3
111	E	29.9	Very low	28.7	Very low	195 Å²	195	142.1 Å²	142.1	91%	0.911	79%	0.793	S	S	*	*			trans	-86	137.5	145.2	-81.5	179.9	157.8	0	0	109.8
112	C	24	Very low	29.6	Very low	124 Å²	124	141.4 Å²	141.4	84%	0.838	79%	0.791	S	S	*	*			trans	-54.5	121.5	-175.1	-82.1	0	0	0	0	113.7	Y114	C112-Y114 PolarHBondContact O-N 2.62Å; C112-Y114 VanDerWaalsContact O-N 3.13Å
113	P	36.4	Very low	30.3	Very low	125 Å²	125	143.7 Å²	143.7	81%	0.812	78%	0.781	S	S	*	*			trans	-85.7	84	172	34.1	-28.9	0	0	0	108.9
114	Y	27.5	Very low	31.2	Very low	202 Å²	202	137.6 Å²	137.6	79%	0.792	75%	0.753	S	S	*	*			trans	-143.9	17.9	166.3	-141.9	-95.6	0	0	0	115.6	C112	C112-Y114 PolarHBondContact O-N 2.62Å; C112-Y114 VanDerWaalsContact O-N 3.13Å
115	L	27.9	Very low	32.1	Very low	177 Å²	177	140 Å²	140	93%	0.927	75%	0.746	S	S	*	*	S	Bend	trans	-122	10.7	176.5	-74	172.1	0	0	0	115.4
116	E	29.8	Very low	33.3	Very low	190 Å²	190	141.6 Å²	141.6	89%	0.888	75%	0.745	S	S	*	*	S	Bend	trans	-111.2	7.9	180	-88	-171.5	163.4	0	0	116.5
117	T	29.2	Very low	34.7	Very low	115 Å²	115	135.5 Å²	135.5	71%	0.706	73%	0.73	S	S	*	*			trans	-123.3	59.4	176.8	59.8	0	0	0	0	112.8	Q119	T117-Q119 VanDerWaalsContact C-N 3.32Å
118	A	29.1	Very low	36.3	Very low	102 Å²	102	130.7 Å²	130.7	84%	0.843	71%	0.711	S	S	*	*			trans	-97.7	67.1	150.6	0	0	0	0	0	107.7
119	Q	31.1	Very low	38.4	Very low	128 Å²	128	128.1 Å²	128.1	60%	0.598	68%	0.684	S	S	*	*			trans	-68.1	135.3	173.4	-77	-170.2	-40.1	0	0	109.4	T117 E123	T117-Q119 VanDerWaalsContact C-N 3.32Å; Q119-E123 PolarHBondContact NE2-OE2 3.48Å
120	P	33.9	Very low	40.4	Very low	90 Å²	90	126.9 Å²	126.9	58%	0.584	68%	0.675	S	S	*	*			trans	-58.8	147.2	175.5	4.2	-4.9	0	0	0	111.5	S122 E123	P120-S122 PolarHBondContact O-N 3.37Å; P120-E123 PolarHBondContact O-N 3.34Å
121	F	43.1	Very low	42.6	Very low	99 Å²	99	128.4 Å²	128.4	43%	0.434	67%	0.67	S	S	.	*	T	Hydrogen-bonded Turn	trans	-51.8	-0.1	-171.8	-165.8	-104.2	0	0	0	117.2	M124 W129 F144	F121-M124 HydrophobicContact CE2-CE 3.97Å; F121-M124 HydrophobicContact CE2-SD 4.3Å; F121-M124 HydrophobicContact CZ-CE 4.35Å; F121-W129 HydrophobicContact CZ-CE3 4.44Å; F121-W129 HydrophobicContact CZ-CH2 4.5Å; F121-W129 AromaticContact CZ-CZ3 3.84Å; F121-W129 HydrophobicContact CZ-CZ3 3.84Å; F121-F144 HydrophobicContact CB-CZ 4.26Å; F121-F144 HydrophobicContact CD1-CE2 4.4Å; F121-F144 HydrophobicContact CD1-CZ 4.23Å; F121-F144 AromaticContact CD2-CE2 3.72Å; F121-F144 HydrophobicContact CD2-CE2 3.72Å; F121-F144 AromaticContact CD2-CZ 3.53Å; F121-F144 HydrophobicContact CD2-CZ 3.53Å; F121-F144 HydrophobicContact CE1-CD2 4.46Å; F121-F144 HydrophobicContact CE1-CE2 4.18Å; F121-F144 HydrophobicContact CE1-CZ 4.46Å; F121-F144 HydrophobicContact CE2-CD2 4.34Å; F121-F144 AromaticContact CE2-CE2 3.44Å; F121-F144 HydrophobicContact CE2-CE2 3.44Å; F121-F144 VanDerWaalsContact CE2-CE2 3.44Å; F121-F144 AromaticContact CE2-CZ 3.8Å; F121-F144 HydrophobicContact CE2-CZ 3.8Å; F121-F144 HydrophobicContact CG-CE1 4.33Å; F121-F144 HydrophobicContact CG-CE2 4.19Å; F121-F144 AromaticContact CG-CZ 3.76Å; F121-F144 HydrophobicContact CG-CZ 3.76Å; F121-F144 HydrophobicContact CZ-CD2 4.16Å; F121-F144 AromaticContact CZ-CE2 3.7Å; F121-F144 HydrophobicContact CZ-CE2 3.7Å; F121-F144 HydrophobicContact CZ-CZ 4.26Å
122	S	46	Very low	44.7	Very low	111 Å²	111	121.7 Å²	121.7	78%	0.776	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-15.3	177.7	61.4	0	0	0	0	114.8	P120	P120-S122 PolarHBondContact O-N 3.37Å
123	E	39.5	Very low	47.1	Very low	127 Å²	127	119.4 Å²	119.4	59%	0.593	62%	0.623	S	S	*	*			trans	-115.1	2.5	-179.2	-87	-174.6	168.9	0	0	114.8	Q119 P120 E125	Q119-E123 PolarHBondContact NE2-OE2 3.48Å; P120-E123 PolarHBondContact O-N 3.34Å; E123-E125 VanDerWaalsContact C-N 3.33Å; E123-E125 WeakPolarHBondContact O-CA 3.45Å; E123-E125 PolarHBondContact O-N 3.41Å
124	M	42.1	Very low	48.9	Very low	77 Å²	77	116.5 Å²	116.5	38%	0.379	61%	0.61	S	S	.	*	S	Bend	trans	-57.3	104.4	166.8	-163.7	-180	76.6	0	0	106.7	F121 K126 W129	F121-M124 HydrophobicContact CE2-CE 3.97Å; F121-M124 HydrophobicContact CE2-SD 4.3Å; F121-M124 HydrophobicContact CZ-CE 4.35Å; M124-K126 PolarHBondContact O-N 2.83Å; M124-W129 HydrophobicContact CE-CE3 3.76Å; M124-W129 HydrophobicContact CE-CZ3 4.28Å
125	E	43.9	Very low	50.6	Low	119 Å²	119	111.6 Å²	111.6	56%	0.556	60%	0.597	S	S	*	*			trans	-43.5	127.8	-159	-71.4	-179.7	138.1	0	0	109.6	E123 N127 Q128 W129	E123-E125 VanDerWaalsContact C-N 3.33Å; E123-E125 WeakPolarHBondContact O-CA 3.45Å; E123-E125 PolarHBondContact O-N 3.41Å; E125-N127 HydrophobicContact CB-CB 4.2Å; E125-N127 PolarHBondContact O-N 3.29Å; E125-Q128 PolarHBondContact O-N 3.3Å; E125-W129 PolarHBondContact O-N 3.39Å
126	K	51.5	Low	52.5	Low	191 Å²	191	105.6 Å²	105.6	83%	0.83	57%	0.568	S	S	*	*	H	α-helix	trans	-43.6	-25.4	170.7	-84.2	178	174.1	174.2	0	112.5	M124	M124-K126 PolarHBondContact O-N 2.83Å
127	N	51.3	Low	54.6	Low	108 Å²	108	100.4 Å²	100.4	58%	0.578	54%	0.54	S	S	*	.	H	α-helix	trans	-72.8	-26.6	177.4	-63.6	-13.6	0	0	0	115.6	E125 S130 K131	E125-N127 HydrophobicContact CB-CB 4.2Å; E125-N127 PolarHBondContact O-N 3.29Å; N127-S130 PolarHBondContact O-OG 3.48Å; N127-K131 WeakPolarHBondContact O-CG 3.32Å
128	Q	61.3	Low	56.7	Low	106 Å²	106	100 Å²	100	50%	0.495	53%	0.53	S	S	.	.	H	α-helix	trans	-86.6	-35.3	174.5	-76.6	-167.8	-10.5	0	0	111.8	E125 S130 K131 L132	E125-Q128 PolarHBondContact O-N 3.3Å; Q128-S130 VanDerWaalsContact C-N 3.26Å; Q128-S130 PolarHBondContact O-N 3.43Å; Q128-K131 WeakPolarHBondContact O-CB 3.4Å; Q128-K131 PolarHBondContact O-N 3.21Å; Q128-L132 PolarHBondContact O-N 3.25Å
129	W	69.9	Low	58.6	Low	63 Å²	63	99.8 Å²	99.8	24%	0.239	51%	0.514	C	S	.	.	H	α-helix	trans	-57.6	-39.6	177.9	-174.5	-100.7	0	0	0	112.1	F121 M124 E125 K131 L132 R137 L140 K141	F121-W129 HydrophobicContact CZ-CE3 4.44Å; F121-W129 HydrophobicContact CZ-CH2 4.5Å; F121-W129 AromaticContact CZ-CZ3 3.84Å; F121-W129 HydrophobicContact CZ-CZ3 3.84Å; M124-W129 HydrophobicContact CE-CE3 3.76Å; M124-W129 HydrophobicContact CE-CZ3 4.28Å; E125-W129 PolarHBondContact O-N 3.39Å; W129-K131 VanDerWaalsContact C-N 3.27Å; W129-K131 PolarHBondContact O-N 3.17Å; W129-L132 HydrophobicContact CE3-CD1 4.21Å; W129-L132 PolarHBondContact O-N 3.28Å; W129-R137 HydrophobicContact CD2-CG 4.36Å; W129-R137 HydrophobicContact CH2-CB 4.28Å; W129-R137 HydrophobicContact CH2-CG 4.37Å; W129-R137 HydrophobicContact CZ2-CB 3.89Å; W129-R137 HydrophobicContact CZ2-CG 3.96Å; W129-R137 VanDerWaalsContact O-CD 3.32Å; W129-R137 WeakPolarHBondContact O-CD 3.27Å; W129-L140 HydrophobicContact CH2-CB 4.19Å; W129-L140 HydrophobicContact CZ3-CB 4.35Å; W129-L140 HydrophobicContact CZ3-CD1 4Å; W129-K141 HydrophobicContact CH2-CG 4.32Å; W129-K141 HydrophobicContact CZ2-CG 4.24Å
130	S	72.5	Confident	60.7	Low	78 Å²	78	96.2 Å²	96.2	55%	0.545	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-19.5	178.1	55.1	0	0	0	0	114.4	N127 Q128	N127-S130 PolarHBondContact O-OG 3.48Å; Q128-S130 VanDerWaalsContact C-N 3.26Å; Q128-S130 PolarHBondContact O-N 3.43Å
131	K	74.6	Confident	62.7	Low	170 Å²	170	98.4 Å²	98.4	74%	0.739	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-16.4	178.9	-66.4	178.8	-178.1	179.6	0	113.4	N127 Q128 W129	N127-K131 WeakPolarHBondContact O-CG 3.32Å; Q128-K131 WeakPolarHBondContact O-CB 3.4Å; Q128-K131 PolarHBondContact O-N 3.21Å; W129-K131 VanDerWaalsContact C-N 3.27Å; W129-K131 PolarHBondContact O-N 3.17Å
132	L	73.4	Confident	63.9	Low	54 Å²	54	99.6 Å²	99.6	28%	0.283	50%	0.504	S	S	.	.	S	Bend	trans	-72.7	136.1	179.3	-70.4	169.7	0	0	0	110.8	Q128 W129 V136 R137 L140	Q128-L132 PolarHBondContact O-N 3.25Å; W129-L132 HydrophobicContact CE3-CD1 4.21Å; W129-L132 PolarHBondContact O-N 3.28Å; L132-V136 HydrophobicContact CD2-CG1 4.11Å; L132-R137 HydrophobicContact CB-CG 3.72Å; L132-R137 HydrophobicContact CD1-CG 4.46Å; L132-R137 PolarHBondContact O-NE 3.03Å; L132-L140 HydrophobicContact CD1-CD1 4.07Å
133	P	74.7	Confident	64.9	Low	75 Å²	75	98.6 Å²	98.6	49%	0.487	49%	0.487	S	S	.	.			trans	-48.7	146.9	167.1	-29.9	38.4	0	0	0	112.2	D135 V136 R137	P133-D135 VanDerWaalsContact C-N 3.29Å; P133-D135 WeakPolarHBondContact CB-OD1 3.43Å; P133-D135 PolarHBondContact O-N 3.5Å; P133-V136 HydrophobicContact CB-CG2 4.11Å; P133-V136 HydrophobicContact CG-CG2 4.38Å; P133-V136 PolarHBondContact O-N 3.38Å; P133-R137 PolarHBondContact O-N 3.47Å; P133-R137 VanDerWaalsContact O-N 3.13Å
134	A	74.3	Confident	66.1	Low	65 Å²	65	97 Å²	97	54%	0.537	48%	0.479	S	S	.	.	H	α-helix	trans	-62.2	-36.3	-172.3	0	0	0	0	0	113.1	R137 E138	A134-R137 PolarHBondContact O-N 3.2Å; A134-E138 PolarHBondContact O-N 2.79Å; A134-E138 VanDerWaalsContact O-N 3.08Å
135	D	64.7	Low	67.1	Low	98 Å²	98	96.4 Å²	96.4	52%	0.524	49%	0.485	S	S	.	.	H	α-helix	trans	-61.5	-46.2	173.7	59.5	-32.3	0	0	0	111.9	P133 R137 E138 I139	P133-D135 VanDerWaalsContact C-N 3.29Å; P133-D135 WeakPolarHBondContact CB-OD1 3.43Å; P133-D135 PolarHBondContact O-N 3.5Å; D135-R137 VanDerWaalsContact C-N 3.34Å; D135-R137 PolarHBondContact O-N 2.82Å; D135-E138 PolarHBondContact O-N 2.77Å; D135-E138 VanDerWaalsContact O-N 3.15Å; D135-I139 VanDerWaalsContact O-CG1 3.3Å; D135-I139 WeakPolarHBondContact O-CG1 3.35Å; D135-I139 PolarHBondContact O-N 3.28Å
136	V	67.5	Low	67.9	Low	52 Å²	52	93.2 Å²	93.2	32%	0.315	47%	0.474	S	S	.	.	H	α-helix	trans	-62.4	-41.8	177.9	-179.8	0	0	0	0	111.1	L132 P133 E138 I139 L140	L132-V136 HydrophobicContact CD2-CG1 4.11Å; P133-V136 HydrophobicContact CB-CG2 4.11Å; P133-V136 HydrophobicContact CG-CG2 4.38Å; P133-V136 PolarHBondContact O-N 3.38Å; V136-E138 VanDerWaalsContact C-N 3.31Å; V136-E138 PolarHBondContact O-N 2.91Å; V136-I139 PolarHBondContact O-N 2.79Å; V136-L140 HydrophobicContact CG1-CD1 4.19Å; V136-L140 WeakPolarHBondContact O-CG 3.44Å; V136-L140 PolarHBondContact O-N 3.21Å
137	R	72.2	Confident	67.9	Low	81 Å²	81	85.8 Å²	85.8	31%	0.306	45%	0.448	S	S	.	.	H	α-helix	trans	-62.4	-37.7	175.3	-71.1	-174.4	-74.6	-177.7	2	112.5	W129 L132 P133 A134 D135 K141	W129-R137 HydrophobicContact CD2-CG 4.36Å; W129-R137 HydrophobicContact CH2-CB 4.28Å; W129-R137 HydrophobicContact CH2-CG 4.37Å; W129-R137 HydrophobicContact CZ2-CB 3.89Å; W129-R137 HydrophobicContact CZ2-CG 3.96Å; W129-R137 VanDerWaalsContact O-CD 3.32Å; W129-R137 WeakPolarHBondContact O-CD 3.27Å; L132-R137 HydrophobicContact CB-CG 3.72Å; L132-R137 HydrophobicContact CD1-CG 4.46Å; L132-R137 PolarHBondContact O-NE 3.03Å; P133-R137 PolarHBondContact O-N 3.47Å; P133-R137 VanDerWaalsContact O-N 3.13Å; A134-R137 PolarHBondContact O-N 3.2Å; D135-R137 VanDerWaalsContact C-N 3.34Å; D135-R137 PolarHBondContact O-N 2.82Å; R137-K141 WeakPolarHBondContact O-CG 3.34Å; R137-K141 PolarHBondContact O-N 3.49Å; R137-K141 VanDerWaalsContact O-N 3.08Å
138	E	73.4	Confident	68.1	Low	106 Å²	106	84.9 Å²	84.9	50%	0.495	45%	0.45	S	S	.	.	H	α-helix	trans	-71.2	-41	179.2	-160.6	-172.2	147	0	0	111.7	A134 D135 V136 K141 K142	A134-E138 PolarHBondContact O-N 2.79Å; A134-E138 VanDerWaalsContact O-N 3.08Å; D135-E138 PolarHBondContact O-N 2.77Å; D135-E138 VanDerWaalsContact O-N 3.15Å; V136-E138 VanDerWaalsContact C-N 3.31Å; V136-E138 PolarHBondContact O-N 2.91Å; E138-K141 PolarHBondContact O-N 2.76Å; E138-K142 PolarHBondContact O-N 2.98Å; E138-K142 WeakPolarHBondContact OE1-CE 3.47Å; E138-K142 IonicContact OE1-NZ 3.09Å; E138-K142 PolarHBondContact OE1-NZ 3.22Å
139	I	70.5	Confident	67.6	Low	97 Å²	97	87 Å²	87	50%	0.497	46%	0.461	S	S	.	.	H	α-helix	trans	-59.3	-48.9	174.5	-67	163.8	0	0	0	110.3	D135 V136 K141 K142 Q143	D135-I139 VanDerWaalsContact O-CG1 3.3Å; D135-I139 WeakPolarHBondContact O-CG1 3.35Å; D135-I139 PolarHBondContact O-N 3.28Å; V136-I139 PolarHBondContact O-N 2.79Å; I139-K141 PolarHBondContact O-N 3.27Å; I139-K142 PolarHBondContact O-N 3.24Å; I139-Q143 HydrophobicContact CG2-CG 4.41Å; I139-Q143 WeakPolarHBondContact O-CG 3.5Å; I139-Q143 PolarHBondContact O-N 3.33Å
140	L	73.9	Confident	66.7	Low	54 Å²	54	92.7 Å²	92.7	28%	0.283	48%	0.483	S	S	.	.	H	α-helix	trans	-61.4	-42.9	178.8	-71.6	172.1	0	0	0	111.9	W129 L132 V136 K142 Q143 F144	W129-L140 HydrophobicContact CH2-CB 4.19Å; W129-L140 HydrophobicContact CZ3-CB 4.35Å; W129-L140 HydrophobicContact CZ3-CD1 4Å; L132-L140 HydrophobicContact CD1-CD1 4.07Å; V136-L140 HydrophobicContact CG1-CD1 4.19Å; V136-L140 WeakPolarHBondContact O-CG 3.44Å; V136-L140 PolarHBondContact O-N 3.21Å; L140-K142 VanDerWaalsContact C-N 3.34Å; L140-K142 PolarHBondContact O-N 3.09Å; L140-Q143 PolarHBondContact O-N 3.33Å; L140-F144 WeakPolarHBondContact O-CB 3.42Å; L140-F144 WeakPolarHBondContact O-CD2 3.42Å; L140-F144 PolarHBondContact O-N 2.81Å
141	K	75.6	Confident	65.2	Low	135 Å²	135	91.7 Å²	91.7	59%	0.587	49%	0.486	S	S	*	.	H	α-helix	trans	-59.3	-43.2	174.5	-78.7	179.6	178.7	-175.8	0	112.1	W129 R137 E138 I139 A145	W129-K141 HydrophobicContact CH2-CG 4.32Å; W129-K141 HydrophobicContact CZ2-CG 4.24Å; R137-K141 WeakPolarHBondContact O-CG 3.34Å; R137-K141 PolarHBondContact O-N 3.49Å; R137-K141 VanDerWaalsContact O-N 3.08Å; E138-K141 PolarHBondContact O-N 2.76Å; I139-K141 PolarHBondContact O-N 3.27Å; K141-A145 WeakPolarHBondContact O-CB 3.5Å; K141-A145 PolarHBondContact O-N 3.03Å
142	K	69.8	Low	63.3	Low	125 Å²	125	90.2 Å²	90.2	54%	0.543	49%	0.485	S	S	.	.	H	α-helix	trans	-64	-49	177.5	-77	177.5	-175.5	162.9	0	111	E138 I139 L140 F144 A145 T146	E138-K142 PolarHBondContact O-N 2.98Å; E138-K142 WeakPolarHBondContact OE1-CE 3.47Å; E138-K142 IonicContact OE1-NZ 3.09Å; E138-K142 PolarHBondContact OE1-NZ 3.22Å; I139-K142 PolarHBondContact O-N 3.24Å; L140-K142 VanDerWaalsContact C-N 3.34Å; L140-K142 PolarHBondContact O-N 3.09Å; K142-F144 VanDerWaalsContact C-N 3.33Å; K142-F144 PolarHBondContact O-N 3.12Å; K142-A145 PolarHBondContact O-N 3.39Å; K142-T146 PolarHBondContact O-N 3.32Å; K142-T146 PolarHBondContact O-OG1 2.71Å
143	Q	66.9	Low	61.4	Low	89 Å²	89	96.7 Å²	96.7	42%	0.416	51%	0.514	S	S	.	.	H	α-helix	trans	-60.6	-40.5	179.5	-70.1	-137.8	-19.3	0	0	112.8	I139 L140 T146 A147	I139-Q143 HydrophobicContact CG2-CG 4.41Å; I139-Q143 WeakPolarHBondContact O-CG 3.5Å; I139-Q143 PolarHBondContact O-N 3.33Å; L140-Q143 PolarHBondContact O-N 3.33Å; Q143-T146 PolarHBondContact O-N 3.08Å; Q143-A147 WeakPolarHBondContact O-CB 3.25Å; Q143-A147 PolarHBondContact O-N 2.96Å
144	F	63.3	Low	59.7	Low	95 Å²	95	97.2 Å²	97.2	42%	0.417	52%	0.524	S	S	.	.	H	α-helix	trans	-67	-39.7	176	-96.1	-77.2	0	0	0	113.3	F121 L140 K142 T146 A147 S148	F121-F144 HydrophobicContact CB-CZ 4.26Å; F121-F144 HydrophobicContact CD1-CE2 4.4Å; F121-F144 HydrophobicContact CD1-CZ 4.23Å; F121-F144 AromaticContact CD2-CE2 3.72Å; F121-F144 HydrophobicContact CD2-CE2 3.72Å; F121-F144 AromaticContact CD2-CZ 3.53Å; F121-F144 HydrophobicContact CD2-CZ 3.53Å; F121-F144 HydrophobicContact CE1-CD2 4.46Å; F121-F144 HydrophobicContact CE1-CE2 4.18Å; F121-F144 HydrophobicContact CE1-CZ 4.46Å; F121-F144 HydrophobicContact CE2-CD2 4.34Å; F121-F144 AromaticContact CE2-CE2 3.44Å; F121-F144 HydrophobicContact CE2-CE2 3.44Å; F121-F144 VanDerWaalsContact CE2-CE2 3.44Å; F121-F144 AromaticContact CE2-CZ 3.8Å; F121-F144 HydrophobicContact CE2-CZ 3.8Å; F121-F144 HydrophobicContact CG-CE1 4.33Å; F121-F144 HydrophobicContact CG-CE2 4.19Å; F121-F144 AromaticContact CG-CZ 3.76Å; F121-F144 HydrophobicContact CG-CZ 3.76Å; F121-F144 HydrophobicContact CZ-CD2 4.16Å; F121-F144 AromaticContact CZ-CE2 3.7Å; F121-F144 HydrophobicContact CZ-CE2 3.7Å; F121-F144 HydrophobicContact CZ-CZ 4.26Å; L140-F144 WeakPolarHBondContact O-CB 3.42Å; L140-F144 WeakPolarHBondContact O-CD2 3.42Å; L140-F144 PolarHBondContact O-N 2.81Å; K142-F144 VanDerWaalsContact C-N 3.33Å; K142-F144 PolarHBondContact O-N 3.12Å; F144-T146 VanDerWaalsContact C-N 3.32Å; F144-A147 PolarHBondContact O-N 2.94Å; F144-S148 WeakPolarHBondContact O-CB 3.45Å; F144-S148 PolarHBondContact O-N 3.21Å; F144-S148 PolarHBondContact O-OG 3.06Å
145	A	64.3	Low	57.9	Low	63 Å²	63	99.3 Å²	99.3	52%	0.521	53%	0.532	S	S	.	.	H	α-helix	trans	-62.7	-42	175	0	0	0	0	0	111	K141 K142 S148 Q149	K141-A145 WeakPolarHBondContact O-CB 3.5Å; K141-A145 PolarHBondContact O-N 3.03Å; K142-A145 PolarHBondContact O-N 3.39Å; A145-S148 PolarHBondContact O-N 3.05Å; A145-Q149 PolarHBondContact O-N 3.14Å; A145-Q149 VanDerWaalsContact O-N 3.08Å
146	T	59.4	Low	56.4	Low	53 Å²	53	99.3 Å²	99.3	33%	0.325	55%	0.546	S	S	.	.	H	α-helix	trans	-63.6	-47.4	174.9	-52.5	0	0	0	0	111.6	K142 Q143 F144 S148 Q149 Y150	K142-T146 PolarHBondContact O-N 3.32Å; K142-T146 PolarHBondContact O-OG1 2.71Å; Q143-T146 PolarHBondContact O-N 3.08Å; F144-T146 VanDerWaalsContact C-N 3.32Å; T146-S148 VanDerWaalsContact C-N 3.27Å; T146-S148 PolarHBondContact O-N 3.46Å; T146-Q149 WeakPolarHBondContact O-CB 3.4Å; T146-Q149 PolarHBondContact O-N 3.23Å; T146-Y150 HydrophobicContact CG2-CD2 3.82Å; T146-Y150 HydrophobicContact CG2-CE2 3.68Å; T146-Y150 VanDerWaalsContact O-CD2 3.26Å; T146-Y150 WeakPolarHBondContact O-CD2 3.49Å; T146-Y150 PolarHBondContact O-N 3.4Å; T146-Y150 VanDerWaalsContact O-N 3.13Å
147	A	52.4	Low	54.7	Low	34 Å²	34	107.8 Å²	107.8	28%	0.281	57%	0.573	S	S	.	*	H	α-helix	trans	-60.8	-35.5	178.2	0	0	0	0	0	112.9	Q143 F144 L152	Q143-A147 WeakPolarHBondContact O-CB 3.25Å; Q143-A147 PolarHBondContact O-N 2.96Å; F144-A147 PolarHBondContact O-N 2.94Å; A147-L152 HydrophobicContact CB-CD1 4.23Å
148	S	55	Low	52.8	Low	89 Å²	89	110.4 Å²	110.4	62%	0.622	60%	0.598	S	S	*	*	H	α-helix	trans	-70.3	-33	175.1	-56.8	0	0	0	0	112.3	F144 A145 T146	F144-S148 WeakPolarHBondContact O-CB 3.45Å; F144-S148 PolarHBondContact O-N 3.21Å; F144-S148 PolarHBondContact O-OG 3.06Å; A145-S148 PolarHBondContact O-N 3.05Å; T146-S148 VanDerWaalsContact C-N 3.27Å; T146-S148 PolarHBondContact O-N 3.46Å
149	Q	51.5	Low	51	Low	152 Å²	152	113.7 Å²	113.7	71%	0.71	61%	0.613	S	S	*	*	H	α-helix	trans	-69.5	-34.2	177	-171.4	179.8	-2	0	0	112.4	A145 T146 G151	A145-Q149 PolarHBondContact O-N 3.14Å; A145-Q149 VanDerWaalsContact O-N 3.08Å; T146-Q149 WeakPolarHBondContact O-CB 3.4Å; T146-Q149 PolarHBondContact O-N 3.23Å; Q149-G151 VanDerWaalsContact C-N 3.32Å; Q149-G151 PolarHBondContact O-N 3.35Å
150	Y	50.7	Low	49.2	Very low	181 Å²	181	117.2 Å²	117.2	71%	0.71	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	16.1	179.5	-70.4	-75.7	0	0	0	114.4	T146 L152	T146-Y150 HydrophobicContact CG2-CD2 3.82Å; T146-Y150 HydrophobicContact CG2-CE2 3.68Å; T146-Y150 VanDerWaalsContact O-CD2 3.26Å; T146-Y150 WeakPolarHBondContact O-CD2 3.49Å; T146-Y150 PolarHBondContact O-N 3.4Å; T146-Y150 VanDerWaalsContact O-N 3.13Å; Y150-L152 PolarHBondContact O-N 3.13Å
151	G	41	Very low	47.3	Very low	58 Å²	58	120.9 Å²	120.9	60%	0.598	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	77.3	19.8	163.4	0	0	0	0	0	116.2	Q149 Q153	Q149-G151 VanDerWaalsContact C-N 3.32Å; Q149-G151 PolarHBondContact O-N 3.35Å; G151-Q153 PolarHBondContact O-N 3.41Å
152	L	35.8	Very low	45.2	Very low	138 Å²	138	120.6 Å²	120.6	72%	0.723	66%	0.664	S	S	*	*			trans	-65.7	100.5	164.7	-76.8	164.5	0	0	0	108.5	A147 Y150 A154	A147-L152 HydrophobicContact CB-CD1 4.23Å; Y150-L152 PolarHBondContact O-N 3.13Å; L152-A154 PolarHBondContact O-N 3.44Å
153	Q	32.3	Very low	43.5	Very low	190 Å²	190	123.1 Å²	123.1	89%	0.888	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-59	120.5	176.4	-76.7	-178.7	-10.2	0	0	109.4	G151	G151-Q153 PolarHBondContact O-N 3.41Å
154	A	39.1	Very low	41.9	Very low	86 Å²	86	125.6 Å²	125.6	71%	0.711	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-55.7	133.9	165.4	0	0	0	0	0	108.8	L152 A156	L152-A154 PolarHBondContact O-N 3.44Å; A154-A156 PolarHBondContact O-N 3.28Å
155	P	35.8	Very low	40.4	Very low	109 Å²	109	128.7 Å²	128.7	71%	0.708	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-57.1	134.5	178.2	20.3	-29.6	0	0	0	109.9	R157	P155-R157 PolarHBondContact O-N 2.95Å
156	A	34.1	Very low	38.9	Very low	99 Å²	99	135.1 Å²	135.1	82%	0.818	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-51.3	127.7	-174.9	0	0	0	0	0	110.7	A154 T158	A154-A156 PolarHBondContact O-N 3.28Å; A156-T158 PolarHBondContact O-N 3.44Å
157	R	31	Very low	37.6	Very low	230 Å²	230	143.4 Å²	143.4	87%	0.868	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-55.2	123.7	-179.6	-154.3	179.3	-157.7	-163.4	3.9	109.4	P155 E159	P155-R157 PolarHBondContact O-N 2.95Å; R157-E159 VanDerWaalsContact C-N 3.33Å; R157-E159 PolarHBondContact O-N 2.77Å
158	T	34.1	Very low	36.6	Very low	136 Å²	136	151.2 Å²	151.2	83%	0.834	79%	0.787	S	S	*	*			trans	-64	92.7	171.9	-19	0	0	0	0	108.2	A156 Q160	A156-T158 PolarHBondContact O-N 3.44Å; T158-Q160 PolarHBondContact O-N 2.9Å
159	E	34.7	Very low	35.7	Very low	175 Å²	175	153.5 Å²	153.5	82%	0.818	80%	0.797	S	S	*	*			trans	-70.9	112.4	169.9	-74.9	-172.9	167.7	0	0	108.3	R157	R157-E159 VanDerWaalsContact C-N 3.33Å; R157-E159 PolarHBondContact O-N 2.77Å
160	Q	32.4	Very low	34.8	Very low	171 Å²	171	151.1 Å²	151.1	80%	0.799	80%	0.797	S	S	*	*			trans	-63.8	132.3	170	-75.3	178	-22.2	0	0	109.2	T158 T162	T158-Q160 PolarHBondContact O-N 2.9Å; Q160-T162 PolarHBondContact O-N 2.67Å; Q160-T162 VanDerWaalsContact O-N 3.1Å
161	P	34.1	Very low	34.5	Very low	130 Å²	130	148.4 Å²	148.4	84%	0.844	80%	0.799	S	S	*	*			trans	-77.6	101.5	-177.2	30.5	-32.6	0	0	0	109.6
162	T	32.3	Very low	34.3	Very low	129 Å²	129	152.8 Å²	152.8	79%	0.791	81%	0.808	S	S	*	*			trans	-86.6	123.1	163.3	38.8	0	0	0	0	109.5	Q160 T164	Q160-T162 PolarHBondContact O-N 2.67Å; Q160-T162 VanDerWaalsContact O-N 3.1Å; T162-T164 PolarHBondContact O-N 3.3Å
163	Q	32.3	Very low	34.6	Very low	179 Å²	179	154.6 Å²	154.6	84%	0.836	81%	0.813	S	S	*	*			trans	-48	127	173.9	-68.6	172.4	-18	0	0	110.5	E165	Q163-E165 PolarHBondContact O-N 2.84Å
164	T	33.4	Very low	34.9	Very low	141 Å²	141	152.7 Å²	152.7	87%	0.865	81%	0.808	S	S	*	*			trans	-75.9	79.1	175.1	-7.9	0	0	0	0	108.5	T162	T162-T164 PolarHBondContact O-N 3.3Å
165	E	33.1	Very low	35	Very low	159 Å²	159	155.5 Å²	155.5	74%	0.743	81%	0.81	S	S	*	*			trans	-72.8	124.8	160.1	-87.4	-168.4	157.1	0	0	108.9	Q163 R167	Q163-E165 PolarHBondContact O-N 2.84Å; E165-R167 VanDerWaalsContact C-N 3.31Å; E165-R167 PolarHBondContact O-N 2.8Å
166	H	32.1	Very low	35.3	Very low	198 Å²	198	155.5 Å²	155.5	92%	0.917	81%	0.808	S	S	*	*			trans	-61.4	85.9	171.5	-72.1	-83.2	0	0	0	110.9
167	R	31.7	Very low	35.4	Very low	227 Å²	227	161.8 Å²	161.8	86%	0.857	81%	0.81	S	S	*	*			trans	-95.1	103.9	169.2	-122.4	177.6	-177.9	-179.4	1.2	110.2	E165 V169	E165-R167 VanDerWaalsContact C-N 3.31Å; E165-R167 PolarHBondContact O-N 2.8Å; R167-V169 PolarHBondContact O-N 3.44Å
168	K	31.7	Very low	36.1	Very low	199 Å²	199	159.4 Å²	159.4	87%	0.865	81%	0.806	S	S	*	*			trans	-48.3	122.7	166.3	-76.2	173.8	173.9	175.7	0	109.5	S170	K168-S170 PolarHBondContact O-N 3.48Å; K168-S170 VanDerWaalsContact O-N 3.13Å
169	V	37.1	Very low	36.3	Very low	137 Å²	137	161.4 Å²	161.4	83%	0.83	81%	0.806	S	S	*	*			trans	-71.5	102.7	167.8	178.5	0	0	0	0	107.3	R167 V171	R167-V169 PolarHBondContact O-N 3.44Å; V169-V171 PolarHBondContact O-N 3.37Å
170	S	33.2	Very low	36.7	Very low	101 Å²	101	160.7 Å²	160.7	71%	0.706	81%	0.807	S	S	*	*			trans	-70	119.8	163.2	46.9	0	0	0	0	108.2	K168 L172	K168-S170 PolarHBondContact O-N 3.48Å; K168-S170 VanDerWaalsContact O-N 3.13Å; S170-L172 PolarHBondContact O-N 3.35Å
171	V	42.9	Very low	37.1	Very low	124 Å²	124	157.6 Å²	157.6	75%	0.752	80%	0.799	S	S	*	*			trans	-55.6	123.6	169.7	177.4	0	0	0	0	107.8	V169 E173	V169-V171 PolarHBondContact O-N 3.37Å; V171-E173 PolarHBondContact O-N 2.82Å; V171-E173 VanDerWaalsContact O-N 3.08Å
172	L	37.9	Very low	38.2	Very low	151 Å²	151	155.7 Å²	155.7	79%	0.791	79%	0.789	S	S	*	*			trans	-57.3	113.8	177	-130.9	88.3	0	0	0	109	S170 N174	S170-L172 PolarHBondContact O-N 3.35Å; L172-N174 PolarHBondContact O-N 3.14Å; L172-N174 VanDerWaalsContact O-N 3.13Å
173	E	41	Very low	39.3	Very low	176 Å²	176	156.9 Å²	156.9	82%	0.822	79%	0.791	S	S	*	*	S	Bend	trans	-59.1	107	160.5	-68.5	176.2	159.5	0	0	107.7	V171	V171-E173 PolarHBondContact O-N 2.82Å; V171-E173 VanDerWaalsContact O-N 3.08Å
174	N	38.4	Very low	40.4	Very low	149 Å²	149	152.3 Å²	152.3	80%	0.797	78%	0.775	S	S	*	*			trans	-179.2	48.9	151.8	-87.9	-22	0	0	0	109.9	L172 V176	L172-N174 PolarHBondContact O-N 3.14Å; L172-N174 VanDerWaalsContact O-N 3.13Å; N174-V176 PolarHBondContact O-N 3.34Å; N174-V176 VanDerWaalsContact O-N 3.15Å
175	I	41.2	Very low	41.3	Very low	146 Å²	146	149.4 Å²	149.4	75%	0.749	76%	0.758	S	S	*	*			trans	-75.8	101	166	-60.1	175.1	0	0	0	106.8	R177	I175-R177 HydrophobicContact CG2-CG 4.41Å; I175-R177 PolarHBondContact O-N 2.93Å
176	V	42.7	Very low	42.4	Very low	109 Å²	109	154.4 Å²	154.4	66%	0.661	77%	0.771	S	S	*	*			trans	-65.9	101.6	165.2	-179.7	0	0	0	0	107.1	N174 F178	N174-V176 PolarHBondContact O-N 3.34Å; N174-V176 VanDerWaalsContact O-N 3.15Å; V176-F178 HydrophobicContact CB-CE2 4.47Å; V176-F178 HydrophobicContact CG1-CD2 4.49Å; V176-F178 HydrophobicContact CG1-CE2 4.03Å; V176-F178 HydrophobicContact CG1-CZ 4.09Å; V176-F178 PolarHBondContact O-N 3Å
177	R	36.7	Very low	43.3	Very low	231 Å²	231	151.5 Å²	151.5	87%	0.872	76%	0.762	S	S	*	*			trans	-73.1	113.2	172.6	-78.8	-176.5	179.5	174.1	0.8	108.7	I175 E179	I175-R177 HydrophobicContact CG2-CG 4.41Å; I175-R177 PolarHBondContact O-N 2.93Å; R177-E179 PolarHBondContact O-N 3.4Å
178	F	45.6	Very low	43.9	Very low	179 Å²	179	148.5 Å²	148.5	79%	0.785	76%	0.755	S	S	*	*			trans	-82	106.6	162.2	-65.3	-86.7	0	0	0	107.8	V176 I180	V176-F178 HydrophobicContact CB-CE2 4.47Å; V176-F178 HydrophobicContact CG1-CD2 4.49Å; V176-F178 HydrophobicContact CG1-CE2 4.03Å; V176-F178 HydrophobicContact CG1-CZ 4.09Å; V176-F178 PolarHBondContact O-N 3Å; F178-I180 PolarHBondContact O-N 2.98Å
179	E	37.2	Very low	44.7	Very low	179 Å²	179	144.7 Å²	144.7	84%	0.836	75%	0.753	S	S	*	*			trans	-86.3	103	168.4	-164.2	170	-156.2	0	0	107.5	R177 T181	R177-E179 PolarHBondContact O-N 3.4Å; E179-T181 PolarHBondContact O-N 3.46Å
180	I	43.8	Very low	45.1	Very low	160 Å²	160	146 Å²	146	82%	0.821	76%	0.755	S	S	*	*			trans	-80.9	98.6	173.9	-57.6	172.4	0	0	0	106.6	F178	F178-I180 PolarHBondContact O-N 2.98Å
181	T	40.3	Very low	45.5	Very low	105 Å²	105	152.8 Å²	152.8	64%	0.644	77%	0.765	S	S	*	*			trans	-71.9	130.3	166.5	49.4	0	0	0	0	109.1	E179	E179-T181 PolarHBondContact O-N 3.46Å
182	S	57.1	Low	45.6	Very low	90 Å²	90	156.5 Å²	156.5	63%	0.629	77%	0.771	S	S	*	*			trans	-69.5	126.1	173.2	173.3	0	0	0	0	110.1	V184	S182-V184 PolarHBondContact O-N 3.22Å; S182-V184 VanDerWaalsContact O-N 3.08Å; S182-V184 WeakPolarHBondContact OG-CG2 2.97Å; S182-V184 PolarHBondContact OG-N 3.46Å
183	D	56.1	Low	45.9	Very low	155 Å²	155	154.5 Å²	154.5	83%	0.829	77%	0.767	S	S	*	*			trans	-69.9	1.9	176.1	-54.5	-23.9	0	0	0	113.3	P185	D183-P185 VanDerWaalsContact O-CD 3.26Å; D183-P185 WeakPolarHBondContact O-CD 3.4Å
184	V	56.2	Low	46.2	Very low	82 Å²	82	151.5 Å²	151.5	50%	0.497	77%	0.765	S	S	.	*	S	Bend	trans	-81.5	115.4	-178.1	-173.2	0	0	0	0	109.2	S182	S182-V184 PolarHBondContact O-N 3.22Å; S182-V184 VanDerWaalsContact O-N 3.08Å; S182-V184 WeakPolarHBondContact OG-CG2 2.97Å; S182-V184 PolarHBondContact OG-N 3.46Å
185	P	52.3	Low	46.5	Very low	81 Å²	81	152.5 Å²	152.5	53%	0.526	77%	0.771	S	S	.	*			trans	-56.2	142.7	174.2	-21.4	33.3	0	0	0	110.7	D183 D187 K188	D183-P185 VanDerWaalsContact O-CD 3.26Å; D183-P185 WeakPolarHBondContact O-CD 3.4Å; P185-D187 WeakPolarHBondContact CB-OD1 3.36Å; P185-D187 PolarHBondContact O-N 3.48Å; P185-K188 PolarHBondContact O-N 3.04Å
186	R	56.2	Low	47.1	Very low	264 Å²	264	148.2 Å²	148.2	100%	0.996	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-7.2	-171.5	-76	-177.2	174.3	168.9	-1.1	115
187	D	49.3	Very low	47.4	Very low	137 Å²	137	151 Å²	151	73%	0.733	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	10.9	-170.3	47.2	-52.4	0	0	0	114.6	P185	P185-D187 WeakPolarHBondContact CB-OD1 3.36Å; P185-D187 PolarHBondContact O-N 3.48Å
188	K	44.5	Very low	48.2	Very low	164 Å²	164	147.1 Å²	147.1	71%	0.713	76%	0.76	S	S	*	*			trans	-120.8	120.2	170.8	-72.9	-170.7	179.5	177.2	0	114.3	P185	P185-K188 PolarHBondContact O-N 3.04Å
189	S	48.7	Very low	48.5	Very low	119 Å²	119	145 Å²	145	83%	0.832	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-79.5	140.2	174.7	65.5	0	0	0	0	112.3	R191	S189-R191 PolarHBondContact O-N 3.01Å
190	L	45.5	Very low	49.3	Very low	164 Å²	164	145.8 Å²	145.8	86%	0.859	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-67	121.5	177.9	-68.4	159.6	0	0	0	110.1	K192	L190-K192 PolarHBondContact O-N 3.26Å
191	R	41.6	Very low	49.7	Very low	243 Å²	243	145.9 Å²	145.9	92%	0.917	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-62.1	127.3	171	-86.8	-176.3	176.7	-174.7	-1.1	109.7	S189	S189-R191 PolarHBondContact O-N 3.01Å
192	K	45.2	Very low	50.6	Low	203 Å²	203	145.3 Å²	145.3	88%	0.883	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-59.6	126.3	171.3	-74.6	-178.2	175.9	-178.8	0	109.9	L190	L190-K192 PolarHBondContact O-N 3.26Å
193	P	45.5	Very low	50.8	Low	108 Å²	108	145 Å²	145	70%	0.701	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-72.4	136.4	171.8	28.3	-30	0	0	0	110
194	S	45.5	Very low	50.9	Low	113 Å²	113	140.2 Å²	140.2	79%	0.79	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-55.8	130.5	-179.6	47.3	0	0	0	0	113.2
195	D	46.3	Very low	51.2	Low	170 Å²	170	138.8 Å²	138.8	91%	0.909	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	136	177.1	-64.2	-51.6	0	0	0	112.9
196	G	52.5	Low	51.8	Low	56 Å²	56	143 Å²	143	58%	0.577	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	133.7	-31.3	162.7	0	0	0	0	0	117.1
197	Q	49.9	Very low	52.2	Low	169 Å²	169	136.5 Å²	136.5	79%	0.79	70%	0.697	S	S	*	*	S	Bend	trans	-90.4	-13.3	-175.3	-77.8	-174.8	-15.2	0	0	115.4
198	Q	53.5	Low	53	Low	149 Å²	149	133.5 Å²	133.5	70%	0.696	69%	0.686	S	S	*	*	H	α-helix	trans	-80.4	-28.1	-178.8	-91.7	178	-11.4	0	0	114.2	Y200 K201 I202	Q198-Y200 PolarHBondContact O-N 3.43Å; Q198-K201 PolarHBondContact O-N 3.17Å; Q198-I202 PolarHBondContact O-N 3.2Å
199	L	51.3	Low	54.2	Low	134 Å²	134	130.9 Å²	130.9	70%	0.702	68%	0.679	S	S	*	*	H	α-helix	trans	-69.5	-36.4	-176.2	-149.5	78.2	0	0	0	112.4	K201 I202 V203	L199-K201 VanDerWaalsContact C-N 3.29Å; L199-K201 PolarHBondContact O-N 3.34Å; L199-I202 PolarHBondContact O-N 3.42Å; L199-V203 PolarHBondContact O-N 3.42Å
200	Y	53.6	Low	55.3	Low	196 Å²	196	128.2 Å²	128.2	77%	0.769	66%	0.66	S	S	*	*	H	α-helix	trans	-64.8	-30.5	174	-83.5	-82.9	0	0	0	113	Q198 A204	Q198-Y200 PolarHBondContact O-N 3.43Å; Y200-A204 VanDerWaalsContact O-CB 3.31Å; Y200-A204 WeakPolarHBondContact O-CB 3.3Å; Y200-A204 PolarHBondContact O-N 3.29Å; Y200-A204 VanDerWaalsContact O-N 3.17Å
201	K	53.7	Low	56.7	Low	161 Å²	161	125.6 Å²	125.6	70%	0.7	65%	0.646	S	S	*	*	H	α-helix	trans	-70.6	-31.6	177.3	-71.8	-172.9	177.5	-178.2	0	112.7	Q198 L199 S205	Q198-K201 PolarHBondContact O-N 3.17Å; L199-K201 VanDerWaalsContact C-N 3.29Å; L199-K201 PolarHBondContact O-N 3.34Å; K201-S205 PolarHBondContact O-N 3.13Å
202	I	58.4	Low	58.3	Low	94 Å²	94	118.8 Å²	118.8	48%	0.482	63%	0.627	S	S	.	*	H	α-helix	trans	-78.4	-40.2	-179.8	-61.4	172.9	0	0	0	110.9	Q198 L199 A204 S205 Y206	Q198-I202 PolarHBondContact O-N 3.2Å; L199-I202 PolarHBondContact O-N 3.42Å; I202-A204 VanDerWaalsContact C-N 3.34Å; I202-A204 PolarHBondContact O-N 3.15Å; I202-S205 PolarHBondContact O-N 3.08Å; I202-S205 PolarHBondContact O-OG 3.03Å; I202-Y206 HydrophobicContact CG2-CD2 4.11Å; I202-Y206 HydrophobicContact CG2-CE2 3.83Å; I202-Y206 VanDerWaalsContact O-CD2 3.28Å; I202-Y206 WeakPolarHBondContact O-CD2 3.45Å; I202-Y206 PolarHBondContact O-N 3.4Å
203	V	61.3	Low	59.7	Low	82 Å²	82	111.4 Å²	111.4	50%	0.497	60%	0.604	S	S	.	*	H	α-helix	trans	-67.4	-37.9	176.7	-179.7	0	0	0	0	111.2	L199 S205 Y206 Q207	L199-V203 PolarHBondContact O-N 3.42Å; V203-S205 VanDerWaalsContact C-N 3.31Å; V203-S205 PolarHBondContact O-N 3.44Å; V203-Y206 PolarHBondContact O-N 2.95Å; V203-Q207 PolarHBondContact O-N 3.17Å
204	A	59.1	Low	61.4	Low	55 Å²	55	110.9 Å²	110.9	46%	0.455	60%	0.595	S	S	.	*	H	α-helix	trans	-63.7	-33.4	175	0	0	0	0	0	112.9	Y200 I202 C208	Y200-A204 VanDerWaalsContact O-CB 3.31Å; Y200-A204 WeakPolarHBondContact O-CB 3.3Å; Y200-A204 PolarHBondContact O-N 3.29Å; Y200-A204 VanDerWaalsContact O-N 3.17Å; I202-A204 VanDerWaalsContact C-N 3.34Å; I202-A204 PolarHBondContact O-N 3.15Å; A204-C208 WeakPolarHBondContact O-CB 3.5Å; A204-C208 PolarHBondContact O-N 2.97Å; A204-C208 VanDerWaalsContact O-N 3.13Å
205	S	62.2	Low	63	Low	53 Å²	53	111.6 Å²	111.6	37%	0.371	59%	0.586	S	S	.	*	H	α-helix	trans	-70.8	-38	178.4	65.7	0	0	0	0	112.5	K201 I202 V203 C208 I209	K201-S205 PolarHBondContact O-N 3.13Å; I202-S205 PolarHBondContact O-N 3.08Å; I202-S205 PolarHBondContact O-OG 3.03Å; V203-S205 VanDerWaalsContact C-N 3.31Å; V203-S205 PolarHBondContact O-N 3.44Å; S205-C208 PolarHBondContact O-N 3.44Å; S205-I209 VanDerWaalsContact O-CG1 3.3Å; S205-I209 WeakPolarHBondContact O-CG1 3.45Å; S205-I209 PolarHBondContact O-N 2.98Å; S205-I209 VanDerWaalsContact O-N 3.08Å
206	Y	64	Low	64.7	Low	168 Å²	168	110.2 Å²	110.2	66%	0.659	58%	0.576	S	S	*	*	H	α-helix	trans	-67.7	-41.1	175.8	-78.7	-75.8	0	0	0	112.8	I202 V203 C208 I209 S210	I202-Y206 HydrophobicContact CG2-CD2 4.11Å; I202-Y206 HydrophobicContact CG2-CE2 3.83Å; I202-Y206 VanDerWaalsContact O-CD2 3.28Å; I202-Y206 WeakPolarHBondContact O-CD2 3.45Å; I202-Y206 PolarHBondContact O-N 3.4Å; V203-Y206 PolarHBondContact O-N 2.95Å; Y206-C208 VanDerWaalsContact C-N 3.27Å; Y206-C208 PolarHBondContact O-N 3.45Å; Y206-I209 PolarHBondContact O-N 3.39Å; Y206-S210 PolarHBondContact O-N 2.95Å; Y206-S210 VanDerWaalsContact O-N 3.14Å
207	Q	64.3	Low	66.1	Low	129 Å²	129	111.9 Å²	111.9	60%	0.603	57%	0.571	S	S	*	*	H	α-helix	trans	-64.1	-32.9	174.9	-74.8	-176.3	-20.8	0	0	112.3	V203 S210 L211	V203-Q207 PolarHBondContact O-N 3.17Å; Q207-S210 PolarHBondContact O-OG 3.42Å; Q207-L211 PolarHBondContact O-N 2.86Å
208	C	66.3	Low	67.8	Low	74 Å²	74	108.7 Å²	108.7	50%	0.5	56%	0.558	S	S	.	*	H	α-helix	trans	-70.6	-40.5	176.5	-158.9	0	0	0	0	111.8	A204 S205 Y206 L211 L212	A204-C208 WeakPolarHBondContact O-CB 3.5Å; A204-C208 PolarHBondContact O-N 2.97Å; A204-C208 VanDerWaalsContact O-N 3.13Å; S205-C208 PolarHBondContact O-N 3.44Å; Y206-C208 VanDerWaalsContact C-N 3.27Å; Y206-C208 PolarHBondContact O-N 3.45Å; C208-L211 PolarHBondContact O-N 3.35Å; C208-L212 VanDerWaalsContact O-CG 3.25Å; C208-L212 WeakPolarHBondContact O-CG 3.46Å; C208-L212 PolarHBondContact O-N 3.08Å
209	I	69.8	Low	69.3	Low	109 Å²	109	108.6 Å²	108.6	56%	0.559	55%	0.552	S	S	*	*	H	α-helix	trans	-66.9	-40.6	179.3	-66.7	163.8	0	0	0	111.8	S205 Y206 L212 A213	S205-I209 VanDerWaalsContact O-CG1 3.3Å; S205-I209 WeakPolarHBondContact O-CG1 3.45Å; S205-I209 PolarHBondContact O-N 2.98Å; S205-I209 VanDerWaalsContact O-N 3.08Å; Y206-I209 PolarHBondContact O-N 3.39Å; I209-L212 PolarHBondContact O-N 2.89Å; I209-A213 PolarHBondContact O-N 3.37Å
210	S	72.8	Confident	70.9	Confident	62 Å²	62	107 Å²	107	43%	0.434	54%	0.544	S	S	.	.	H	α-helix	trans	-65.8	-41.8	177.2	66	0	0	0	0	112	Y206 Q207 L212 A213 D214	Y206-S210 PolarHBondContact O-N 2.95Å; Y206-S210 VanDerWaalsContact O-N 3.14Å; Q207-S210 PolarHBondContact O-OG 3.42Å; S210-L212 VanDerWaalsContact C-N 3.33Å; S210-L212 PolarHBondContact O-N 3Å; S210-A213 PolarHBondContact O-N 2.86Å; S210-D214 PolarHBondContact O-N 3.2Å
211	L	73.5	Confident	72.6	Confident	109 Å²	109	106.1 Å²	106.1	57%	0.571	54%	0.539	S	S	*	.	H	α-helix	trans	-61.9	-39.9	175.8	-110.8	116.7	0	0	0	112.4	Q207 C208 Q215	Q207-L211 PolarHBondContact O-N 2.86Å; C208-L211 PolarHBondContact O-N 3.35Å; L211-Q215 WeakPolarHBondContact O-CG 3.39Å; L211-Q215 PolarHBondContact O-N 3.07Å
212	L	74.9	Confident	74.4	Confident	101 Å²	101	103.8 Å²	103.8	53%	0.529	53%	0.534	S	S	.	.	H	α-helix	trans	-67.3	-38.2	177.1	-71.1	170.3	0	0	0	111.9	C208 I209 S210 Q215 M216	C208-L212 VanDerWaalsContact O-CG 3.25Å; C208-L212 WeakPolarHBondContact O-CG 3.46Å; C208-L212 PolarHBondContact O-N 3.08Å; I209-L212 PolarHBondContact O-N 2.89Å; S210-L212 VanDerWaalsContact C-N 3.33Å; S210-L212 PolarHBondContact O-N 3Å; L212-Q215 PolarHBondContact O-N 3.36Å; L212-M216 WeakPolarHBondContact O-CG 3.45Å; L212-M216 PolarHBondContact O-N 3.13Å
213	A	75.9	Confident	75.8	Confident	48 Å²	48	106.8 Å²	106.8	40%	0.397	54%	0.539	S	S	.	.	H	α-helix	trans	-65.1	-44.3	176.2	0	0	0	0	0	111.9	I209 S210 Q215 M216 I217	I209-A213 PolarHBondContact O-N 3.37Å; S210-A213 PolarHBondContact O-N 2.86Å; A213-Q215 PolarHBondContact O-N 2.95Å; A213-M216 PolarHBondContact O-N 3.05Å; A213-I217 WeakPolarHBondContact O-CG1 3.38Å; A213-I217 PolarHBondContact O-N 3.48Å
214	D	79.7	Confident	77.2	Confident	96 Å²	96	106.1 Å²	106.1	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-41	176.6	-70.3	-24.7	0	0	0	111.5	S210 M216 I217 I218	S210-D214 PolarHBondContact O-N 3.2Å; D214-M216 VanDerWaalsContact C-N 3.35Å; D214-M216 PolarHBondContact O-N 3.08Å; D214-I217 PolarHBondContact O-N 2.87Å; D214-I218 WeakPolarHBondContact O-CD1 3.31Å; D214-I218 VanDerWaalsContact O-CG1 3.24Å; D214-I218 WeakPolarHBondContact O-CG1 3.33Å; D214-I218 PolarHBondContact O-N 3.46Å
215	Q	79.5	Confident	78.5	Confident	128 Å²	128	105.2 Å²	105.2	60%	0.598	53%	0.528	S	S	*	.	H	α-helix	trans	-63.6	-38.5	174.1	-75.7	-157.7	-13.6	0	0	112.8	L211 L212 A213 I218 Y219	L211-Q215 WeakPolarHBondContact O-CG 3.39Å; L211-Q215 PolarHBondContact O-N 3.07Å; L212-Q215 PolarHBondContact O-N 3.36Å; A213-Q215 PolarHBondContact O-N 2.95Å; Q215-I218 PolarHBondContact O-N 3.25Å; Q215-Y219 VanDerWaalsContact O-CB 3.29Å; Q215-Y219 WeakPolarHBondContact O-CB 3.48Å; Q215-Y219 PolarHBondContact O-N 3.48Å
216	M	81.9	Confident	79.7	Confident	142 Å²	142	111 Å²	111	70%	0.7	54%	0.542	S	S	*	.	H	α-helix	trans	-65.4	-40.5	175.7	-83.5	-150.6	60.1	0	0	112.7	L212 A213 D214 Y219 L220	L212-M216 WeakPolarHBondContact O-CG 3.45Å; L212-M216 PolarHBondContact O-N 3.13Å; A213-M216 PolarHBondContact O-N 3.05Å; D214-M216 VanDerWaalsContact C-N 3.35Å; D214-M216 PolarHBondContact O-N 3.08Å; M216-Y219 PolarHBondContact O-N 3.3Å; M216-L220 WeakPolarHBondContact O-CB 3.32Å; M216-L220 PolarHBondContact O-N 3.42Å
217	I	83.2	Confident	80.7	Confident	91 Å²	91	108.1 Å²	108.1	47%	0.467	54%	0.538	S	S	.	.	H	α-helix	trans	-65.2	-46.3	176.7	-68	167.7	0	0	0	110.1	A213 D214 Y219 L220 W221	A213-I217 WeakPolarHBondContact O-CG1 3.38Å; A213-I217 PolarHBondContact O-N 3.48Å; D214-I217 PolarHBondContact O-N 2.87Å; I217-Y219 VanDerWaalsContact C-N 3.31Å; I217-Y219 PolarHBondContact O-N 3.32Å; I217-L220 WeakPolarHBondContact O-CB 3.28Å; I217-L220 PolarHBondContact O-N 3.44Å; I217-W221 PolarHBondContact O-N 2.9Å
218	I	84.7	Confident	81.5	Confident	102 Å²	102	106.5 Å²	106.5	52%	0.523	53%	0.532	S	S	.	.	H	α-helix	trans	-59.6	-43.8	176.3	-67	164.6	0	0	0	110.5	D214 Q215 L220 W221 L222	D214-I218 WeakPolarHBondContact O-CD1 3.31Å; D214-I218 VanDerWaalsContact O-CG1 3.24Å; D214-I218 WeakPolarHBondContact O-CG1 3.33Å; D214-I218 PolarHBondContact O-N 3.46Å; Q215-I218 PolarHBondContact O-N 3.25Å; I218-L220 VanDerWaalsContact C-N 3.33Å; I218-L220 PolarHBondContact O-N 3.21Å; I218-W221 PolarHBondContact O-N 2.86Å; I218-L222 HydrophobicContact CG2-CD1 3.87Å; I218-L222 HydrophobicContact CG2-CG 4.34Å; I218-L222 WeakPolarHBondContact O-CB 3.29Å; I218-L222 VanDerWaalsContact O-CG 3.28Å; I218-L222 WeakPolarHBondContact O-CG 3.26Å; I218-L222 PolarHBondContact O-N 2.91Å
219	Y	84.6	Confident	82.1	Confident	146 Å²	146	108.1 Å²	108.1	57%	0.573	54%	0.535	S	S	*	.	H	α-helix	trans	-65	-36.4	178.3	-163.5	-94.1	0	0	0	112.6	Q215 M216 I217 L222 R223	Q215-Y219 VanDerWaalsContact O-CB 3.29Å; Q215-Y219 WeakPolarHBondContact O-CB 3.48Å; Q215-Y219 PolarHBondContact O-N 3.48Å; M216-Y219 PolarHBondContact O-N 3.3Å; I217-Y219 VanDerWaalsContact C-N 3.31Å; I217-Y219 PolarHBondContact O-N 3.32Å; Y219-L222 PolarHBondContact O-N 2.97Å; Y219-R223 HydrophobicContact CD1-CG 4.49Å; Y219-R223 HydrophobicContact CE1-CG 4.2Å; Y219-R223 WeakPolarHBondContact O-CB 3.24Å; Y219-R223 PolarHBondContact O-N 2.97Å
220	L	86.4	Confident	82.3	Confident	101 Å²	101	104.5 Å²	104.5	53%	0.529	52%	0.518	S	S	.	.	H	α-helix	trans	-65.6	-45.3	174.6	-173.9	67.7	0	0	0	111.4	M216 I217 I218 R223 I224	M216-L220 WeakPolarHBondContact O-CB 3.32Å; M216-L220 PolarHBondContact O-N 3.42Å; I217-L220 WeakPolarHBondContact O-CB 3.28Å; I217-L220 PolarHBondContact O-N 3.44Å; I218-L220 VanDerWaalsContact C-N 3.33Å; I218-L220 PolarHBondContact O-N 3.21Å; L220-R223 PolarHBondContact O-N 3.41Å; L220-I224 HydrophobicContact CD1-CD1 4.5Å; L220-I224 HydrophobicContact CG-CD1 4.05Å; L220-I224 VanDerWaalsContact O-CG1 3.31Å; L220-I224 WeakPolarHBondContact O-CG1 3.47Å; L220-I224 PolarHBondContact O-N 3.49Å
221	W	88.8	Confident	82.3	Confident	177 Å²	177	108.6 Å²	108.6	67%	0.67	53%	0.529	S	S	*	.	H	α-helix	trans	-65.6	-37.1	175.6	-79.8	105	0	0	0	112.6	I217 I218 I224 G225	I217-W221 PolarHBondContact O-N 2.9Å; I218-W221 PolarHBondContact O-N 2.86Å; W221-I224 PolarHBondContact O-N 2.76Å; W221-G225 PolarHBondContact O-N 2.76Å
222	L	91.1	Very high	81.9	Confident	113 Å²	113	108.3 Å²	108.3	59%	0.592	53%	0.528	S	S	*	.	H	α-helix	trans	-64.7	-40.4	172.4	-73.9	169.8	0	0	0	111.5	I218 Y219 G225 W226	I218-L222 HydrophobicContact CG2-CD1 3.87Å; I218-L222 HydrophobicContact CG2-CG 4.34Å; I218-L222 WeakPolarHBondContact O-CB 3.29Å; I218-L222 VanDerWaalsContact O-CG 3.28Å; I218-L222 WeakPolarHBondContact O-CG 3.26Å; I218-L222 PolarHBondContact O-N 2.91Å; Y219-L222 PolarHBondContact O-N 2.97Å; L222-G225 PolarHBondContact O-N 3.35Å; L222-W226 VanDerWaalsContact O-CB 3.23Å; L222-W226 WeakPolarHBondContact O-CB 3.2Å; L222-W226 PolarHBondContact O-N 2.91Å
223	R	88.1	Confident	81.4	Confident	157 Å²	157	110.2 Å²	110.2	59%	0.592	54%	0.537	S	S	*	.	H	α-helix	trans	-66.1	-43	174.1	-95.1	-165.9	176.6	-166.5	1.5	112.9	Y219 L220 W226 L227	Y219-R223 HydrophobicContact CD1-CG 4.49Å; Y219-R223 HydrophobicContact CE1-CG 4.2Å; Y219-R223 WeakPolarHBondContact O-CB 3.24Å; Y219-R223 PolarHBondContact O-N 2.97Å; L220-R223 PolarHBondContact O-N 3.41Å; R223-W226 PolarHBondContact O-N 3.46Å; R223-L227 WeakPolarHBondContact O-CB 3.25Å; R223-L227 WeakPolarHBondContact O-CG 3.1Å; R223-L227 PolarHBondContact O-N 3.14Å
224	I	89.8	Confident	80.4	Confident	68 Å²	68	116 Å²	116	35%	0.349	55%	0.554	S	S	.	*	H	α-helix	trans	-64.9	-44.7	176.1	-68.1	166.5	0	0	0	109.5	L220 W221 W226 L227 I228	L220-I224 HydrophobicContact CD1-CD1 4.5Å; L220-I224 HydrophobicContact CG-CD1 4.05Å; L220-I224 VanDerWaalsContact O-CG1 3.31Å; L220-I224 WeakPolarHBondContact O-CG1 3.47Å; L220-I224 PolarHBondContact O-N 3.49Å; W221-I224 PolarHBondContact O-N 2.76Å; I224-W226 VanDerWaalsContact C-N 3.31Å; I224-W226 PolarHBondContact O-N 2.79Å; I224-L227 PolarHBondContact O-N 2.83Å; I224-I228 HydrophobicContact CG2-CD1 3.7Å; I224-I228 HydrophobicContact CG2-CG1 4.35Å; I224-I228 WeakPolarHBondContact O-CB 3.32Å; I224-I228 WeakPolarHBondContact O-CG1 3.05Å; I224-I228 PolarHBondContact O-N 3.25Å
225	G	87.7	Confident	79.2	Confident	36 Å²	36	115.7 Å²	115.7	37%	0.371	56%	0.555	S	S	.	*	H	α-helix	trans	-59.4	-41.1	174.5	0	0	0	0	0	112.1	W221 L222 I228 L229	W221-G225 PolarHBondContact O-N 2.76Å; L222-G225 PolarHBondContact O-N 3.35Å; G225-I228 PolarHBondContact O-N 3.03Å; G225-L229 VanDerWaalsContact O-CB 3.26Å; G225-L229 WeakPolarHBondContact O-CB 3.35Å; G225-L229 PolarHBondContact O-N 2.78Å
226	W	86.5	Confident	78.1	Confident	174 Å²	174	115.1 Å²	115.1	66%	0.659	56%	0.561	S	S	*	*	H	α-helix	trans	-71.3	-37	176.2	-160	80.6	0	0	0	112.6	L222 R223 I224 L229 T230	L222-W226 VanDerWaalsContact O-CB 3.23Å; L222-W226 WeakPolarHBondContact O-CB 3.2Å; L222-W226 PolarHBondContact O-N 2.91Å; R223-W226 PolarHBondContact O-N 3.46Å; I224-W226 VanDerWaalsContact C-N 3.31Å; I224-W226 PolarHBondContact O-N 2.79Å; W226-L229 PolarHBondContact O-N 3.42Å; W226-T230 HydrophobicContact CD2-CG2 3.85Å; W226-T230 HydrophobicContact CE3-CG2 3.82Å; W226-T230 HydrophobicContact CH2-CG2 3.91Å; W226-T230 HydrophobicContact CZ2-CG2 3.93Å; W226-T230 HydrophobicContact CZ3-CG2 3.85Å; W226-T230 VanDerWaalsContact O-CB 3.32Å; W226-T230 WeakPolarHBondContact O-CB 3.38Å; W226-T230 VanDerWaalsContact O-CG2 3.27Å; W226-T230 WeakPolarHBondContact O-CG2 3.14Å; W226-T230 PolarHBondContact O-N 3.48Å; W226-T230 PolarHBondContact O-OG1 3.15Å
227	L	84.6	Confident	77.1	Confident	108 Å²	108	116.7 Å²	116.7	57%	0.565	57%	0.566	S	S	*	*	H	α-helix	trans	-64.5	-41	171.4	-79.3	165.9	0	0	0	111.7	R223 I224 T230 F231	R223-L227 WeakPolarHBondContact O-CB 3.25Å; R223-L227 WeakPolarHBondContact O-CG 3.1Å; R223-L227 PolarHBondContact O-N 3.14Å; I224-L227 PolarHBondContact O-N 2.83Å; L227-T230 WeakPolarHBondContact CA-OG1 3.16Å; L227-T230 PolarHBondContact O-OG1 3.15Å; L227-T230 VanDerWaalsContact O-OG1 3.11Å; L227-F231 WeakPolarHBondContact O-CB 3.31Å; L227-F231 PolarHBondContact O-N 3.4Å
228	I	82.5	Confident	76.5	Confident	95 Å²	95	114.9 Å²	114.9	49%	0.487	57%	0.565	S	S	.	*	H	α-helix	trans	-67.2	-43.8	174.2	-67.2	166.5	0	0	0	109.8	I224 G225 F231 N232	I224-I228 HydrophobicContact CG2-CD1 3.7Å; I224-I228 HydrophobicContact CG2-CG1 4.35Å; I224-I228 WeakPolarHBondContact O-CB 3.32Å; I224-I228 WeakPolarHBondContact O-CG1 3.05Å; I224-I228 PolarHBondContact O-N 3.25Å; G225-I228 PolarHBondContact O-N 3.03Å; I228-F231 PolarHBondContact O-N 2.54Å; I228-N232 VanDerWaalsContact CG2-ND2 3.32Å; I228-N232 WeakPolarHBondContact CG2-ND2 3.32Å; I228-N232 WeakPolarHBondContact O-CB 3.32Å; I228-N232 PolarHBondContact O-N 2.87Å; I228-N232 PolarHBondContact O-ND2 3.21Å
229	L	78.3	Confident	76.5	Confident	107 Å²	107	112.5 Å²	112.5	56%	0.56	56%	0.555	S	S	*	*	H	α-helix	trans	-64.4	-46.6	179.6	-162.7	93.2	0	0	0	110.9	G225 W226 N232 L233	G225-L229 VanDerWaalsContact O-CB 3.26Å; G225-L229 WeakPolarHBondContact O-CB 3.35Å; G225-L229 PolarHBondContact O-N 2.78Å; W226-L229 PolarHBondContact O-N 3.42Å; L229-N232 PolarHBondContact O-N 2.84Å; L229-L233 WeakPolarHBondContact O-CB 3.43Å; L229-L233 PolarHBondContact O-N 2.82Å
230	T	74.5	Confident	76.7	Confident	33 Å²	33	106.6 Å²	106.6	20%	0.202	54%	0.535	C	S	.	.	H	α-helix	trans	-65.7	-41.3	175.7	50.1	0	0	0	0	111.3	W226 L227 N232 L233 F234	W226-T230 HydrophobicContact CD2-CG2 3.85Å; W226-T230 HydrophobicContact CE3-CG2 3.82Å; W226-T230 HydrophobicContact CH2-CG2 3.91Å; W226-T230 HydrophobicContact CZ2-CG2 3.93Å; W226-T230 HydrophobicContact CZ3-CG2 3.85Å; W226-T230 VanDerWaalsContact O-CB 3.32Å; W226-T230 WeakPolarHBondContact O-CB 3.38Å; W226-T230 VanDerWaalsContact O-CG2 3.27Å; W226-T230 WeakPolarHBondContact O-CG2 3.14Å; W226-T230 PolarHBondContact O-N 3.48Å; W226-T230 PolarHBondContact O-OG1 3.15Å; L227-T230 WeakPolarHBondContact CA-OG1 3.16Å; L227-T230 PolarHBondContact O-OG1 3.15Å; L227-T230 VanDerWaalsContact O-OG1 3.11Å; T230-N232 VanDerWaalsContact C-N 3.35Å; T230-N232 PolarHBondContact O-N 2.96Å; T230-L233 CarbonylContact O-C 3.57Å; T230-L233 PolarHBondContact O-N 3.21Å; T230-F234 VanDerWaalsContact O-CB 3.27Å; T230-F234 WeakPolarHBondContact O-CB 3.33Å; T230-F234 WeakPolarHBondContact O-CD2 3.43Å; T230-F234 PolarHBondContact O-N 3.21Å
231	F	71.9	Confident	76.9	Confident	149 Å²	149	102.1 Å²	102.1	65%	0.654	51%	0.512	S	S	*	.	H	α-helix	trans	-61.2	-42.1	174.1	-174.9	-99.1	0	0	0	111.8	L227 I228 F234 V235	L227-F231 WeakPolarHBondContact O-CB 3.31Å; L227-F231 PolarHBondContact O-N 3.4Å; I228-F231 PolarHBondContact O-N 2.54Å; F231-F234 CarbonylContact O-C 3.58Å; F231-F234 PolarHBondContact O-N 2.95Å; F231-V235 PolarHBondContact O-N 3.5Å
232	N	65.4	Low	77.1	Confident	103 Å²	103	95.7 Å²	95.7	55%	0.551	49%	0.489	S	S	*	.	H	α-helix	trans	-70	-30.4	174.2	-78.1	-78.9	0	0	0	112.8	I228 L229 T230	I228-N232 VanDerWaalsContact CG2-ND2 3.32Å; I228-N232 WeakPolarHBondContact CG2-ND2 3.32Å; I228-N232 WeakPolarHBondContact O-CB 3.32Å; I228-N232 PolarHBondContact O-N 2.87Å; I228-N232 PolarHBondContact O-ND2 3.21Å; L229-N232 PolarHBondContact O-N 2.84Å; T230-N232 VanDerWaalsContact C-N 3.35Å; T230-N232 PolarHBondContact O-N 2.96Å
233	L	63.9	Low	77.1	Confident	140 Å²	140	90.5 Å²	90.5	73%	0.733	46%	0.462	S	S	*	.	H	α-helix	trans	-72.2	-30.3	170.6	-122.5	98.1	0	0	0	112.2	L229 T230	L229-L233 WeakPolarHBondContact O-CB 3.43Å; L229-L233 PolarHBondContact O-N 2.82Å; T230-L233 CarbonylContact O-C 3.57Å; T230-L233 PolarHBondContact O-N 3.21Å
234	F	56	Low	77.3	Confident	171 Å²	171	88.6 Å²	88.6	75%	0.75	46%	0.458	S	S	*	.	H	α-helix	trans	-86.5	-9.3	178.2	-95.8	-81.6	0	0	0	113.5	T230 F231 T236	T230-F234 VanDerWaalsContact O-CB 3.27Å; T230-F234 WeakPolarHBondContact O-CB 3.33Å; T230-F234 WeakPolarHBondContact O-CD2 3.43Å; T230-F234 PolarHBondContact O-N 3.21Å; F231-F234 CarbonylContact O-C 3.58Å; F231-F234 PolarHBondContact O-N 2.95Å; F234-T236 PolarHBondContact O-N 3.48Å
235	V	53.8	Low	77.5	Confident	89 Å²	89	92 Å²	92	54%	0.539	47%	0.466	S	S	.	.	S	Bend	trans	-65.1	86	154.5	-178.2	0	0	0	0	105	F231 Q237	F231-V235 PolarHBondContact O-N 3.5Å; V235-Q237 PolarHBondContact O-N 2.76Å
236	T	57	Low	77.7	Confident	115 Å²	115	91.3 Å²	91.3	71%	0.706	46%	0.455	S	S	*	.			trans	-46.3	116.5	172.9	49.7	0	0	0	0	106.5	F234 A238	F234-T236 PolarHBondContact O-N 3.48Å; T236-A238 PolarHBondContact O-N 3.44Å
237	Q	60.7	Low	77.8	Confident	175 Å²	175	85.6 Å²	85.6	82%	0.818	45%	0.445	S	S	*	.			trans	-50.1	119.8	168.3	-74.4	174.5	-13.9	0	0	106.3	V235 V239	V235-Q237 PolarHBondContact O-N 2.76Å; Q237-V239 WeakPolarHBondContact O-CG2 3.4Å; Q237-V239 PolarHBondContact O-N 3.27Å
238	A	70.1	Confident	78.1	Confident	53 Å²	53	83.7 Å²	83.7	44%	0.438	43%	0.433	S	S	.	.			trans	-56.8	115.6	173.2	0	0	0	0	0	106.4	T236 E578	T236-A238 PolarHBondContact O-N 3.44Å; A238-E578 HydrophobicContact CB-CG 3.69Å
239	V	84.4	Confident	78.3	Confident	52 Å²	52	86 Å²	86	32%	0.315	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-83.6	141.4	-176.7	-172.5	0	0	0	0	107.5	Q237 Y531 G574 D575	Q237-V239 WeakPolarHBondContact O-CG2 3.4Å; Q237-V239 PolarHBondContact O-N 3.27Å; V239-Y531 HydrophobicContact CG1-CD2 4.27Å; V239-Y531 HydrophobicContact CG1-CE1 4.25Å; V239-Y531 HydrophobicContact CG1-CE2 3.65Å; V239-G574 CarbonylContact O-C 3.58Å; V239-G574 VanDerWaalsContact O-CA 3.22Å; V239-G574 WeakPolarHBondContact O-CA 3.16Å; V239-D575 PolarHBondContact O-N 3.17Å
240	S	88.9	Confident	78.2	Confident	23 Å²	23	83.5 Å²	83.5	16%	0.161	44%	0.436	C	S	.	.	B	Isolated β-bridge	trans	-61.4	163.2	171.5	56.4	0	0	0	0	111.8	H242 Y531	S240-H242 PolarHBondContact O-N 2.84Å; S240-H242 PolarHBondContact O-ND1 3.33Å; S240-Y531 VanDerWaalsContact OG-CD2 3.3Å; S240-Y531 WeakPolarHBondContact OG-CD2 3.43Å
241	L	91.3	Very high	77.7	Confident	6 Å²	6	91.7 Å²	91.7	3%	0.031	47%	0.469	C	S	.	.	P	Polyproline II helix	trans	-53.9	128.5	175.4	-66.2	169.8	0	0	0	110.8	V514 S529 L572 A573 G574 W576 S579	L241-V514 HydrophobicContact CD1-CB 4.38Å; L241-V514 HydrophobicContact CD1-CG1 4.13Å; L241-S529 CarbonylContact O-C 3.53Å; L241-S529 VanDerWaalsContact O-CA 3.24Å; L241-S529 WeakPolarHBondContact O-CA 3.32Å; L241-L572 HydrophobicContact CB-CD1 4Å; L241-L572 HydrophobicContact CD2-CD1 4.36Å; L241-L572 HydrophobicContact CD2-CD2 4.18Å; L241-L572 HydrophobicContact CD2-CG 4.03Å; L241-A573 CarbonylContact C-O 3.53Å; L241-A573 VanDerWaalsContact CA-O 3.3Å; L241-A573 WeakPolarHBondContact CA-O 3.48Å; L241-G574 WeakPolarHBondContact CD2-O 3.16Å; L241-W576 HydrophobicContact CD1-CB 3.69Å; L241-W576 HydrophobicContact CD2-CB 4.3Å; L241-W576 HydrophobicContact CG-CB 4.07Å; L241-S579 WeakPolarHBondContact CB-OG 3.35Å; L241-S579 WeakPolarHBondContact CG-OG 3.36Å; L241-S579 PolarHBondContact N-OG 3.23Å
242	H	91.6	Very high	77.5	Confident	43 Å²	43	92 Å²	92	20%	0.199	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	142.7	176.7	61.1	-81.2	0	0	0	110.9	S240 Y531 A573	S240-H242 PolarHBondContact O-N 2.84Å; S240-H242 PolarHBondContact O-ND1 3.33Å; H242-Y531 HydrophobicContact CB-CD1 4.27Å; H242-Y531 HydrophobicContact CB-CG 4.04Å; H242-A573 PolarHBondContact N-O 3.22Å; H242-A573 PolarHBondContact ND1-O 3.21Å; H242-A573 PolarHBondContact O-N 3.39Å
243	W	93.1	Very high	78.5	Confident	4 Å²	4	90.9 Å²	90.9	2%	0.015	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	139.4	176.8	-71.3	103.4	0	0	0	111.4	Y493 S529 P538 M555 W570 L572	W243-Y493 HydrophobicContact CH2-CD1 4.16Å; W243-Y493 HydrophobicContact CH2-CE1 4.26Å; W243-Y493 HydrophobicContact CH2-CG 4.48Å; W243-Y493 AromaticContact CZ2-CD1 3.89Å; W243-Y493 HydrophobicContact CZ2-CD1 3.89Å; W243-Y493 AromaticContact CZ2-CD2 3.93Å; W243-Y493 HydrophobicContact CZ2-CD2 3.93Å; W243-Y493 AromaticContact CZ2-CE1 3.84Å; W243-Y493 HydrophobicContact CZ2-CE1 3.84Å; W243-Y493 AromaticContact CZ2-CE2 3.88Å; W243-Y493 HydrophobicContact CZ2-CE2 3.88Å; W243-Y493 AromaticContact CZ2-CG 3.94Å; W243-Y493 HydrophobicContact CZ2-CG 3.94Å; W243-Y493 AromaticContact CZ2-CZ 3.84Å; W243-S529 PolarHBondContact NE1-OG 3.13Å; W243-S529 VanDerWaalsContact NE1-OG 3.09Å; W243-P538 HydrophobicContact CB-CG 4.5Å; W243-P538 HydrophobicContact CD2-CG 3.67Å; W243-P538 HydrophobicContact CE3-CG 4.18Å; W243-P538 HydrophobicContact CG-CG 3.82Å; W243-P538 HydrophobicContact CZ2-CG 4.31Å; W243-M555 HydrophobicContact CH2-CB 4.32Å; W243-M555 HydrophobicContact CH2-CE 3.91Å; W243-M555 HydrophobicContact CH2-SD 4.07Å; W243-M555 HydrophobicContact CZ3-CB 4.14Å; W243-M555 HydrophobicContact CZ3-CE 3.91Å; W243-M555 HydrophobicContact CZ3-SD 4.5Å; W243-W570 HydrophobicContact CB-CE3 3.93Å; W243-W570 HydrophobicContact CB-CZ3 4.01Å; W243-W570 HydrophobicContact CE3-CB 3.88Å; W243-W570 HydrophobicContact CZ3-CB 3.97Å; W243-L572 HydrophobicContact CD2-CB 4.16Å; W243-L572 HydrophobicContact CD2-CD1 3.81Å; W243-L572 HydrophobicContact CE3-CB 3.77Å; W243-L572 HydrophobicContact CE3-CD1 4.3Å; W243-L572 HydrophobicContact CG-CD1 4.07Å; W243-L572 HydrophobicContact CH2-CB 3.84Å; W243-L572 HydrophobicContact CH2-CD2 4.23Å; W243-L572 HydrophobicContact CH2-CG 4.48Å; W243-L572 HydrophobicContact CZ2-CB 4.18Å; W243-L572 HydrophobicContact CZ2-CD1 4.18Å; W243-L572 HydrophobicContact CZ2-CD2 3.98Å; W243-L572 HydrophobicContact CZ2-CG 4.36Å; W243-L572 HydrophobicContact CZ3-CB 3.62Å
244	K	92.3	Very high	79.9	Confident	117 Å²	117	88.6 Å²	88.6	51%	0.509	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	137.7	171.9	-171	178.1	177.9	178.3	0	109.7	W570 M571	K244-W570 VanDerWaalsContact C-CE3 3.43Å; K244-M571 HydrophobicContact CD-CE 4.46Å; K244-M571 PolarHBondContact N-O 3.01Å; K244-M571 PolarHBondContact O-N 3.4Å
245	R	92.4	Very high	81.8	Confident	138 Å²	138	80.5 Å²	80.5	52%	0.521	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	134.5	169.4	-72.3	-175.5	176.2	-92.2	-1.6	109.4	A247 D568 W570	R245-A247 PolarHBondContact O-N 3.24Å; R245-D568 IonicContact NH2-OD2 3.44Å; R245-W570 HydrophobicContact CG-CD2 3.9Å; R245-W570 HydrophobicContact CG-CE3 3.83Å; R245-W570 HydrophobicContact CG-CH2 3.57Å; R245-W570 HydrophobicContact CG-CZ2 3.62Å; R245-W570 HydrophobicContact CG-CZ3 3.66Å; R245-W570 VanDerWaalsContact CZ-CZ2 3.45Å
246	V	93.2	Very high	83.8	Confident	22 Å²	22	81.6 Å²	81.6	13%	0.133	42%	0.421	C	S	.	.			trans	-67.8	131.2	176	-178.2	0	0	0	0	108.6	E248 F291 Y554 F569 M571	V246-E248 PolarHBondContact O-N 3.38Å; V246-F291 HydrophobicContact CG1-CE1 3.81Å; V246-F291 HydrophobicContact CG1-CE2 4.41Å; V246-F291 HydrophobicContact CG1-CZ 3.5Å; V246-Y554 HydrophobicContact CG2-CD1 3.84Å; V246-Y554 HydrophobicContact CG2-CE1 3.78Å; V246-F569 HydrophobicContact CB-CB 4.4Å; V246-F569 HydrophobicContact CB-CD1 3.55Å; V246-F569 HydrophobicContact CB-CE1 3.93Å; V246-F569 HydrophobicContact CB-CG 3.96Å; V246-F569 HydrophobicContact CG1-CD1 3.72Å; V246-F569 HydrophobicContact CG1-CE1 3.69Å; V246-F569 HydrophobicContact CG2-CD1 3.79Å; V246-F569 HydrophobicContact CG2-CD2 4.12Å; V246-F569 HydrophobicContact CG2-CE1 3.91Å; V246-F569 HydrophobicContact CG2-CE2 4.21Å; V246-F569 HydrophobicContact CG2-CG 3.89Å; V246-F569 HydrophobicContact CG2-CZ 4.1Å; V246-F569 PolarHBondContact N-O 3.33Å; V246-M571 HydrophobicContact CG2-CB 3.85Å
247	A	88.3	Confident	85.7	Confident	55 Å²	55	77 Å²	77	46%	0.455	40%	0.395	S	S	.	.			trans	-75.1	115.4	176	0	0	0	0	0	109.4	R245 Y249	R245-A247 PolarHBondContact O-N 3.24Å; A247-Y249 HydrophobicContact CB-CE2 4.43Å
248	E	90.5	Very high	87.4	Confident	67 Å²	67	68.6 Å²	68.6	31%	0.313	36%	0.356	S	S	.	.			trans	-104.5	119.8	177.4	-62.2	178	-126.4	0	0	109.2	V246 R254 F291 G296 W298	V246-E248 PolarHBondContact O-N 3.38Å; E248-R254 IonicContact OE2-NE 2.92Å; E248-F291 HydrophobicContact CG-CE2 4.15Å; E248-G296 WeakPolarHBondContact CA-O 3.49Å; E248-W298 PolarHBondContact OE2-NE1 3.46Å; E248-W298 VanDerWaalsContact OE2-NE1 3.08Å
249	Y	86.2	Confident	88.7	Confident	144 Å²	144	67.5 Å²	67.5	57%	0.565	34%	0.341	S	S	*	.			trans	-95.3	131.4	-176.1	-63.4	-68.5	0	0	0	112.3	A247 G296 R297	A247-Y249 HydrophobicContact CB-CE2 4.43Å; Y249-G296 PolarHBondContact N-O 2.75Å; Y249-R297 WeakPolarHBondContact O-CG 3.23Å; Y249-R297 PolarHBondContact O-NE 3.17Å; Y249-R297 PolarHBondContact O-NH1 2.8Å
250	G	76	Confident	89.2	Confident	54 Å²	54	67 Å²	67	56%	0.557	34%	0.335	S	S	*	.	S	Bend	trans	98.3	167.3	175	0	0	0	0	0	115.2
251	K	65.1	Low	89.6	Confident	205 Å²	205	66.2 Å²	66.2	89%	0.891	33%	0.33	S	S	*	.	S	Bend	trans	-110.9	84.2	173.9	-69.7	-177.2	177.5	-177.1	0	107.9
252	N	67.1	Low	89.8	Confident	157 Å²	157	66.1 Å²	66.1	84%	0.84	33%	0.33	S	S	*	.	S	Bend	trans	-179.1	161.3	172.4	-92.1	-16.3	0	0	0	109.7
253	P	85.7	Confident	90	Very high	79 Å²	79	64.1 Å²	64.1	51%	0.513	32%	0.321	S	S	.	.				-70.6	151.3	-120.8	34.7	-40.5	0	0	0	114.1	W289	P253-W289 HydrophobicContact CB-CH2 3.89Å; P253-W289 HydrophobicContact CB-CZ3 4.27Å; P253-W289 HydrophobicContact CG-CH2 4.17Å; P253-W289 HydrophobicContact CG-CZ3 4.24Å; P253-W289 VanDerWaalsContact O-CZ3 3.27Å; P253-W289 WeakPolarHBondContact O-CZ3 3.24Å
254	R	93.8	Very high	90	Very high	92 Å²	92	64.1 Å²	64.1	35%	0.347	32%	0.323	S	S	.	.			trans	-126	155.5	178.1	63.5	-175.7	-81	-99	11.4	110.2	E248 W298 D567	E248-R254 IonicContact OE2-NE 2.92Å; R254-W298 HydrophobicContact CB-CG 4.41Å; R254-D567 IonicContact CZ-OD1 2.77Å; R254-D567 IonicContact CZ-OD2 2.69Å; R254-D567 IonicContact NH1-OD1 3.45Å; R254-D567 IonicContact NH1-OD2 3.52Å; R254-D567 PolarHBondContact NH1-OD2 2.82Å; R254-D567 VanDerWaalsContact NH2-C 3.26Å; R254-D567 PolarHBondContact NH2-O 3.34Å; R254-D567 IonicContact NH2-OD1 3.55Å; R254-D567 PolarHBondContact NH2-OD1 3.11Å; R254-D567 IonicContact NH2-OD2 2.68Å; R254-D567 PolarHBondContact NH2-OD2 2.7Å
255	P	95.9	Very high	90.1	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-57.3	143.3	174.9	20.8	-31.9	0	0	0	112.1	L274 W289 W298 F556	P255-L274 HydrophobicContact CB-CD2 3.5Å; P255-L274 VanDerWaalsContact CB-CD2 3.5Å; P255-L274 HydrophobicContact CG-CD2 3.68Å; P255-W289 HydrophobicContact CB-CD2 4.05Å; P255-W289 HydrophobicContact CB-CG 3.94Å; P255-W289 HydrophobicContact CG-CD2 4.35Å; P255-W289 HydrophobicContact CG-CG 4.29Å; P255-W298 HydrophobicContact CG-CD2 4.03Å; P255-W298 HydrophobicContact CG-CE3 4.04Å; P255-W298 HydrophobicContact CG-CH2 4.14Å; P255-W298 HydrophobicContact CG-CZ2 4.13Å; P255-W298 HydrophobicContact CG-CZ3 4.09Å; P255-F556 HydrophobicContact CB-CE1 4.08Å; P255-F556 HydrophobicContact CB-CZ 3.76Å; P255-F556 HydrophobicContact CG-CE1 4.05Å; P255-F556 HydrophobicContact CG-CE2 3.78Å; P255-F556 HydrophobicContact CG-CZ 3.44Å; P255-F556 VanDerWaalsContact CG-CZ 3.44Å
256	Q	95.1	Very high	90.2	Very high	112 Å²	112	53.4 Å²	53.4	52%	0.523	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-73	163.8	174.8	-65.6	175.6	-11.4	0	0	111.9	R258 Y285	Q256-R258 PolarHBondContact O-N 3.26Å; Q256-R258 PolarHBondContact O-NE 3.4Å; Q256-Y285 PolarHBondContact OE1-OH 2.8Å
257	A	96.9	Very high	89.9	Confident	18 Å²	18	56.4 Å²	56.4	15%	0.149	29%	0.293	C	S	.	.	S	Bend	trans	-56.7	130.1	175	0	0	0	0	0	111.6	L565 L566 D567	A257-L565 HydrophobicContact CB-CB 3.84Å; A257-L566 VanDerWaalsContact CA-O 3.27Å; A257-L566 WeakPolarHBondContact CA-O 3.05Å; A257-D567 HydrophobicContact CB-CB 3.91Å
258	R	97.7	Very high	89.9	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.299	C	S	.	.			trans	-161.6	159.1	-173.9	64.7	-170.2	69.1	-161.7	-2.3	112.4	Q256 A261 G276 Q278 Y285 D287 F556 G558 L566	Q256-R258 PolarHBondContact O-N 3.26Å; Q256-R258 PolarHBondContact O-NE 3.4Å; R258-A261 HydrophobicContact CG-CB 4.3Å; R258-G276 VanDerWaalsContact CD-O 3.31Å; R258-G276 WeakPolarHBondContact CD-O 3.3Å; R258-G276 PolarHBondContact NH1-O 3.44Å; R258-Q278 CarbonylContact C-O 3.59Å; R258-Q278 VanDerWaalsContact CA-O 3.22Å; R258-Q278 WeakPolarHBondContact CA-O 3.18Å; R258-Y285 HydrophobicContact CB-CD2 4.15Å; R258-Y285 HydrophobicContact CB-CE2 3.92Å; R258-D287 IonicContact CZ-OD1 3.21Å; R258-D287 IonicContact CZ-OD2 3.89Å; R258-D287 IonicContact NH1-OD1 2.76Å; R258-D287 PolarHBondContact NH1-OD1 3.11Å; R258-D287 IonicContact NH1-OD2 2.67Å; R258-D287 PolarHBondContact NH1-OD2 2.81Å; R258-D287 IonicContact NH2-OD1 2.76Å; R258-D287 IonicContact NH2-OD2 2.79Å; R258-D287 PolarHBondContact NH2-OD2 3.29Å; R258-F556 HydrophobicContact CG-CE1 3.96Å; R258-G558 PolarHBondContact O-N 2.79Å; R258-L566 PolarHBondContact N-O 3.1Å
259	K	96.4	Very high	90.1	Very high	29 Å²	29	59.7 Å²	59.7	13%	0.126	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-126.4	166.1	169.9	64.2	175.7	176.8	-178.1	0	111	A261 G277 Q278 A543 E559 L565	K259-A261 PolarHBondContact O-N 2.78Å; K259-A261 VanDerWaalsContact O-N 3.17Å; K259-G277 CarbonylContact O-C 3.58Å; K259-G277 VanDerWaalsContact O-CA 3.31Å; K259-G277 WeakPolarHBondContact O-CA 3.33Å; K259-Q278 VanDerWaalsContact CE-OE1 3.25Å; K259-Q278 HydrophobicContact CG-CB 4.15Å; K259-Q278 PolarHBondContact N-O 2.95Å; K259-Q278 PolarHBondContact O-N 3.32Å; K259-A543 WeakPolarHBondContact CA-O 3.45Å; K259-A543 HydrophobicContact CB-CB 3.79Å; K259-A543 HydrophobicContact CD-CB 4.28Å; K259-A543 HydrophobicContact CG-CB 4.45Å; K259-E559 HydrophobicContact CD-CB 4.13Å; K259-E559 WeakPolarHBondContact CD-OE2 3.2Å; K259-E559 IonicContact NZ-OE2 3.06Å; K259-E559 PolarHBondContact NZ-OE2 3.42Å; K259-L565 HydrophobicContact CB-CD2 4.05Å; K259-L565 HydrophobicContact CD-CD2 3.89Å; K259-L565 HydrophobicContact CG-CD2 3.86Å
260	H	95.7	Very high	90.4	Very high	41 Å²	41	56.2 Å²	56.2	19%	0.19	29%	0.287	C	S	.	.	S	Bend	trans	56.9	30.3	175.2	-65.5	-62	0	0	0	114.1	H311 G312 E471 A543	H260-H311 HydrophobicContact CB-CB 4.04Å; H260-G312 PolarHBondContact O-N 2.85Å; H260-E471 IonicContact CE1-OE1 2.81Å; H260-E471 PolarHBondContact CE1-OE1 2.8Å; H260-E471 IonicContact NE2-OE1 3.59Å; H260-E471 PolarHBondContact NE2-OE1 2.8Å; H260-A543 WeakPolarHBondContact CE1-CB 3.41Å; H260-A543 PolarHBondContact N-O 3.35Å; H260-A543 WeakPolarHBondContact NE2-CB 3.05Å
261	A	97	Very high	91.3	Very high	7 Å²	7	56 Å²	56	6%	0.058	27%	0.27	C	S	.	.			trans	-84	152.9	176.5	0	0	0	0	0	110.8	R258 K259 L274 G276 S545	R258-A261 HydrophobicContact CG-CB 4.3Å; K259-A261 PolarHBondContact O-N 2.78Å; K259-A261 VanDerWaalsContact O-N 3.17Å; A261-L274 HydrophobicContact CB-CD1 3.46Å; A261-L274 VanDerWaalsContact CB-CD1 3.46Å; A261-G276 WeakPolarHBondContact CB-O 3.47Å; A261-S545 PolarHBondContact O-OG 3.49Å
262	A	95.8	Very high	92.8	Very high	4 Å²	4	46.2 Å²	46.2	3%	0.033	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	133.1	174	0	0	0	0	0	109.6	L274 F275 F315 F322 L324	A262-L274 CarbonylContact O-C 3.5Å; A262-L274 WeakPolarHBondContact O-CA 3.43Å; A262-F275 HydrophobicContact CB-CB 4.44Å; A262-F275 PolarHBondContact N-O 2.93Å; A262-F275 PolarHBondContact O-N 2.78Å; A262-F315 VanDerWaalsContact CA-CD1 3.48Å; A262-F315 HydrophobicContact CB-CB 3.83Å; A262-F315 HydrophobicContact CB-CD1 3.56Å; A262-F315 HydrophobicContact CB-CE1 4.29Å; A262-F315 HydrophobicContact CB-CG 3.74Å; A262-F322 HydrophobicContact CB-CE1 4.35Å; A262-F322 HydrophobicContact CB-CZ 3.72Å; A262-L324 HydrophobicContact CB-CD1 3.5Å; A262-L324 VanDerWaalsContact CB-CD1 3.5Å
263	F	95.6	Very high	94.2	Very high	1 Å²	1	38.7 Å²	38.7	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	103.3	-167.3	-163.7	-109	0	0	0	113.1	V272 V273 L274 W298 F315 S545 A547 F556 F569	F263-V272 HydrophobicContact CD1-CG1 4.22Å; F263-V272 HydrophobicContact CD2-CG1 3.92Å; F263-V272 HydrophobicContact CE1-CG1 3.65Å; F263-V272 HydrophobicContact CE2-CG1 3.32Å; F263-V272 HydrophobicContact CG-CG1 4.37Å; F263-V272 HydrophobicContact CZ-CG1 3.19Å; F263-V273 CarbonylContact C-O 3.56Å; F263-V273 VanDerWaalsContact CA-O 3.27Å; F263-V273 WeakPolarHBondContact CA-O 3.43Å; F263-L274 HydrophobicContact CD2-CB 3.82Å; F263-L274 HydrophobicContact CD2-CD1 3.57Å; F263-L274 HydrophobicContact CD2-CG 4.28Å; F263-L274 HydrophobicContact CE2-CB 4.12Å; F263-L274 HydrophobicContact CE2-CD1 4.17Å; F263-W298 HydrophobicContact CE2-CH2 4.21Å; F263-F315 HydrophobicContact CB-CZ 4.48Å; F263-F315 WeakPolarHBondContact O-CE2 3.4Å; F263-S545 VanDerWaalsContact CB-CB 3.48Å; F263-A547 HydrophobicContact CD1-CB 3.61Å; F263-A547 HydrophobicContact CE1-CB 3.97Å; F263-F556 HydrophobicContact CE2-CB 3.88Å; F263-F556 HydrophobicContact CZ-CB 3.85Å; F263-F569 AromaticContact CZ-CE2 3.84Å; F263-F569 HydrophobicContact CZ-CE2 3.84Å; F263-F569 HydrophobicContact CZ-CZ 4.37Å
264	G	94.2	Very high	94.8	Very high	5 Å²	5	35 Å²	35	5%	0.052	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	154.1	-175	0	0	0	0	0	113.2	V272 V273	G264-V272 CarbonylContact O-C 3.55Å; G264-V272 WeakPolarHBondContact O-CA 3.35Å; G264-V273 PolarHBondContact N-O 2.86Å; G264-V273 PolarHBondContact O-N 2.83Å
265	Y	94.3	Very high	95	Very high	28 Å²	28	30.7 Å²	30.7	11%	0.11	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124	174.5	-179.7	-108.3	0	0	0	111.1	M267 H270 V272 V293 T549	Y265-M267 HydrophobicContact CD1-CB 4.49Å; Y265-M267 HydrophobicContact CD1-CG 3.73Å; Y265-M267 HydrophobicContact CE1-CB 4.21Å; Y265-M267 HydrophobicContact CE1-CG 3.76Å; Y265-H270 AromaticContact CZ-ND1 3.96Å; Y265-H270 PolarHBondContact OH-ND1 2.9Å; Y265-V272 HydrophobicContact CD2-CG2 3.77Å; Y265-V272 HydrophobicContact CE2-CG2 4.37Å; Y265-V293 HydrophobicContact CE2-CG2 4.08Å; Y265-T549 HydrophobicContact CD1-CG2 3.84Å; Y265-T549 HydrophobicContact CD2-CG2 4.08Å; Y265-T549 HydrophobicContact CE1-CG2 3.6Å; Y265-T549 HydrophobicContact CE2-CG2 3.84Å; Y265-T549 HydrophobicContact CG-CG2 4.05Å
266	D	93.7	Very high	95.1	Very high	2 Å²	2	30.7 Å²	30.7	1%	0.011	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	104.5	171.5	-176.1	-6.3	0	0	0	109.5	L268 R269 H270 Y271 L317 G320 T342	D266-L268 PolarHBondContact O-N 2.9Å; D266-L268 WeakPolarHBondContact OD1-CB 3.35Å; D266-L268 PolarHBondContact OD1-N 2.8Å; D266-R269 PolarHBondContact O-N 2.89Å; D266-R269 PolarHBondContact OD1-N 2.88Å; D266-R269 IonicContact OD2-NH1 3.36Å; D266-R269 PolarHBondContact OD2-NH1 2.77Å; D266-H270 VanDerWaalsContact O-CA 3.23Å; D266-H270 WeakPolarHBondContact O-CA 3.32Å; D266-H270 PolarHBondContact O-N 2.81Å; D266-Y271 PolarHBondContact N-O 2.87Å; D266-Y271 PolarHBondContact O-N 2.86Å; D266-L317 HydrophobicContact CB-CD1 4.07Å; D266-L317 HydrophobicContact CB-CD2 3.88Å; D266-G320 WeakPolarHBondContact OD2-CA 3.38Å; D266-T342 HydrophobicContact CB-CG2 4.26Å; D266-T342 WeakPolarHBondContact OD2-CB 3.45Å; D266-T342 PolarHBondContact OD2-OG1 3.09Å
267	M	87.1	Confident	95.1	Very high	85 Å²	85	25.4 Å²	25.4	42%	0.419	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-25.4	179.6	-62.4	-171.5	-64.3	0	0	113.4	Y265 L478 L550	Y265-M267 HydrophobicContact CD1-CB 4.49Å; Y265-M267 HydrophobicContact CD1-CG 3.73Å; Y265-M267 HydrophobicContact CE1-CB 4.21Å; Y265-M267 HydrophobicContact CE1-CG 3.76Å; M267-L478 HydrophobicContact SD-CD1 4.46Å; M267-L550 HydrophobicContact SD-CD2 4.14Å; M267-L550 HydrophobicContact SD-CG 4.31Å
268	L	88.4	Confident	95.1	Very high	112 Å²	112	25.5 Å²	25.5	59%	0.586	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-37.2	-177	-177.6	65.2	0	0	0	111.8	D266	D266-L268 PolarHBondContact O-N 2.9Å; D266-L268 WeakPolarHBondContact OD1-CB 3.35Å; D266-L268 PolarHBondContact OD1-N 2.8Å
269	R	93.5	Very high	95	Very high	78 Å²	78	25.6 Å²	25.6	29%	0.294	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-6.9	-177	-65.1	-180	-178.2	71.5	11.5	113.9	D266 Y271 T342	D266-R269 PolarHBondContact O-N 2.89Å; D266-R269 PolarHBondContact OD1-N 2.88Å; D266-R269 IonicContact OD2-NH1 3.36Å; D266-R269 PolarHBondContact OD2-NH1 2.77Å; R269-Y271 VanDerWaalsContact C-N 3.27Å; R269-Y271 HydrophobicContact CB-CD1 4.32Å; R269-Y271 HydrophobicContact CB-CD2 3.68Å; R269-Y271 HydrophobicContact CB-CE2 3.91Å; R269-Y271 HydrophobicContact CB-CG 3.91Å; R269-Y271 HydrophobicContact CG-CE2 4.49Å; R269-Y271 WeakPolarHBondContact O-CD1 3.27Å; R269-Y271 PolarHBondContact O-N 2.84Å; R269-T342 PolarHBondContact NH1-OG1 3.4Å; R269-T342 VanDerWaalsContact NH1-OG1 3.15Å
270	H	93.5	Very high	94.7	Very high	72 Å²	72	30 Å²	30	33%	0.333	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	42.8	-171.9	-54.3	-72.2	0	0	0	112.5	Y265 D266 V293 L294	Y265-H270 AromaticContact CZ-ND1 3.96Å; Y265-H270 PolarHBondContact OH-ND1 2.9Å; D266-H270 VanDerWaalsContact O-CA 3.23Å; D266-H270 WeakPolarHBondContact O-CA 3.32Å; D266-H270 PolarHBondContact O-N 2.81Å; H270-V293 HydrophobicContact CB-CB 4.25Å; H270-V293 VanDerWaalsContact O-CB 3.29Å; H270-V293 WeakPolarHBondContact O-CB 3.22Å; H270-V293 VanDerWaalsContact O-CG2 3.32Å; H270-V293 WeakPolarHBondContact O-CG2 3.44Å; H270-V293 PolarHBondContact O-N 2.8Å; H270-L294 HydrophobicContact CB-CG 4.12Å
271	Y	95.8	Very high	94.3	Very high	48 Å²	48	39.6 Å²	39.6	19%	0.188	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	133.4	178.3	-70.6	-12.8	0	0	0	110.7	D266 R269 I290 F291 D292 F345	D266-Y271 PolarHBondContact N-O 2.87Å; D266-Y271 PolarHBondContact O-N 2.86Å; R269-Y271 VanDerWaalsContact C-N 3.27Å; R269-Y271 HydrophobicContact CB-CD1 4.32Å; R269-Y271 HydrophobicContact CB-CD2 3.68Å; R269-Y271 HydrophobicContact CB-CE2 3.91Å; R269-Y271 HydrophobicContact CB-CG 3.91Å; R269-Y271 HydrophobicContact CG-CE2 4.49Å; R269-Y271 WeakPolarHBondContact O-CD1 3.27Å; R269-Y271 PolarHBondContact O-N 2.84Å; Y271-I290 HydrophobicContact CD1-CG2 4.17Å; Y271-I290 HydrophobicContact CD2-CG2 4.06Å; Y271-I290 HydrophobicContact CG-CG2 3.78Å; Y271-F291 WeakPolarHBondContact CA-O 3.23Å; Y271-D292 HydrophobicContact CD1-CB 4.16Å; Y271-D292 HydrophobicContact CE1-CB 3.89Å; Y271-F345 AromaticContact CD2-CE1 3.98Å; Y271-F345 HydrophobicContact CD2-CE1 3.98Å; Y271-F345 HydrophobicContact CD2-CZ 4.38Å; Y271-F345 AromaticContact CE2-CE1 3.69Å; Y271-F345 HydrophobicContact CE2-CE1 3.69Å; Y271-F345 AromaticContact CE2-CZ 3.67Å; Y271-F345 HydrophobicContact CE2-CZ 3.67Å
272	V	96.1	Very high	93.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	120.9	167.2	179.6	0	0	0	0	108.1	F263 G264 Y265 I290 F291 V293 Y554	F263-V272 HydrophobicContact CD1-CG1 4.22Å; F263-V272 HydrophobicContact CD2-CG1 3.92Å; F263-V272 HydrophobicContact CE1-CG1 3.65Å; F263-V272 HydrophobicContact CE2-CG1 3.32Å; F263-V272 HydrophobicContact CG-CG1 4.37Å; F263-V272 HydrophobicContact CZ-CG1 3.19Å; G264-V272 CarbonylContact O-C 3.55Å; G264-V272 WeakPolarHBondContact O-CA 3.35Å; Y265-V272 HydrophobicContact CD2-CG2 3.77Å; Y265-V272 HydrophobicContact CE2-CG2 4.37Å; V272-I290 CarbonylContact O-C 3.57Å; V272-I290 VanDerWaalsContact O-CA 3.3Å; V272-I290 WeakPolarHBondContact O-CA 3.09Å; V272-F291 HydrophobicContact CB-CB 4.12Å; V272-F291 PolarHBondContact N-O 2.94Å; V272-F291 PolarHBondContact O-N 3.02Å; V272-V293 HydrophobicContact CG2-CG2 3.98Å; V272-Y554 HydrophobicContact CG2-CD2 4.12Å; V272-Y554 HydrophobicContact CG2-CE2 4.47Å; V272-Y554 HydrophobicContact CG2-CG 4.45Å
273	V	97	Very high	93.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	126.6	178.7	-175.5	0	0	0	0	108.9	F263 G264 T288 W289 L317 F322 F340 T342	F263-V273 CarbonylContact C-O 3.56Å; F263-V273 VanDerWaalsContact CA-O 3.27Å; F263-V273 WeakPolarHBondContact CA-O 3.43Å; G264-V273 PolarHBondContact N-O 2.86Å; G264-V273 PolarHBondContact O-N 2.83Å; V273-T288 HydrophobicContact CG1-CG2 4.44Å; V273-W289 WeakPolarHBondContact CA-O 3.26Å; V273-L317 HydrophobicContact CG2-CD1 4.12Å; V273-F322 HydrophobicContact CB-CG 4.4Å; V273-F322 HydrophobicContact CG1-CD1 3.82Å; V273-F322 HydrophobicContact CG1-CE1 4.04Å; V273-F322 HydrophobicContact CG1-CG 4.13Å; V273-F340 HydrophobicContact CG1-CD1 4.06Å; V273-F340 HydrophobicContact CG1-CE1 4.22Å; V273-F340 HydrophobicContact CG2-CD1 4.41Å; V273-F340 HydrophobicContact CG2-CE1 4.32Å; V273-T342 HydrophobicContact CG2-CG2 3.82Å
274	L	97.7	Very high	93.6	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	130.9	174.2	172.7	76.5	0	0	0	108.9	P255 A261 A262 F263 T288 W289 W298 F556	P255-L274 HydrophobicContact CB-CD2 3.5Å; P255-L274 VanDerWaalsContact CB-CD2 3.5Å; P255-L274 HydrophobicContact CG-CD2 3.68Å; A261-L274 HydrophobicContact CB-CD1 3.46Å; A261-L274 VanDerWaalsContact CB-CD1 3.46Å; A262-L274 CarbonylContact O-C 3.5Å; A262-L274 WeakPolarHBondContact O-CA 3.43Å; F263-L274 HydrophobicContact CD2-CB 3.82Å; F263-L274 HydrophobicContact CD2-CD1 3.57Å; F263-L274 HydrophobicContact CD2-CG 4.28Å; F263-L274 HydrophobicContact CE2-CB 4.12Å; F263-L274 HydrophobicContact CE2-CD1 4.17Å; L274-T288 WeakPolarHBondContact O-CA 3.43Å; L274-W289 HydrophobicContact CB-CB 4.13Å; L274-W289 HydrophobicContact CD2-CB 4.28Å; L274-W289 HydrophobicContact CD2-CG 4.48Å; L274-W289 PolarHBondContact N-O 3Å; L274-W289 PolarHBondContact O-N 2.84Å; L274-W298 HydrophobicContact CB-CZ3 4.27Å; L274-W298 HydrophobicContact CD2-CH2 4.47Å; L274-W298 HydrophobicContact CD2-CZ3 4.42Å; L274-F556 HydrophobicContact CD1-CD1 4.24Å; L274-F556 HydrophobicContact CD2-CD1 3.98Å; L274-F556 HydrophobicContact CD2-CE1 3.86Å
275	F	97.7	Very high	93.7	Very high	2 Å²	2	50.4 Å²	50.4	1%	0.009	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	135	176.2	178.5	-97.6	0	0	0	112.3	A262 N286 D287 T288 P307 M310 F322 L324 W347	A262-F275 HydrophobicContact CB-CB 4.44Å; A262-F275 PolarHBondContact N-O 2.93Å; A262-F275 PolarHBondContact O-N 2.78Å; F275-N286 WeakPolarHBondContact CE2-O 3.49Å; F275-D287 WeakPolarHBondContact CD2-O 3Å; F275-T288 WeakPolarHBondContact CD2-OG1 3.3Å; F275-P307 HydrophobicContact CE1-CB 3.92Å; F275-P307 HydrophobicContact CE1-CG 4.04Å; F275-P307 HydrophobicContact CE2-CB 4.33Å; F275-P307 HydrophobicContact CE2-CG 4Å; F275-P307 HydrophobicContact CZ-CB 3.53Å; F275-P307 HydrophobicContact CZ-CG 3.63Å; F275-M310 HydrophobicContact CE1-CE 4.46Å; F275-M310 HydrophobicContact CE1-CG 3.79Å; F275-M310 HydrophobicContact CE1-SD 4Å; F275-F322 HydrophobicContact CB-CE1 4.17Å; F275-L324 HydrophobicContact CD1-CD1 4.27Å; F275-L324 HydrophobicContact CD1-CD2 3.41Å; F275-L324 VanDerWaalsContact CD1-CD2 3.41Å; F275-L324 HydrophobicContact CD1-CG 4.49Å; F275-L324 HydrophobicContact CE1-CD2 3.41Å; F275-L324 VanDerWaalsContact CE1-CD2 3.41Å; F275-L324 HydrophobicContact CG-CD2 4.38Å; F275-L324 HydrophobicContact CZ-CD2 4.38Å; F275-W347 HydrophobicContact CB-CH2 4.39Å; F275-W347 HydrophobicContact CB-CZ2 4.1Å; F275-W347 HydrophobicContact CD2-CH2 4.28Å; F275-W347 AromaticContact CD2-CZ2 3.56Å; F275-W347 HydrophobicContact CD2-CZ2 3.56Å; F275-W347 HydrophobicContact CE2-CZ2 4.17Å; F275-W347 HydrophobicContact CG-CH2 4.14Å; F275-W347 AromaticContact CG-CZ2 3.82Å; F275-W347 HydrophobicContact CG-CZ2 3.82Å
276	G	97.1	Very high	93.8	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.246	C	C	.	.			trans	60	-141.8	171.3	0	0	0	0	0	113.6	R258 A261 Y285 D287	R258-G276 VanDerWaalsContact CD-O 3.31Å; R258-G276 WeakPolarHBondContact CD-O 3.3Å; R258-G276 PolarHBondContact NH1-O 3.44Å; A261-G276 WeakPolarHBondContact CB-O 3.47Å; G276-Y285 WeakPolarHBondContact CA-O 3.41Å; G276-D287 PolarHBondContact N-O 2.85Å
277	G	96.8	Very high	93.9	Very high	1 Å²	1	55.4 Å²	55.4	1%	0.01	26%	0.255	C	S	.	.			trans	100.6	170.3	-173.2	0	0	0	0	0	112.5	K259 Y285 M310	K259-G277 CarbonylContact O-C 3.58Å; K259-G277 VanDerWaalsContact O-CA 3.31Å; K259-G277 WeakPolarHBondContact O-CA 3.33Å; G277-Y285 PolarHBondContact O-N 3.03Å; G277-M310 PolarHBondContact N-O 3.23Å
278	Q	96.2	Very high	94.4	Very high	21 Å²	21	51.5 Å²	51.5	10%	0.098	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-103.8	123.1	-177.2	-173	178.5	10.3	0	0	109.7	R258 K259 D282 E283 H311	R258-Q278 CarbonylContact C-O 3.59Å; R258-Q278 VanDerWaalsContact CA-O 3.22Å; R258-Q278 WeakPolarHBondContact CA-O 3.18Å; K259-Q278 VanDerWaalsContact CE-OE1 3.25Å; K259-Q278 HydrophobicContact CG-CB 4.15Å; K259-Q278 PolarHBondContact N-O 2.95Å; K259-Q278 PolarHBondContact O-N 3.32Å; Q278-D282 PolarHBondContact NE2-OD1 3.45Å; Q278-E283 CarbonylContact C-O 3.59Å; Q278-E283 WeakPolarHBondContact CA-O 3.26Å; Q278-H311 HydrophobicContact CB-CB 3.96Å
279	G	96	Very high	94.8	Very high	2 Å²	2	47.2 Å²	47.2	2%	0.021	21%	0.212	C	C	.	.			trans	-90.4	-167.2	174.9	0	0	0	0	0	113.4	E283 Y285 L565	G279-E283 PolarHBondContact N-O 3.44Å; G279-Y285 VanDerWaalsContact CA-CE2 3.46Å; G279-L565 VanDerWaalsContact O-CD1 3.3Å; G279-L565 WeakPolarHBondContact O-CD1 3.34Å
280	E	90.1	Very high	95	Very high	122 Å²	122	43.7 Å²	43.7	57%	0.57	20%	0.199	S	C	*	.	G	3₁₀ helix	trans	-65.1	150.1	178.6	-66.2	-170.8	171.3	0	0	110.5	D282 E283 L565	E280-D282 PolarHBondContact O-N 3.06Å; E280-E283 PolarHBondContact O-N 3.41Å; E280-L565 HydrophobicContact CG-CD1 4.12Å; E280-L565 VanDerWaalsContact N-CD1 3.35Å
281	R	87.2	Confident	95.1	Very high	241 Å²	241	40.4 Å²	40.4	91%	0.909	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	58.2	28.9	-177.8	-48.3	178.2	-179.8	-153	-1	114	E283	R281-E283 PolarHBondContact O-N 2.89Å
282	D	84.3	Confident	95	Very high	92 Å²	92	38.7 Å²	38.7	49%	0.492	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	63.2	17.6	178.9	-54.4	-43.7	0	0	0	114.9	Q278 E280 Q330	Q278-D282 PolarHBondContact NE2-OD1 3.45Å; E280-D282 PolarHBondContact O-N 3.06Å; D282-Q330 PolarHBondContact O-NE2 2.91Å
283	E	93	Very high	94.9	Very high	110 Å²	110	40.5 Å²	40.5	51%	0.514	19%	0.189	S	C	.	.	P	Polyproline II helix	trans	-61.8	136	171.9	-175.5	173.7	-176.3	0	0	110.3	Q278 G279 E280 R281	Q278-E283 CarbonylContact C-O 3.59Å; Q278-E283 WeakPolarHBondContact CA-O 3.26Å; G279-E283 PolarHBondContact N-O 3.44Å; E280-E283 PolarHBondContact O-N 3.41Å; R281-E283 PolarHBondContact O-N 2.89Å
284	N	95.5	Very high	94.7	Very high	18 Å²	18	45 Å²	45	10%	0.096	21%	0.212	C	C	.	.	B	Isolated β-bridge	trans	-103.9	134.9	175.1	-70.8	-56.6	0	0	0	109.8	A309 H311 D329 Q330	N284-A309 HydrophobicContact CB-CB 4.01Å; N284-A309 WeakPolarHBondContact O-CB 3.32Å; N284-H311 PolarHBondContact OD1-CD2 2.87Å; N284-D329 WeakPolarHBondContact ND2-CA 3.47Å; N284-Q330 PolarHBondContact ND2-N 2.8Å
285	Y	96.5	Very high	94.5	Very high	25 Å²	25	46.6 Å²	46.6	10%	0.098	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-90.8	151.6	176.3	-55.8	-65.3	0	0	0	111.4	Q256 R258 G276 G277 G279 D287 A309 M310	Q256-Y285 PolarHBondContact OE1-OH 2.8Å; R258-Y285 HydrophobicContact CB-CD2 4.15Å; R258-Y285 HydrophobicContact CB-CE2 3.92Å; G276-Y285 WeakPolarHBondContact CA-O 3.41Å; G277-Y285 PolarHBondContact O-N 3.03Å; G279-Y285 VanDerWaalsContact CA-CE2 3.46Å; Y285-D287 VanDerWaalsContact CB-OD1 3.25Å; Y285-D287 WeakPolarHBondContact CB-OD1 3.5Å; Y285-A309 VanDerWaalsContact O-CA 3.31Å; Y285-A309 WeakPolarHBondContact O-CA 3.39Å; Y285-M310 PolarHBondContact O-N 3.02Å
286	N	96	Very high	94.2	Very high	95 Å²	95	46.8 Å²	46.8	51%	0.508	23%	0.228	S	C	.	.			trans	-120.1	12.2	170.7	65.1	-13	0	0	0	112.2	F275 A309	F275-N286 WeakPolarHBondContact CE2-O 3.49Å; N286-A309 HydrophobicContact CB-CB 3.95Å
287	D	96.5	Very high	94.1	Very high	39 Å²	39	52 Å²	52	21%	0.209	25%	0.248	C	C	.	.			trans	-78.2	150.3	-177.3	58.9	-4.8	0	0	0	111.3	R258 F275 G276 Y285 W289	R258-D287 IonicContact CZ-OD1 3.21Å; R258-D287 IonicContact CZ-OD2 3.89Å; R258-D287 IonicContact NH1-OD1 2.76Å; R258-D287 PolarHBondContact NH1-OD1 3.11Å; R258-D287 IonicContact NH1-OD2 2.67Å; R258-D287 PolarHBondContact NH1-OD2 2.81Å; R258-D287 IonicContact NH2-OD1 2.76Å; R258-D287 IonicContact NH2-OD2 2.79Å; R258-D287 PolarHBondContact NH2-OD2 3.29Å; F275-D287 WeakPolarHBondContact CD2-O 3Å; G276-D287 PolarHBondContact N-O 2.85Å; Y285-D287 VanDerWaalsContact CB-OD1 3.25Å; Y285-D287 WeakPolarHBondContact CB-OD1 3.5Å; D287-W289 VanDerWaalsContact CG-NE1 3.3Å; D287-W289 PolarHBondContact OD2-NE1 2.85Å
288	T	97.7	Very high	94	Very high	4 Å²	4	52.7 Å²	52.7	3%	0.025	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.7	174.4	-53.8	0	0	0	0	108.7	V273 L274 F275 V301 F340 W347	V273-T288 HydrophobicContact CG1-CG2 4.44Å; L274-T288 WeakPolarHBondContact O-CA 3.43Å; F275-T288 WeakPolarHBondContact CD2-OG1 3.3Å; T288-V301 HydrophobicContact CG2-CB 4.09Å; T288-V301 HydrophobicContact CG2-CG2 4.48Å; T288-V301 PolarHBondContact O-N 3.4Å; T288-F340 HydrophobicContact CG2-CE2 4.1Å; T288-F340 HydrophobicContact CG2-CZ 4.08Å; T288-W347 HydrophobicContact CG2-CZ2 4.34Å; T288-W347 PolarHBondContact OG1-NE1 3.19Å
289	W	97.3	Very high	93.9	Very high	22 Å²	22	57 Å²	57	8%	0.083	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	142	178	-67.8	89.1	0	0	0	110.4	P253 P255 V273 L274 D287 W298 Y299 A300	P253-W289 HydrophobicContact CB-CH2 3.89Å; P253-W289 HydrophobicContact CB-CZ3 4.27Å; P253-W289 HydrophobicContact CG-CH2 4.17Å; P253-W289 HydrophobicContact CG-CZ3 4.24Å; P253-W289 VanDerWaalsContact O-CZ3 3.27Å; P253-W289 WeakPolarHBondContact O-CZ3 3.24Å; P255-W289 HydrophobicContact CB-CD2 4.05Å; P255-W289 HydrophobicContact CB-CG 3.94Å; P255-W289 HydrophobicContact CG-CD2 4.35Å; P255-W289 HydrophobicContact CG-CG 4.29Å; V273-W289 WeakPolarHBondContact CA-O 3.26Å; L274-W289 HydrophobicContact CB-CB 4.13Å; L274-W289 HydrophobicContact CD2-CB 4.28Å; L274-W289 HydrophobicContact CD2-CG 4.48Å; L274-W289 PolarHBondContact N-O 3Å; L274-W289 PolarHBondContact O-N 2.84Å; D287-W289 VanDerWaalsContact CG-NE1 3.3Å; D287-W289 PolarHBondContact OD2-NE1 2.85Å; W289-W298 HydrophobicContact CB-CE3 3.85Å; W289-W298 HydrophobicContact CB-CZ3 3.9Å; W289-W298 HydrophobicContact CE3-CB 4.23Å; W289-W298 HydrophobicContact CZ3-CB 4.47Å; W289-Y299 WeakPolarHBondContact CA-O 3.48Å; W289-A300 HydrophobicContact CD2-CB 4.46Å; W289-A300 HydrophobicContact CE3-CB 3.99Å; W289-A300 HydrophobicContact CH2-CB 3.71Å; W289-A300 HydrophobicContact CZ2-CB 4.2Å; W289-A300 HydrophobicContact CZ3-CB 3.6Å
290	I	96.5	Very high	93.9	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.015	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.7	171.7	-63.8	-179.2	0	0	0	108.4	Y271 V272 W298 Y299 V301 F340 F345	Y271-I290 HydrophobicContact CD1-CG2 4.17Å; Y271-I290 HydrophobicContact CD2-CG2 4.06Å; Y271-I290 HydrophobicContact CG-CG2 3.78Å; V272-I290 CarbonylContact O-C 3.57Å; V272-I290 VanDerWaalsContact O-CA 3.3Å; V272-I290 WeakPolarHBondContact O-CA 3.09Å; I290-W298 CarbonylContact O-C 3.59Å; I290-W298 WeakPolarHBondContact O-CA 3.39Å; I290-Y299 PolarHBondContact N-O 2.83Å; I290-Y299 PolarHBondContact O-N 3.35Å; I290-V301 HydrophobicContact CD1-CG2 3.64Å; I290-V301 HydrophobicContact CG1-CG2 3.8Å; I290-F340 HydrophobicContact CD1-CE1 3.89Å; I290-F340 HydrophobicContact CD1-CZ 3.89Å; I290-F340 HydrophobicContact CG1-CE1 4.48Å; I290-F345 HydrophobicContact CD1-CD1 3.16Å; I290-F345 HydrophobicContact CD1-CE1 3.18Å; I290-F345 HydrophobicContact CD1-CG 4.03Å; I290-F345 HydrophobicContact CD1-CZ 4.06Å
291	F	96.3	Very high	94.1	Very high	3 Å²	3	53.4 Å²	53.4	1%	0.013	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	117.4	164.2	-175	-102	0	0	0	109.2	V246 E248 Y271 V272 V293 G296 R297 W298 F569	V246-F291 HydrophobicContact CG1-CE1 3.81Å; V246-F291 HydrophobicContact CG1-CE2 4.41Å; V246-F291 HydrophobicContact CG1-CZ 3.5Å; E248-F291 HydrophobicContact CG-CE2 4.15Å; Y271-F291 WeakPolarHBondContact CA-O 3.23Å; V272-F291 HydrophobicContact CB-CB 4.12Å; V272-F291 PolarHBondContact N-O 2.94Å; V272-F291 PolarHBondContact O-N 3.02Å; F291-V293 HydrophobicContact CD1-CG2 3.83Å; F291-V293 HydrophobicContact CE1-CB 4.45Å; F291-V293 HydrophobicContact CE1-CG2 4.08Å; F291-V293 PolarHBondContact O-N 3.06Å; F291-G296 VanDerWaalsContact CE2-C 3.45Å; F291-R297 WeakPolarHBondContact CA-O 3.32Å; F291-R297 VanDerWaalsContact CD2-C 3.46Å; F291-R297 WeakPolarHBondContact CD2-O 3.29Å; F291-W298 HydrophobicContact CB-CD2 3.79Å; F291-W298 HydrophobicContact CB-CE3 3.62Å; F291-W298 HydrophobicContact CB-CH2 3.82Å; F291-W298 HydrophobicContact CB-CZ2 3.97Å; F291-W298 HydrophobicContact CB-CZ3 3.65Å; F291-W298 AromaticContact CD2-CD1 3.69Å; F291-W298 AromaticContact CD2-CD2 3.74Å; F291-W298 HydrophobicContact CD2-CD2 3.74Å; F291-W298 AromaticContact CD2-CE2 3.61Å; F291-W298 HydrophobicContact CD2-CE3 4.44Å; F291-W298 AromaticContact CD2-CG 3.8Å; F291-W298 HydrophobicContact CD2-CG 3.8Å; F291-W298 HydrophobicContact CD2-CZ2 4.22Å; F291-W298 AromaticContact CD2-NE1 3.57Å; F291-W298 HydrophobicContact CG-CD2 4.23Å; F291-W298 HydrophobicContact CG-CZ2 4.3Å; F291-F569 HydrophobicContact CB-CE1 4.42Å; F291-F569 AromaticContact CD1-CE1 3.64Å; F291-F569 HydrophobicContact CD1-CE1 3.64Å; F291-F569 HydrophobicContact CD1-CZ 4.15Å; F291-F569 AromaticContact CD2-CE1 3.96Å; F291-F569 HydrophobicContact CD2-CE1 3.96Å; F291-F569 AromaticContact CE1-CE1 3.72Å; F291-F569 HydrophobicContact CE1-CE1 3.72Å; F291-F569 HydrophobicContact CE1-CZ 4.44Å; F291-F569 HydrophobicContact CE2-CD1 4.41Å; F291-F569 HydrophobicContact CE2-CE1 4.04Å; F291-F569 AromaticContact CG-CE1 3.75Å; F291-F569 HydrophobicContact CG-CE1 3.75Å; F291-F569 HydrophobicContact CG-CZ 4.43Å; F291-F569 HydrophobicContact CZ-CD1 4.49Å; F291-F569 AromaticContact CZ-CE1 3.92Å; F291-F569 HydrophobicContact CZ-CE1 3.92Å
292	D	94.6	Very high	94.3	Very high	13 Å²	13	49.6 Å²	49.6	7%	0.07	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	109.2	169.2	-177.6	-26.1	0	0	0	108.2	Y271 L294 A295 G296 R297 Y299	Y271-D292 HydrophobicContact CD1-CB 4.16Å; Y271-D292 HydrophobicContact CE1-CB 3.89Å; D292-L294 VanDerWaalsContact C-N 3.3Å; D292-L294 PolarHBondContact O-N 2.97Å; D292-L294 WeakPolarHBondContact OD1-CB 3.44Å; D292-L294 PolarHBondContact OD1-N 2.94Å; D292-A295 HydrophobicContact CB-CB 3.89Å; D292-A295 VanDerWaalsContact CG-CB 3.46Å; D292-A295 PolarHBondContact O-N 2.76Å; D292-A295 PolarHBondContact OD1-N 3.15Å; D292-G296 WeakPolarHBondContact O-CA 3.4Å; D292-G296 PolarHBondContact O-N 3.31Å; D292-R297 PolarHBondContact N-O 3.24Å; D292-R297 PolarHBondContact O-N 2.75Å; D292-Y299 HydrophobicContact CB-CD2 4.28Å; D292-Y299 HydrophobicContact CB-CE2 3.7Å
293	V	93.9	Very high	94.6	Very high	37 Å²	37	50.6 Å²	50.6	22%	0.224	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-33.6	-177.5	174.8	0	0	0	0	111.6	Y265 H270 V272 F291 Y554	Y265-V293 HydrophobicContact CE2-CG2 4.08Å; H270-V293 HydrophobicContact CB-CB 4.25Å; H270-V293 VanDerWaalsContact O-CB 3.29Å; H270-V293 WeakPolarHBondContact O-CB 3.22Å; H270-V293 VanDerWaalsContact O-CG2 3.32Å; H270-V293 WeakPolarHBondContact O-CG2 3.44Å; H270-V293 PolarHBondContact O-N 2.8Å; V272-V293 HydrophobicContact CG2-CG2 3.98Å; F291-V293 HydrophobicContact CD1-CG2 3.83Å; F291-V293 HydrophobicContact CE1-CB 4.45Å; F291-V293 HydrophobicContact CE1-CG2 4.08Å; F291-V293 PolarHBondContact O-N 3.06Å; V293-Y554 VanDerWaalsContact CG1-OH 3.32Å; V293-Y554 WeakPolarHBondContact CG1-OH 3.14Å; V293-Y554 HydrophobicContact CG2-CE2 4.24Å
294	L	92.5	Very high	94.4	Very high	94 Å²	94	54 Å²	54	49%	0.492	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-37.9	-179.9	-60.4	-179.8	0	0	0	111.6	H270 D292	H270-L294 HydrophobicContact CB-CG 4.12Å; D292-L294 VanDerWaalsContact C-N 3.3Å; D292-L294 PolarHBondContact O-N 2.97Å; D292-L294 WeakPolarHBondContact OD1-CB 3.44Å; D292-L294 PolarHBondContact OD1-N 2.94Å
295	A	91.9	Very high	94.3	Very high	35 Å²	35	57.1 Å²	57.1	29%	0.289	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-21.3	175.4	0	0	0	0	0	113	D292	D292-A295 HydrophobicContact CB-CB 3.89Å; D292-A295 VanDerWaalsContact CG-CB 3.46Å; D292-A295 PolarHBondContact O-N 2.76Å; D292-A295 PolarHBondContact OD1-N 3.15Å
296	G	93.2	Very high	94.2	Very high	5 Å²	5	57.5 Å²	57.5	5%	0.052	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	41.9	-173.4	0	0	0	0	0	112.8	E248 Y249 F291 D292	E248-G296 WeakPolarHBondContact CA-O 3.49Å; Y249-G296 PolarHBondContact N-O 2.75Å; F291-G296 VanDerWaalsContact CE2-C 3.45Å; D292-G296 WeakPolarHBondContact O-CA 3.4Å; D292-G296 PolarHBondContact O-N 3.31Å
297	R	93.9	Very high	94.3	Very high	109 Å²	109	53.1 Å²	53.1	41%	0.411	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	144.8	-173.2	-63	-172.4	-176.2	-113.2	2.7	113.3	Y249 F291 D292 Y299	Y249-R297 WeakPolarHBondContact O-CG 3.23Å; Y249-R297 PolarHBondContact O-NE 3.17Å; Y249-R297 PolarHBondContact O-NH1 2.8Å; F291-R297 WeakPolarHBondContact CA-O 3.32Å; F291-R297 VanDerWaalsContact CD2-C 3.46Å; F291-R297 WeakPolarHBondContact CD2-O 3.29Å; D292-R297 PolarHBondContact N-O 3.24Å; D292-R297 PolarHBondContact O-N 2.75Å; R297-Y299 HydrophobicContact CB-CE2 4.06Å
298	W	95.5	Very high	94.2	Very high	16 Å²	16	53.3 Å²	53.3	6%	0.061	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	143.3	169.2	-69.9	100.9	0	0	0	111.9	E248 R254 P255 F263 L274 W289 I290 F291 F556 F569	E248-W298 PolarHBondContact OE2-NE1 3.46Å; E248-W298 VanDerWaalsContact OE2-NE1 3.08Å; R254-W298 HydrophobicContact CB-CG 4.41Å; P255-W298 HydrophobicContact CG-CD2 4.03Å; P255-W298 HydrophobicContact CG-CE3 4.04Å; P255-W298 HydrophobicContact CG-CH2 4.14Å; P255-W298 HydrophobicContact CG-CZ2 4.13Å; P255-W298 HydrophobicContact CG-CZ3 4.09Å; F263-W298 HydrophobicContact CE2-CH2 4.21Å; L274-W298 HydrophobicContact CB-CZ3 4.27Å; L274-W298 HydrophobicContact CD2-CH2 4.47Å; L274-W298 HydrophobicContact CD2-CZ3 4.42Å; W289-W298 HydrophobicContact CB-CE3 3.85Å; W289-W298 HydrophobicContact CB-CZ3 3.9Å; W289-W298 HydrophobicContact CE3-CB 4.23Å; W289-W298 HydrophobicContact CZ3-CB 4.47Å; I290-W298 CarbonylContact O-C 3.59Å; I290-W298 WeakPolarHBondContact O-CA 3.39Å; F291-W298 HydrophobicContact CB-CD2 3.79Å; F291-W298 HydrophobicContact CB-CE3 3.62Å; F291-W298 HydrophobicContact CB-CH2 3.82Å; F291-W298 HydrophobicContact CB-CZ2 3.97Å; F291-W298 HydrophobicContact CB-CZ3 3.65Å; F291-W298 AromaticContact CD2-CD1 3.69Å; F291-W298 AromaticContact CD2-CD2 3.74Å; F291-W298 HydrophobicContact CD2-CD2 3.74Å; F291-W298 AromaticContact CD2-CE2 3.61Å; F291-W298 HydrophobicContact CD2-CE3 4.44Å; F291-W298 AromaticContact CD2-CG 3.8Å; F291-W298 HydrophobicContact CD2-CG 3.8Å; F291-W298 HydrophobicContact CD2-CZ2 4.22Å; F291-W298 AromaticContact CD2-NE1 3.57Å; F291-W298 HydrophobicContact CG-CD2 4.23Å; F291-W298 HydrophobicContact CG-CZ2 4.3Å; W298-F556 HydrophobicContact CZ2-CD2 4.14Å; W298-F556 HydrophobicContact CZ2-CE2 4.36Å; W298-F569 HydrophobicContact CH2-CE1 4.49Å; W298-F569 AromaticContact CZ2-CD1 3.7Å; W298-F569 HydrophobicContact CZ2-CD1 3.7Å; W298-F569 AromaticContact CZ2-CE1 3.69Å; W298-F569 HydrophobicContact CZ2-CE1 3.69Å; W298-F569 HydrophobicContact CZ2-CG 4.14Å; W298-F569 HydrophobicContact CZ2-CZ 4.15Å
299	Y	94.2	Very high	94.2	Very high	111 Å²	111	54.5 Å²	54.5	44%	0.435	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	126.3	173	-59.6	-83.1	0	0	0	109.3	W289 I290 D292 R297	W289-Y299 WeakPolarHBondContact CA-O 3.48Å; I290-Y299 PolarHBondContact N-O 2.83Å; I290-Y299 PolarHBondContact O-N 3.35Å; D292-Y299 HydrophobicContact CB-CD2 4.28Å; D292-Y299 HydrophobicContact CB-CE2 3.7Å; R297-Y299 HydrophobicContact CB-CE2 4.06Å
300	A	94.9	Very high	94.1	Very high	30 Å²	30	53.7 Å²	53.7	25%	0.248	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	122.6	170.5	0	0	0	0	0	109.7	W289 H302	W289-A300 HydrophobicContact CD2-CB 4.46Å; W289-A300 HydrophobicContact CE3-CB 3.99Å; W289-A300 HydrophobicContact CH2-CB 3.71Å; W289-A300 HydrophobicContact CZ2-CB 4.2Å; W289-A300 HydrophobicContact CZ3-CB 3.6Å; A300-H302 WeakPolarHBondContact CB-CE1 3.26Å; A300-H302 PolarHBondContact O-ND1 2.76Å
301	V	95.2	Very high	94.1	Very high	20 Å²	20	54.6 Å²	54.6	12%	0.121	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	105.1	177.5	177.2	0	0	0	0	108.8	T288 I290 R303 F340 F345	T288-V301 HydrophobicContact CG2-CB 4.09Å; T288-V301 HydrophobicContact CG2-CG2 4.48Å; T288-V301 PolarHBondContact O-N 3.4Å; I290-V301 HydrophobicContact CD1-CG2 3.64Å; I290-V301 HydrophobicContact CG1-CG2 3.8Å; V301-R303 HydrophobicContact CG1-CG 3.88Å; V301-F340 HydrophobicContact CG1-CE2 4.08Å; V301-F340 HydrophobicContact CG1-CZ 4.2Å; V301-F340 HydrophobicContact CG2-CZ 4.45Å; V301-F345 HydrophobicContact CG1-CB 3.95Å; V301-F345 HydrophobicContact CG2-CB 4.45Å
302	H	91.5	Very high	94	Very high	161 Å²	161	55 Å²	55	75%	0.745	29%	0.291	S	S	*	.			trans	-97.4	113.8	177.3	-59.8	91.2	0	0	0	109.8	A300	A300-H302 WeakPolarHBondContact CB-CE1 3.26Å; A300-H302 PolarHBondContact O-ND1 2.76Å
303	R	90.3	Very high	93.9	Very high	113 Å²	113	55 Å²	55	43%	0.426	29%	0.293	S	S	.	.			trans	-133.3	148.1	177.3	-63.5	-62.4	-173	-173	8	110.4	V301 V305 T344 F345	V301-R303 HydrophobicContact CG1-CG 3.88Å; R303-V305 VanDerWaalsContact C-N 3.31Å; R303-T344 PolarHBondContact NH2-O 2.77Å; R303-F345 WeakPolarHBondContact CG-O 3.37Å; R303-F345 PolarHBondContact NE-O 2.69Å
304	N	88.7	Confident	93.9	Very high	180 Å²	180	53.8 Å²	53.8	96%	0.963	29%	0.287	S	S	*	.	S	Bend	trans	-71.6	-29.5	178.6	-65	-19.4	0	0	0	112.5
305	V	94.1	Very high	93.9	Very high	85 Å²	85	52.2 Å²	52.2	52%	0.515	28%	0.276	S	S	.	.	S	Bend	trans	-106.4	118.6	176.2	178.9	0	0	0	0	107	R303 W338 W347	R303-V305 VanDerWaalsContact C-N 3.31Å; V305-W338 HydrophobicContact CG1-CH2 4.34Å; V305-W338 HydrophobicContact CG1-CZ3 3.9Å; V305-W347 WeakPolarHBondContact O-CB 3.32Å
306	A	94.6	Very high	93.8	Very high	33 Å²	33	51 Å²	51	27%	0.273	27%	0.266	S	S	.	.			trans	-155.1	159.1	177.1	0	0	0	0	0	109.4	W338	A306-W338 VanDerWaalsContact O-CH2 3.3Å; A306-W338 WeakPolarHBondContact O-CH2 3.48Å
307	P	96.2	Very high	93.7	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.013	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-61.3	156.9	171.2	-10.8	22.6	0	0	0	111.4	F275 M310 L324 W338 W347	F275-P307 HydrophobicContact CE1-CB 3.92Å; F275-P307 HydrophobicContact CE1-CG 4.04Å; F275-P307 HydrophobicContact CE2-CB 4.33Å; F275-P307 HydrophobicContact CE2-CG 4Å; F275-P307 HydrophobicContact CZ-CB 3.53Å; F275-P307 HydrophobicContact CZ-CG 3.63Å; P307-M310 HydrophobicContact CB-CE 3.79Å; P307-L324 HydrophobicContact CB-CD2 4.1Å; P307-L324 HydrophobicContact CG-CD2 3.93Å; P307-W338 HydrophobicContact CB-CD2 3.88Å; P307-W338 HydrophobicContact CB-CE3 4.47Å; P307-W338 HydrophobicContact CB-CG 3.93Å; P307-W338 HydrophobicContact CB-CZ2 4.39Å; P307-W338 HydrophobicContact CG-CB 3.96Å; P307-W338 HydrophobicContact CG-CD2 3.68Å; P307-W338 HydrophobicContact CG-CE3 3.95Å; P307-W338 HydrophobicContact CG-CG 3.7Å; P307-W347 VanDerWaalsContact CD-CD2 3.48Å; P307-W347 HydrophobicContact CG-CD2 3.86Å; P307-W347 HydrophobicContact CG-CE3 3.66Å; P307-W347 HydrophobicContact CG-CH2 4.09Å; P307-W347 HydrophobicContact CG-CZ2 4.29Å; P307-W347 HydrophobicContact CG-CZ3 3.78Å
308	P	95.6	Very high	93.2	Very high	43 Å²	43	49.5 Å²	49.5	28%	0.279	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-64.7	167.3	175.8	26.6	-32.1	0	0	0	111.7	M310 F334	P308-M310 HydrophobicContact CG-CE 3.6Å; P308-M310 VanDerWaalsContact O-CE 3.32Å; P308-M310 WeakPolarHBondContact O-CE 3.29Å; P308-M310 PolarHBondContact O-N 3.43Å; P308-F334 HydrophobicContact CB-CE1 4.26Å; P308-F334 HydrophobicContact CB-CE2 4.41Å; P308-F334 HydrophobicContact CB-CZ 3.89Å; P308-F334 HydrophobicContact CG-CD1 4.06Å; P308-F334 HydrophobicContact CG-CD2 4.29Å; P308-F334 HydrophobicContact CG-CE1 3.66Å; P308-F334 HydrophobicContact CG-CE2 3.92Å; P308-F334 HydrophobicContact CG-CG 4.36Å; P308-F334 HydrophobicContact CG-CZ 3.59Å
309	A	96.3	Very high	92.7	Very high	30 Å²	30	54.2 Å²	54.2	25%	0.248	29%	0.292	C	S	.	.	S	Bend	trans	-60.9	127.1	173.9	0	0	0	0	0	110	N284 Y285 N286 D329	N284-A309 HydrophobicContact CB-CB 4.01Å; N284-A309 WeakPolarHBondContact O-CB 3.32Å; Y285-A309 VanDerWaalsContact O-CA 3.31Å; Y285-A309 WeakPolarHBondContact O-CA 3.39Å; N286-A309 HydrophobicContact CB-CB 3.95Å; A309-D329 WeakPolarHBondContact O-CB 3.3Å
310	M	96.2	Very high	92.6	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.02	27%	0.273	C	S	.	.			trans	-160.4	162.4	-175.5	64.3	-179.9	70.8	0	0	112.7	F275 G277 Y285 P307 P308 A313 L324 C328 F334	F275-M310 HydrophobicContact CE1-CE 4.46Å; F275-M310 HydrophobicContact CE1-CG 3.79Å; F275-M310 HydrophobicContact CE1-SD 4Å; G277-M310 PolarHBondContact N-O 3.23Å; Y285-M310 PolarHBondContact O-N 3.02Å; P307-M310 HydrophobicContact CB-CE 3.79Å; P308-M310 HydrophobicContact CG-CE 3.6Å; P308-M310 VanDerWaalsContact O-CE 3.32Å; P308-M310 WeakPolarHBondContact O-CE 3.29Å; P308-M310 PolarHBondContact O-N 3.43Å; M310-A313 HydrophobicContact SD-CB 4.06Å; M310-L324 HydrophobicContact CE-CD2 4.43Å; M310-L324 HydrophobicContact SD-CD2 3.69Å; M310-L324 HydrophobicContact SD-CG 4.36Å; M310-C328 CarbonylContact C-O 3.5Å; M310-C328 VanDerWaalsContact CA-O 3.24Å; M310-C328 WeakPolarHBondContact CA-O 3.27Å; M310-F334 HydrophobicContact CB-CD2 4.37Å; M310-F334 HydrophobicContact CB-CE2 4.26Å; M310-F334 HydrophobicContact CE-CD2 4.1Å; M310-F334 HydrophobicContact CE-CE2 4.46Å
311	H	95.5	Very high	92.5	Very high	22 Å²	22	51.9 Å²	51.9	10%	0.102	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-135.9	160.4	170.8	74.7	99.6	0	0	0	111.5	H260 Q278 N284 A313 G327 C328 L362	H260-H311 HydrophobicContact CB-CB 4.04Å; Q278-H311 HydrophobicContact CB-CB 3.96Å; N284-H311 PolarHBondContact OD1-CD2 2.87Å; H311-A313 VanDerWaalsContact C-N 3.25Å; H311-A313 PolarHBondContact O-N 3.1Å; H311-G327 WeakPolarHBondContact O-CA 3.48Å; H311-C328 PolarHBondContact CD2-O 2.94Å; H311-C328 PolarHBondContact N-O 2.84Å; H311-C328 PolarHBondContact O-N 2.85Å; H311-L362 VanDerWaalsContact CE1-CD1 3.48Å; H311-L362 WeakPolarHBondContact CE1-CD1 3.37Å; H311-L362 WeakPolarHBondContact O-CD1 3.27Å
312	G	94.1	Very high	92.5	Very high	12 Å²	12	50.9 Å²	50.9	12%	0.124	27%	0.273	C	S	.	.	S	Bend	trans	63.7	26.9	173.5	0	0	0	0	0	114.8	H260 G363	H260-G312 PolarHBondContact O-N 2.85Å; G312-G363 PolarHBondContact O-N 2.93Å
313	A	94.3	Very high	92.6	Very high	14 Å²	14	44.2 Å²	44.2	12%	0.116	24%	0.242	C	C	.	.			trans	-69.2	148.9	171.6	0	0	0	0	0	111.2	M310 H311 L324	M310-A313 HydrophobicContact SD-CB 4.06Å; H311-A313 VanDerWaalsContact C-N 3.25Å; H311-A313 PolarHBondContact O-N 3.1Å; A313-L324 HydrophobicContact CB-CD1 3.52Å; A313-L324 HydrophobicContact CB-CG 4Å
314	A	92.9	Very high	92.8	Very high	11 Å²	11	38.9 Å²	38.9	9%	0.091	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	139.6	168.1	0	0	0	0	0	109	V325 A364 Y377	A314-V325 PolarHBondContact N-O 2.86Å; A314-V325 PolarHBondContact O-N 3.24Å; A314-A364 HydrophobicContact CB-CB 4.37Å; A314-Y377 HydrophobicContact CB-CD2 3.93Å; A314-Y377 HydrophobicContact CB-CE2 3.96Å
315	F	92.9	Very high	93.1	Very high	61 Å²	61	30.3 Å²	30.3	27%	0.268	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	163.9	-175.5	67.3	-93.9	0	0	0	112.3	A262 F263 F322 Y323 L324 F368	A262-F315 VanDerWaalsContact CA-CD1 3.48Å; A262-F315 HydrophobicContact CB-CB 3.83Å; A262-F315 HydrophobicContact CB-CD1 3.56Å; A262-F315 HydrophobicContact CB-CE1 4.29Å; A262-F315 HydrophobicContact CB-CG 3.74Å; F263-F315 HydrophobicContact CB-CZ 4.48Å; F263-F315 WeakPolarHBondContact O-CE2 3.4Å; F315-F322 HydrophobicContact CB-CE2 4.04Å; F315-F322 HydrophobicContact CB-CZ 4.02Å; F315-F322 AromaticContact CD2-CE2 3.82Å; F315-F322 HydrophobicContact CD2-CE2 3.82Å; F315-F322 HydrophobicContact CD2-CZ 4.32Å; F315-F322 HydrophobicContact CG-CE2 4.21Å; F315-F322 HydrophobicContact CG-CZ 4.31Å; F315-Y323 VanDerWaalsContact CA-O 3.22Å; F315-Y323 WeakPolarHBondContact CA-O 3.33Å; F315-Y323 WeakPolarHBondContact CB-O 3.46Å; F315-L324 HydrophobicContact CB-CD1 4.07Å; F315-F368 WeakPolarHBondContact O-CD2 3.05Å
316	G	90.1	Very high	93	Very high	8 Å²	8	26.4 Å²	26.4	8%	0.082	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.6	157.5	170.5	0	0	0	0	0	112.6	Y323 F368	G316-Y323 PolarHBondContact N-O 2.9Å; G316-Y323 PolarHBondContact O-N 2.85Å; G316-F368 VanDerWaalsContact CA-CD2 3.42Å; G316-F368 VanDerWaalsContact N-CE2 3.32Å
317	L	89.8	Confident	92.9	Very high	25 Å²	25	24.8 Å²	24.8	13%	0.131	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	126.8	-174.4	-157.4	155.6	0	0	0	109.6	D266 V273 K321 F322 T342	D266-L317 HydrophobicContact CB-CD1 4.07Å; D266-L317 HydrophobicContact CB-CD2 3.88Å; V273-L317 HydrophobicContact CG2-CD1 4.12Å; L317-K321 WeakPolarHBondContact CA-O 3.48Å; L317-F322 HydrophobicContact CB-CD2 4.05Å; L317-F322 HydrophobicContact CD1-CB 3.93Å; L317-F322 HydrophobicContact CD1-CD2 3.98Å; L317-F322 HydrophobicContact CD1-CG 4.38Å; L317-F322 HydrophobicContact CG-CB 4.04Å; L317-F322 HydrophobicContact CG-CD2 4.26Å; L317-T342 HydrophobicContact CD1-CG2 4.41Å
318	N	84.4	Confident	92.9	Very high	59 Å²	59	24.8 Å²	24.8	32%	0.316	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	132.5	171.7	179.2	14.5	0	0	0	109.4	G320 K321 A370	N318-G320 VanDerWaalsContact C-N 3.31Å; N318-G320 PolarHBondContact O-N 2.9Å; N318-K321 PolarHBondContact N-O 2.92Å; N318-K321 WeakPolarHBondContact O-CA 3.48Å; N318-K321 WeakPolarHBondContact O-CB 3.4Å; N318-K321 PolarHBondContact O-N 3.07Å; N318-A370 WeakPolarHBondContact CB-O 3.32Å; N318-A370 PolarHBondContact ND2-O 2.75Å; N318-A370 PolarHBondContact OD1-O 2.8Å
319	D	85.6	Confident	92.8	Very high	115 Å²	115	24.1 Å²	24.1	62%	0.615	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	47.4	172.2	-168.4	32.5	0	0	0	113.9	K321	D319-K321 PolarHBondContact O-N 2.87Å
320	G	91.3	Very high	92.4	Very high	3 Å²	3	28.8 Å²	28.8	3%	0.031	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	14.1	-177.1	0	0	0	0	0	115.8	D266 N318 T342	D266-G320 WeakPolarHBondContact OD2-CA 3.38Å; N318-G320 VanDerWaalsContact C-N 3.31Å; N318-G320 PolarHBondContact O-N 2.9Å; G320-T342 WeakPolarHBondContact CA-OG1 3.41Å; G320-T342 PolarHBondContact O-N 3.33Å; G320-T342 PolarHBondContact O-OG1 3.22Å
321	K	93.2	Very high	92.1	Very high	88 Å²	88	33.6 Å²	33.6	38%	0.383	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	110.6	173.3	-57.7	-178.1	-177	169	0	109.3	L317 N318 D319 Y323 V339 F340 L341	L317-K321 WeakPolarHBondContact CA-O 3.48Å; N318-K321 PolarHBondContact N-O 2.92Å; N318-K321 WeakPolarHBondContact O-CA 3.48Å; N318-K321 WeakPolarHBondContact O-CB 3.4Å; N318-K321 PolarHBondContact O-N 3.07Å; D319-K321 PolarHBondContact O-N 2.87Å; K321-Y323 HydrophobicContact CB-CD2 4.28Å; K321-Y323 HydrophobicContact CB-CE2 3.63Å; K321-V339 HydrophobicContact CB-CG2 3.9Å; K321-F340 WeakPolarHBondContact CA-O 3.26Å; K321-L341 HydrophobicContact CD-CD2 4.32Å; K321-L341 HydrophobicContact CG-CD2 3.78Å
322	F	94.4	Very high	92.1	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	106.9	176.7	176.8	-108.2	0	0	0	109.7	A262 V273 F275 F315 L317 V339 F340 W347	A262-F322 HydrophobicContact CB-CE1 4.35Å; A262-F322 HydrophobicContact CB-CZ 3.72Å; V273-F322 HydrophobicContact CB-CG 4.4Å; V273-F322 HydrophobicContact CG1-CD1 3.82Å; V273-F322 HydrophobicContact CG1-CE1 4.04Å; V273-F322 HydrophobicContact CG1-CG 4.13Å; F275-F322 HydrophobicContact CB-CE1 4.17Å; F315-F322 HydrophobicContact CB-CE2 4.04Å; F315-F322 HydrophobicContact CB-CZ 4.02Å; F315-F322 AromaticContact CD2-CE2 3.82Å; F315-F322 HydrophobicContact CD2-CE2 3.82Å; F315-F322 HydrophobicContact CD2-CZ 4.32Å; F315-F322 HydrophobicContact CG-CE2 4.21Å; F315-F322 HydrophobicContact CG-CZ 4.31Å; L317-F322 HydrophobicContact CB-CD2 4.05Å; L317-F322 HydrophobicContact CD1-CB 3.93Å; L317-F322 HydrophobicContact CD1-CD2 3.98Å; L317-F322 HydrophobicContact CD1-CG 4.38Å; L317-F322 HydrophobicContact CG-CB 4.04Å; L317-F322 HydrophobicContact CG-CD2 4.26Å; F322-V339 CarbonylContact O-C 3.59Å; F322-V339 WeakPolarHBondContact O-CA 3.32Å; F322-F340 HydrophobicContact CB-CB 4.14Å; F322-F340 HydrophobicContact CB-CD1 4.42Å; F322-F340 HydrophobicContact CD1-CB 4.2Å; F322-F340 PolarHBondContact N-O 2.97Å; F322-F340 PolarHBondContact O-N 3.47Å; F322-W347 AromaticContact CD1-CH2 3.7Å; F322-W347 HydrophobicContact CD1-CH2 3.7Å; F322-W347 HydrophobicContact CD1-CZ2 4.36Å; F322-W347 HydrophobicContact CD1-CZ3 4.42Å; F322-W347 AromaticContact CE1-CH2 3.86Å; F322-W347 HydrophobicContact CE1-CH2 3.86Å; F322-W347 HydrophobicContact CE1-CZ2 4.49Å
323	Y	93.7	Very high	92.1	Very high	21 Å²	21	38 Å²	38	8%	0.082	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	145.3	-179.2	-66.8	-90.4	0	0	0	111	F315 G316 K321 W338 V339 L350 F368 I396	F315-Y323 VanDerWaalsContact CA-O 3.22Å; F315-Y323 WeakPolarHBondContact CA-O 3.33Å; F315-Y323 WeakPolarHBondContact CB-O 3.46Å; G316-Y323 PolarHBondContact N-O 2.9Å; G316-Y323 PolarHBondContact O-N 2.85Å; K321-Y323 HydrophobicContact CB-CD2 4.28Å; K321-Y323 HydrophobicContact CB-CE2 3.63Å; Y323-W338 CarbonylContact C-O 3.54Å; Y323-W338 VanDerWaalsContact CA-O 3.3Å; Y323-W338 WeakPolarHBondContact CA-O 3.32Å; Y323-V339 HydrophobicContact CD1-CB 3.82Å; Y323-V339 HydrophobicContact CD1-CG2 3.84Å; Y323-V339 HydrophobicContact CD2-CG2 4.49Å; Y323-V339 HydrophobicContact CE1-CB 3.86Å; Y323-V339 HydrophobicContact CE1-CG2 3.67Å; Y323-V339 HydrophobicContact CE2-CG2 4.34Å; Y323-V339 HydrophobicContact CG-CG2 4.24Å; Y323-L350 HydrophobicContact CD1-CD1 4.36Å; Y323-L350 HydrophobicContact CE1-CD1 4.05Å; Y323-F368 HydrophobicContact CD1-CE1 4.44Å; Y323-F368 HydrophobicContact CD2-CD1 4.29Å; Y323-F368 AromaticContact CD2-CE1 3.83Å; Y323-F368 HydrophobicContact CD2-CE1 3.83Å; Y323-F368 HydrophobicContact CG-CD1 4.47Å; Y323-F368 AromaticContact CG-CE1 3.58Å; Y323-F368 HydrophobicContact CG-CE1 3.58Å; Y323-F368 HydrophobicContact CG-CZ 4.12Å; Y323-I396 HydrophobicContact CE1-CG2 4.03Å; Y323-I396 HydrophobicContact CE2-CD1 4.28Å; Y323-I396 WeakPolarHBondContact OH-CG2 3.48Å
324	L	94.5	Very high	92.1	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132.4	-178.8	-171.7	76.9	0	0	0	109	A262 F275 P307 M310 A313 F315 V337 W338 W347	A262-L324 HydrophobicContact CB-CD1 3.5Å; A262-L324 VanDerWaalsContact CB-CD1 3.5Å; F275-L324 HydrophobicContact CD1-CD1 4.27Å; F275-L324 HydrophobicContact CD1-CD2 3.41Å; F275-L324 VanDerWaalsContact CD1-CD2 3.41Å; F275-L324 HydrophobicContact CD1-CG 4.49Å; F275-L324 HydrophobicContact CE1-CD2 3.41Å; F275-L324 VanDerWaalsContact CE1-CD2 3.41Å; F275-L324 HydrophobicContact CG-CD2 4.38Å; F275-L324 HydrophobicContact CZ-CD2 4.38Å; P307-L324 HydrophobicContact CB-CD2 4.1Å; P307-L324 HydrophobicContact CG-CD2 3.93Å; M310-L324 HydrophobicContact CE-CD2 4.43Å; M310-L324 HydrophobicContact SD-CD2 3.69Å; M310-L324 HydrophobicContact SD-CG 4.36Å; A313-L324 HydrophobicContact CB-CD1 3.52Å; A313-L324 HydrophobicContact CB-CG 4Å; F315-L324 HydrophobicContact CB-CD1 4.07Å; L324-V337 WeakPolarHBondContact O-CA 3.35Å; L324-W338 HydrophobicContact CB-CB 4.28Å; L324-W338 PolarHBondContact N-O 2.76Å; L324-W338 PolarHBondContact O-N 3.01Å; L324-W347 HydrophobicContact CB-CH2 4.37Å; L324-W347 HydrophobicContact CB-CZ3 4.18Å; L324-W347 HydrophobicContact CD2-CH2 4.28Å; L324-W347 HydrophobicContact CD2-CZ3 4.44Å
325	V	94.3	Very high	92	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	123.8	-178	-176	0	0	0	0	111.1	A314 V337 F368 I375 Y377 W401	A314-V325 PolarHBondContact N-O 2.86Å; A314-V325 PolarHBondContact O-N 3.24Å; V325-V337 HydrophobicContact CG1-CG2 4.4Å; V325-V337 HydrophobicContact CG2-CG1 4.19Å; V325-V337 HydrophobicContact CG2-CG2 4.23Å; V325-F368 HydrophobicContact CG2-CZ 4.16Å; V325-I375 HydrophobicContact CG2-CD1 3.84Å; V325-I375 HydrophobicContact CG2-CG2 4.39Å; V325-Y377 HydrophobicContact CB-CD2 4.37Å; V325-Y377 HydrophobicContact CB-CE2 4.28Å; V325-Y377 HydrophobicContact CG1-CD1 4.34Å; V325-Y377 HydrophobicContact CG1-CD2 3.82Å; V325-Y377 HydrophobicContact CG1-CE1 4.25Å; V325-Y377 HydrophobicContact CG1-CE2 3.72Å; V325-Y377 HydrophobicContact CG1-CG 4.12Å; V325-W401 HydrophobicContact CG1-CH2 3.84Å; V325-W401 HydrophobicContact CG1-CZ2 3.99Å
326	G	92.7	Very high	92	Very high	2 Å²	2	38.4 Å²	38.4	2%	0.021	20%	0.2	C	C	.	.			trans	62.7	-128.6	175.9	0	0	0	0	0	114.1	F334 D336 Y377	G326-F334 WeakPolarHBondContact CA-O 3.45Å; G326-D336 PolarHBondContact N-O 3.35Å; G326-D336 VanDerWaalsContact N-O 3.1Å; G326-Y377 WeakPolarHBondContact CA-OH 3.22Å
327	G	93.7	Very high	92.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.			trans	86.4	173.7	-166.8	0	0	0	0	0	111.6	H311 C333 F334 R361	H311-G327 WeakPolarHBondContact O-CA 3.48Å; G327-C333 CarbonylContact O-C 3.5Å; G327-C333 WeakPolarHBondContact O-CA 3.39Å; G327-F334 PolarHBondContact O-N 2.86Å; G327-R361 PolarHBondContact N-O 3.42Å
328	C	94.9	Very high	92.5	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.014	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-134.2	154.4	-177.9	-48.3	0	0	0	0	111.6	M310 H311 Q332 C333 L362	M310-C328 CarbonylContact C-O 3.5Å; M310-C328 VanDerWaalsContact CA-O 3.24Å; M310-C328 WeakPolarHBondContact CA-O 3.27Å; H311-C328 PolarHBondContact CD2-O 2.94Å; H311-C328 PolarHBondContact N-O 2.84Å; H311-C328 PolarHBondContact O-N 2.85Å; C328-Q332 VanDerWaalsContact CA-O 3.31Å; C328-Q332 WeakPolarHBondContact CA-O 3.48Å; C328-Q332 WeakPolarHBondContact CB-O 3.32Å; C328-C333 HydrophobicContact CB-CB 4.01Å; C328-C333 WeakPolarHBondContact CB-SG 3.21Å; C328-C333 WeakPolarHBondContact SG-CB 3.2Å; C328-C333 CovalentContact SG-SG 2.04Å; C328-C333 PolarHBondContact SG-SG 3.46Å; C328-L362 HydrophobicContact CB-CD1 4.39Å
329	D	92.8	Very high	93	Very high	28 Å²	28	35.5 Å²	35.5	15%	0.15	18%	0.182	C	C	.	.			trans	-105.5	-166.2	160.8	67.4	22.6	0	0	0	109.7	N284 A309 T331 Q332 F334 I383	N284-D329 WeakPolarHBondContact ND2-CA 3.47Å; A309-D329 WeakPolarHBondContact O-CB 3.3Å; D329-T331 PolarHBondContact O-N 2.78Å; D329-T331 VanDerWaalsContact OD1-CA 3.3Å; D329-T331 WeakPolarHBondContact OD1-CA 3.4Å; D329-T331 WeakPolarHBondContact OD1-CB 3.39Å; D329-T331 PolarHBondContact OD1-N 2.96Å; D329-T331 PolarHBondContact OD1-OG1 3.27Å; D329-T331 PolarHBondContact OD2-OG1 3.11Å; D329-Q332 PolarHBondContact N-O 3.4Å; D329-Q332 PolarHBondContact OD1-N 3.11Å; D329-F334 HydrophobicContact CB-CE2 4.13Å; D329-F334 HydrophobicContact CB-CZ 4.42Å; D329-F334 VanDerWaalsContact OD2-CZ 3.31Å; D329-F334 WeakPolarHBondContact OD2-CZ 3.13Å; D329-I383 WeakPolarHBondContact O-CD1 2.96Å
330	Q	88.8	Confident	93.6	Very high	128 Å²	128	30 Å²	30	60%	0.598	15%	0.152	S	C	*	.	S	Bend	trans	-70.5	-13	178.9	-61.7	179.5	16.7	0	0	113.5	D282 N284	D282-Q330 PolarHBondContact O-NE2 2.91Å; N284-Q330 PolarHBondContact ND2-N 2.8Å
331	T	91	Very high	93.8	Very high	106 Å²	106	31.7 Å²	31.7	65%	0.65	16%	0.161	S	C	*	.	S	Bend	trans	-115.1	-36.9	-169.3	68.5	0	0	0	0	113.4	D329	D329-T331 PolarHBondContact O-N 2.78Å; D329-T331 VanDerWaalsContact OD1-CA 3.3Å; D329-T331 WeakPolarHBondContact OD1-CA 3.4Å; D329-T331 WeakPolarHBondContact OD1-CB 3.39Å; D329-T331 PolarHBondContact OD1-N 2.96Å; D329-T331 PolarHBondContact OD1-OG1 3.27Å; D329-T331 PolarHBondContact OD2-OG1 3.11Å
332	Q	93.8	Very high	93.9	Very high	100 Å²	100	27.5 Å²	27.5	47%	0.467	14%	0.142	S	C	.	.			trans	-153.1	165	-173.1	66.6	-176.8	-17.7	0	0	112.1	C328 D329 F334	C328-Q332 VanDerWaalsContact CA-O 3.31Å; C328-Q332 WeakPolarHBondContact CA-O 3.48Å; C328-Q332 WeakPolarHBondContact CB-O 3.32Å; D329-Q332 PolarHBondContact N-O 3.4Å; D329-Q332 PolarHBondContact OD1-N 3.11Å; Q332-F334 HydrophobicContact CG-CD1 4.5Å; Q332-F334 HydrophobicContact CG-CE1 3.98Å; Q332-F334 HydrophobicContact CG-CZ 4.02Å; Q332-F334 VanDerWaalsContact NE2-CE1 3.25Å
333	C	94.8	Very high	93.9	Very high	25 Å²	25	30.7 Å²	30.7	17%	0.169	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-110.4	136	168.2	-63.7	0	0	0	0	109.7	G327 C328 G360 I383	G327-C333 CarbonylContact O-C 3.5Å; G327-C333 WeakPolarHBondContact O-CA 3.39Å; C328-C333 HydrophobicContact CB-CB 4.01Å; C328-C333 WeakPolarHBondContact CB-SG 3.21Å; C328-C333 WeakPolarHBondContact SG-CB 3.2Å; C328-C333 CovalentContact SG-SG 2.04Å; C328-C333 PolarHBondContact SG-SG 3.46Å; C333-G360 WeakPolarHBondContact CB-O 3.31Å; C333-I383 PolarHBondContact SG-N 3.05Å
334	F	93.9	Very high	94	Very high	19 Å²	19	32.5 Å²	32.5	8%	0.083	18%	0.178	C	C	.	.			trans	-89.3	153.2	-176.3	-55.2	-79.8	0	0	0	111.2	P308 M310 G326 G327 D329 Q332 G360	P308-F334 HydrophobicContact CB-CE1 4.26Å; P308-F334 HydrophobicContact CB-CE2 4.41Å; P308-F334 HydrophobicContact CB-CZ 3.89Å; P308-F334 HydrophobicContact CG-CD1 4.06Å; P308-F334 HydrophobicContact CG-CD2 4.29Å; P308-F334 HydrophobicContact CG-CE1 3.66Å; P308-F334 HydrophobicContact CG-CE2 3.92Å; P308-F334 HydrophobicContact CG-CG 4.36Å; P308-F334 HydrophobicContact CG-CZ 3.59Å; M310-F334 HydrophobicContact CB-CD2 4.37Å; M310-F334 HydrophobicContact CB-CE2 4.26Å; M310-F334 HydrophobicContact CE-CD2 4.1Å; M310-F334 HydrophobicContact CE-CE2 4.46Å; G326-F334 WeakPolarHBondContact CA-O 3.45Å; G327-F334 PolarHBondContact O-N 2.86Å; D329-F334 HydrophobicContact CB-CE2 4.13Å; D329-F334 HydrophobicContact CB-CZ 4.42Å; D329-F334 VanDerWaalsContact OD2-CZ 3.31Å; D329-F334 WeakPolarHBondContact OD2-CZ 3.13Å; Q332-F334 HydrophobicContact CG-CD1 4.5Å; Q332-F334 HydrophobicContact CG-CE1 3.98Å; Q332-F334 HydrophobicContact CG-CZ 4.02Å; Q332-F334 VanDerWaalsContact NE2-CE1 3.25Å; F334-G360 WeakPolarHBondContact O-CA 3.31Å
335	D	91.3	Very high	94.1	Very high	49 Å²	49	35.4 Å²	35.4	26%	0.262	19%	0.191	S	C	.	.			trans	-114.6	7.2	169.6	71.2	-37.4	0	0	0	112.3	P358	D335-P358 VanDerWaalsContact CB-O 3.23Å; D335-P358 WeakPolarHBondContact CB-O 3.48Å
336	D	93	Very high	94.2	Very high	27 Å²	27	39.2 Å²	39.2	14%	0.144	21%	0.209	C	C	.	.			trans	-66.7	148.5	-178.6	-74.6	-33.8	0	0	0	112.1	G326 K349	G326-D336 PolarHBondContact N-O 3.35Å; G326-D336 VanDerWaalsContact N-O 3.1Å; D336-K349 WeakPolarHBondContact OD1-CE 3.26Å; D336-K349 IonicContact OD1-NZ 3.12Å; D336-K349 PolarHBondContact OD1-NZ 3.32Å; D336-K349 WeakPolarHBondContact OD2-CE 3.33Å; D336-K349 IonicContact OD2-NZ 2.96Å; D336-K349 PolarHBondContact OD2-NZ 3.01Å
337	V	94.6	Very high	94.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	124.3	171.3	-176.3	0	0	0	0	108.4	L324 V325 L350 P352 F394 W401	L324-V337 WeakPolarHBondContact O-CA 3.35Å; V325-V337 HydrophobicContact CG1-CG2 4.4Å; V325-V337 HydrophobicContact CG2-CG1 4.19Å; V325-V337 HydrophobicContact CG2-CG2 4.23Å; V337-L350 HydrophobicContact CB-CB 4.22Å; V337-L350 HydrophobicContact CG1-CB 4.22Å; V337-L350 HydrophobicContact CG1-CD1 3.9Å; V337-L350 HydrophobicContact CG1-CG 4.34Å; V337-L350 PolarHBondContact O-N 2.99Å; V337-P352 HydrophobicContact CG2-CG 4.17Å; V337-F394 HydrophobicContact CG1-CE1 4.18Å; V337-F394 HydrophobicContact CG1-CZ 4.39Å; V337-F394 HydrophobicContact CG2-CE2 4.44Å; V337-F394 HydrophobicContact CG2-CZ 4.47Å; V337-W401 HydrophobicContact CG2-CZ2 3.61Å
338	W	95.8	Very high	94.6	Very high	20 Å²	20	43.3 Å²	43.3	8%	0.076	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	151.3	177.8	-70.6	85	0	0	0	110.4	V305 A306 P307 Y323 L324 W347 H348 K349	V305-W338 HydrophobicContact CG1-CH2 4.34Å; V305-W338 HydrophobicContact CG1-CZ3 3.9Å; A306-W338 VanDerWaalsContact O-CH2 3.3Å; A306-W338 WeakPolarHBondContact O-CH2 3.48Å; P307-W338 HydrophobicContact CB-CD2 3.88Å; P307-W338 HydrophobicContact CB-CE3 4.47Å; P307-W338 HydrophobicContact CB-CG 3.93Å; P307-W338 HydrophobicContact CB-CZ2 4.39Å; P307-W338 HydrophobicContact CG-CB 3.96Å; P307-W338 HydrophobicContact CG-CD2 3.68Å; P307-W338 HydrophobicContact CG-CE3 3.95Å; P307-W338 HydrophobicContact CG-CG 3.7Å; Y323-W338 CarbonylContact C-O 3.54Å; Y323-W338 VanDerWaalsContact CA-O 3.3Å; Y323-W338 WeakPolarHBondContact CA-O 3.32Å; L324-W338 HydrophobicContact CB-CB 4.28Å; L324-W338 PolarHBondContact N-O 2.76Å; L324-W338 PolarHBondContact O-N 3.01Å; W338-W347 HydrophobicContact CB-CE3 3.92Å; W338-W347 HydrophobicContact CB-CZ3 3.9Å; W338-W347 HydrophobicContact CE3-CB 4.22Å; W338-W347 HydrophobicContact CE3-CE3 4.43Å; W338-W347 HydrophobicContact CZ3-CB 4.33Å; W338-H348 WeakPolarHBondContact CA-O 3.42Å; W338-K349 HydrophobicContact CD2-CB 3.96Å; W338-K349 HydrophobicContact CD2-CG 4.16Å; W338-K349 HydrophobicContact CE3-CB 3.8Å; W338-K349 HydrophobicContact CE3-CG 4.5Å; W338-K349 HydrophobicContact CH2-CB 3.73Å; W338-K349 HydrophobicContact CH2-CD 4.16Å; W338-K349 HydrophobicContact CH2-CG 4.27Å; W338-K349 HydrophobicContact CZ2-CB 3.87Å; W338-K349 HydrophobicContact CZ2-CD 3.63Å; W338-K349 HydrophobicContact CZ2-CG 3.89Å; W338-K349 HydrophobicContact CZ3-CB 3.69Å
339	V	95.4	Very high	94.6	Very high	11 Å²	11	48.4 Å²	48.4	7%	0.067	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	131.6	171.7	64	0	0	0	0	109.8	K321 F322 Y323 L341 W347 H348 L350	K321-V339 HydrophobicContact CB-CG2 3.9Å; F322-V339 CarbonylContact O-C 3.59Å; F322-V339 WeakPolarHBondContact O-CA 3.32Å; Y323-V339 HydrophobicContact CD1-CB 3.82Å; Y323-V339 HydrophobicContact CD1-CG2 3.84Å; Y323-V339 HydrophobicContact CD2-CG2 4.49Å; Y323-V339 HydrophobicContact CE1-CB 3.86Å; Y323-V339 HydrophobicContact CE1-CG2 3.67Å; Y323-V339 HydrophobicContact CE2-CG2 4.34Å; Y323-V339 HydrophobicContact CG-CG2 4.24Å; V339-L341 HydrophobicContact CG2-CD2 4.36Å; V339-W347 CarbonylContact O-C 3.47Å; V339-W347 WeakPolarHBondContact O-CA 3.5Å; V339-H348 HydrophobicContact CG1-CB 3.91Å; V339-H348 PolarHBondContact N-O 2.83Å; V339-H348 PolarHBondContact O-N 2.89Å; V339-L350 HydrophobicContact CG1-CD1 4.4Å; V339-L350 HydrophobicContact CG1-CD2 3.77Å; V339-L350 HydrophobicContact CG1-CG 4.1Å
340	F	97	Very high	94.7	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	125.8	172.1	179.9	-105.6	0	0	0	109.7	V273 T288 I290 V301 K321 F322 T342 F345 E346 W347	V273-F340 HydrophobicContact CG1-CD1 4.06Å; V273-F340 HydrophobicContact CG1-CE1 4.22Å; V273-F340 HydrophobicContact CG2-CD1 4.41Å; V273-F340 HydrophobicContact CG2-CE1 4.32Å; T288-F340 HydrophobicContact CG2-CE2 4.1Å; T288-F340 HydrophobicContact CG2-CZ 4.08Å; I290-F340 HydrophobicContact CD1-CE1 3.89Å; I290-F340 HydrophobicContact CD1-CZ 3.89Å; I290-F340 HydrophobicContact CG1-CE1 4.48Å; V301-F340 HydrophobicContact CG1-CE2 4.08Å; V301-F340 HydrophobicContact CG1-CZ 4.2Å; V301-F340 HydrophobicContact CG2-CZ 4.45Å; K321-F340 WeakPolarHBondContact CA-O 3.26Å; F322-F340 HydrophobicContact CB-CB 4.14Å; F322-F340 HydrophobicContact CB-CD1 4.42Å; F322-F340 HydrophobicContact CD1-CB 4.2Å; F322-F340 PolarHBondContact N-O 2.97Å; F322-F340 PolarHBondContact O-N 3.47Å; F340-T342 HydrophobicContact CD1-CG2 4.19Å; F340-T342 HydrophobicContact CE1-CG2 4.26Å; F340-F345 HydrophobicContact CE1-CD1 4.34Å; F340-F345 HydrophobicContact CE2-CB 4.25Å; F340-F345 WeakPolarHBondContact CE2-O 3.22Å; F340-F345 VanDerWaalsContact CZ-CA 3.46Å; F340-F345 HydrophobicContact CZ-CB 3.87Å; F340-F345 HydrophobicContact CZ-CD1 4.02Å; F340-F345 HydrophobicContact CZ-CG 4.42Å; F340-E346 WeakPolarHBondContact CA-O 3.28Å; F340-W347 HydrophobicContact CB-CD2 3.67Å; F340-W347 HydrophobicContact CB-CE3 3.58Å; F340-W347 HydrophobicContact CB-CG 4.44Å; F340-W347 HydrophobicContact CB-CH2 3.73Å; F340-W347 HydrophobicContact CB-CZ2 3.79Å; F340-W347 HydrophobicContact CB-CZ3 3.62Å; F340-W347 AromaticContact CD2-CD1 3.62Å; F340-W347 AromaticContact CD2-CD2 3.74Å; F340-W347 HydrophobicContact CD2-CD2 3.74Å; F340-W347 AromaticContact CD2-CE2 3.56Å; F340-W347 AromaticContact CD2-CG 3.78Å; F340-W347 HydrophobicContact CD2-CG 3.78Å; F340-W347 HydrophobicContact CD2-CZ2 4.19Å; F340-W347 AromaticContact CD2-NE1 3.46Å; F340-W347 AromaticContact CE2-NE1 3.92Å; F340-W347 HydrophobicContact CG-CD2 4.15Å; F340-W347 AromaticContact CG-CE2 3.93Å; F340-W347 HydrophobicContact CG-CZ2 4.13Å
341	L	96.2	Very high	94.9	Very high	39 Å²	39	45.4 Å²	45.4	20%	0.204	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	114.7	175.7	-57.8	-178	0	0	0	109.2	K321 V339 S343 T344 F345 E346	K321-L341 HydrophobicContact CD-CD2 4.32Å; K321-L341 HydrophobicContact CG-CD2 3.78Å; V339-L341 HydrophobicContact CG2-CD2 4.36Å; L341-S343 PolarHBondContact O-N 3.13Å; L341-T344 PolarHBondContact O-N 2.79Å; L341-F345 WeakPolarHBondContact O-CA 3.41Å; L341-F345 PolarHBondContact O-N 2.83Å; L341-E346 PolarHBondContact N-O 2.68Å; L341-E346 PolarHBondContact O-N 3.06Å
342	T	95.2	Very high	94.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-12.2	178.6	62.5	0	0	0	0	113.1	D266 R269 V273 L317 G320 F340 F345	D266-T342 HydrophobicContact CB-CG2 4.26Å; D266-T342 WeakPolarHBondContact OD2-CB 3.45Å; D266-T342 PolarHBondContact OD2-OG1 3.09Å; R269-T342 PolarHBondContact NH1-OG1 3.4Å; R269-T342 VanDerWaalsContact NH1-OG1 3.15Å; V273-T342 HydrophobicContact CG2-CG2 3.82Å; L317-T342 HydrophobicContact CD1-CG2 4.41Å; G320-T342 WeakPolarHBondContact CA-OG1 3.41Å; G320-T342 PolarHBondContact O-N 3.33Å; G320-T342 PolarHBondContact O-OG1 3.22Å; F340-T342 HydrophobicContact CD1-CG2 4.19Å; F340-T342 HydrophobicContact CE1-CG2 4.26Å; T342-F345 WeakPolarHBondContact O-CD1 3.37Å; T342-F345 WeakPolarHBondContact O-CE1 3.42Å
343	S	95.3	Very high	94.8	Very high	67 Å²	67	42.1 Å²	42.1	47%	0.469	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-40.8	175.1	54.6	0	0	0	0	113.1	L341	L341-S343 PolarHBondContact O-N 3.13Å
344	T	95.5	Very high	94.6	Very high	58 Å²	58	43.3 Å²	43.3	36%	0.356	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-10.6	-177.4	60.4	0	0	0	0	112.6	R303 L341 E346	R303-T344 PolarHBondContact NH2-O 2.77Å; L341-T344 PolarHBondContact O-N 2.79Å; T344-E346 VanDerWaalsContact C-N 3.31Å
345	F	96	Very high	94.4	Very high	63 Å²	63	51.7 Å²	51.7	28%	0.276	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	41.6	-171.1	-50.9	-45	0	0	0	113	Y271 I290 V301 R303 F340 L341 T342	Y271-F345 AromaticContact CD2-CE1 3.98Å; Y271-F345 HydrophobicContact CD2-CE1 3.98Å; Y271-F345 HydrophobicContact CD2-CZ 4.38Å; Y271-F345 AromaticContact CE2-CE1 3.69Å; Y271-F345 HydrophobicContact CE2-CE1 3.69Å; Y271-F345 AromaticContact CE2-CZ 3.67Å; Y271-F345 HydrophobicContact CE2-CZ 3.67Å; I290-F345 HydrophobicContact CD1-CD1 3.16Å; I290-F345 HydrophobicContact CD1-CE1 3.18Å; I290-F345 HydrophobicContact CD1-CG 4.03Å; I290-F345 HydrophobicContact CD1-CZ 4.06Å; V301-F345 HydrophobicContact CG1-CB 3.95Å; V301-F345 HydrophobicContact CG2-CB 4.45Å; R303-F345 WeakPolarHBondContact CG-O 3.37Å; R303-F345 PolarHBondContact NE-O 2.69Å; F340-F345 HydrophobicContact CE1-CD1 4.34Å; F340-F345 HydrophobicContact CE2-CB 4.25Å; F340-F345 WeakPolarHBondContact CE2-O 3.22Å; F340-F345 VanDerWaalsContact CZ-CA 3.46Å; F340-F345 HydrophobicContact CZ-CB 3.87Å; F340-F345 HydrophobicContact CZ-CD1 4.02Å; F340-F345 HydrophobicContact CZ-CG 4.42Å; L341-F345 WeakPolarHBondContact O-CA 3.41Å; L341-F345 PolarHBondContact O-N 2.83Å; T342-F345 WeakPolarHBondContact O-CD1 3.37Å; T342-F345 WeakPolarHBondContact O-CE1 3.42Å
346	E	96.9	Very high	94.4	Very high	80 Å²	80	52.8 Å²	52.8	37%	0.374	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	139.6	-177.4	-67.1	178.6	158.6	0	0	111.8	F340 L341 T344 H348	F340-E346 WeakPolarHBondContact CA-O 3.28Å; L341-E346 PolarHBondContact N-O 2.68Å; L341-E346 PolarHBondContact O-N 3.06Å; T344-E346 VanDerWaalsContact C-N 3.31Å; E346-H348 IonicContact OE2-NE2 3.81Å
347	W	97.9	Very high	94.3	Very high	6 Å²	6	56.1 Å²	56.1	2%	0.023	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	136.8	170.9	-74.5	102.7	0	0	0	110.7	F275 T288 V305 P307 F322 L324 W338 V339 F340	F275-W347 HydrophobicContact CB-CH2 4.39Å; F275-W347 HydrophobicContact CB-CZ2 4.1Å; F275-W347 HydrophobicContact CD2-CH2 4.28Å; F275-W347 AromaticContact CD2-CZ2 3.56Å; F275-W347 HydrophobicContact CD2-CZ2 3.56Å; F275-W347 HydrophobicContact CE2-CZ2 4.17Å; F275-W347 HydrophobicContact CG-CH2 4.14Å; F275-W347 AromaticContact CG-CZ2 3.82Å; F275-W347 HydrophobicContact CG-CZ2 3.82Å; T288-W347 HydrophobicContact CG2-CZ2 4.34Å; T288-W347 PolarHBondContact OG1-NE1 3.19Å; V305-W347 WeakPolarHBondContact O-CB 3.32Å; P307-W347 VanDerWaalsContact CD-CD2 3.48Å; P307-W347 HydrophobicContact CG-CD2 3.86Å; P307-W347 HydrophobicContact CG-CE3 3.66Å; P307-W347 HydrophobicContact CG-CH2 4.09Å; P307-W347 HydrophobicContact CG-CZ2 4.29Å; P307-W347 HydrophobicContact CG-CZ3 3.78Å; F322-W347 AromaticContact CD1-CH2 3.7Å; F322-W347 HydrophobicContact CD1-CH2 3.7Å; F322-W347 HydrophobicContact CD1-CZ2 4.36Å; F322-W347 HydrophobicContact CD1-CZ3 4.42Å; F322-W347 AromaticContact CE1-CH2 3.86Å; F322-W347 HydrophobicContact CE1-CH2 3.86Å; F322-W347 HydrophobicContact CE1-CZ2 4.49Å; L324-W347 HydrophobicContact CB-CH2 4.37Å; L324-W347 HydrophobicContact CB-CZ3 4.18Å; L324-W347 HydrophobicContact CD2-CH2 4.28Å; L324-W347 HydrophobicContact CD2-CZ3 4.44Å; W338-W347 HydrophobicContact CB-CE3 3.92Å; W338-W347 HydrophobicContact CB-CZ3 3.9Å; W338-W347 HydrophobicContact CE3-CB 4.22Å; W338-W347 HydrophobicContact CE3-CE3 4.43Å; W338-W347 HydrophobicContact CZ3-CB 4.33Å; V339-W347 CarbonylContact O-C 3.47Å; V339-W347 WeakPolarHBondContact O-CA 3.5Å; F340-W347 HydrophobicContact CB-CD2 3.67Å; F340-W347 HydrophobicContact CB-CE3 3.58Å; F340-W347 HydrophobicContact CB-CG 4.44Å; F340-W347 HydrophobicContact CB-CH2 3.73Å; F340-W347 HydrophobicContact CB-CZ2 3.79Å; F340-W347 HydrophobicContact CB-CZ3 3.62Å; F340-W347 AromaticContact CD2-CD1 3.62Å; F340-W347 AromaticContact CD2-CD2 3.74Å; F340-W347 HydrophobicContact CD2-CD2 3.74Å; F340-W347 AromaticContact CD2-CE2 3.56Å; F340-W347 AromaticContact CD2-CG 3.78Å; F340-W347 HydrophobicContact CD2-CG 3.78Å; F340-W347 HydrophobicContact CD2-CZ2 4.19Å; F340-W347 AromaticContact CD2-NE1 3.46Å; F340-W347 AromaticContact CE2-NE1 3.92Å; F340-W347 HydrophobicContact CG-CD2 4.15Å; F340-W347 AromaticContact CG-CE2 3.93Å; F340-W347 HydrophobicContact CG-CZ2 4.13Å
348	H	96.6	Very high	94.2	Very high	81 Å²	81	56.3 Å²	56.3	38%	0.375	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.8	170	-57.8	-80	0	0	0	109.5	W338 V339 E346	W338-H348 WeakPolarHBondContact CA-O 3.42Å; V339-H348 HydrophobicContact CG1-CB 3.91Å; V339-H348 PolarHBondContact N-O 2.83Å; V339-H348 PolarHBondContact O-N 2.89Å; E346-H348 IonicContact OE2-NE2 3.81Å
349	K	95.9	Very high	94.1	Very high	109 Å²	109	58.8 Å²	58.8	47%	0.474	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	123	169	-170.2	170.1	176.8	159.5	0	108.6	D336 W338	D336-K349 WeakPolarHBondContact OD1-CE 3.26Å; D336-K349 IonicContact OD1-NZ 3.12Å; D336-K349 PolarHBondContact OD1-NZ 3.32Å; D336-K349 WeakPolarHBondContact OD2-CE 3.33Å; D336-K349 IonicContact OD2-NZ 2.96Å; D336-K349 PolarHBondContact OD2-NZ 3.01Å; W338-K349 HydrophobicContact CD2-CB 3.96Å; W338-K349 HydrophobicContact CD2-CG 4.16Å; W338-K349 HydrophobicContact CE3-CB 3.8Å; W338-K349 HydrophobicContact CE3-CG 4.5Å; W338-K349 HydrophobicContact CH2-CB 3.73Å; W338-K349 HydrophobicContact CH2-CD 4.16Å; W338-K349 HydrophobicContact CH2-CG 4.27Å; W338-K349 HydrophobicContact CZ2-CB 3.87Å; W338-K349 HydrophobicContact CZ2-CD 3.63Å; W338-K349 HydrophobicContact CZ2-CG 3.89Å; W338-K349 HydrophobicContact CZ3-CB 3.69Å
350	L	94.1	Very high	93.9	Very high	21 Å²	21	58.8 Å²	58.8	11%	0.11	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	141.3	172.4	-57	-171.4	0	0	0	109.1	Y323 V337 V339 P352	Y323-L350 HydrophobicContact CD1-CD1 4.36Å; Y323-L350 HydrophobicContact CE1-CD1 4.05Å; V337-L350 HydrophobicContact CB-CB 4.22Å; V337-L350 HydrophobicContact CG1-CB 4.22Å; V337-L350 HydrophobicContact CG1-CD1 3.9Å; V337-L350 HydrophobicContact CG1-CG 4.34Å; V337-L350 PolarHBondContact O-N 2.99Å; V339-L350 HydrophobicContact CG1-CD1 4.4Å; V339-L350 HydrophobicContact CG1-CD2 3.77Å; V339-L350 HydrophobicContact CG1-CG 4.1Å; L350-P352 WeakPolarHBondContact O-CD 3.47Å
351	A	91.9	Very high	93.8	Very high	73 Å²	73	58.8 Å²	58.8	60%	0.603	32%	0.315	S	S	*	.			trans	-106.7	94.4	173.8	0	0	0	0	0	109.1	K353	A351-K353 PolarHBondContact O-N 3.32Å
352	P	92.5	Very high	93.6	Very high	8 Å²	8	58.4 Å²	58.4	5%	0.052	31%	0.313	C	S	.	.			trans	-51.9	132.2	176.1	-28.2	31.1	0	0	0	112.7	V337 L350 R357 F394 Q399	V337-P352 HydrophobicContact CG2-CG 4.17Å; L350-P352 WeakPolarHBondContact O-CD 3.47Å; P352-R357 PolarHBondContact O-NH2 2.85Å; P352-F394 HydrophobicContact CB-CE2 3.94Å; P352-F394 HydrophobicContact CG-CE2 3.87Å; P352-F394 HydrophobicContact CG-CZ 4.43Å; P352-Q399 CarbonylContact C-O 3.54Å; P352-Q399 VanDerWaalsContact CA-O 3.26Å; P352-Q399 WeakPolarHBondContact CA-O 3.41Å
353	K	91	Very high	93.3	Very high	129 Å²	129	59.6 Å²	59.6	56%	0.561	33%	0.326	S	S	*	.	B	Isolated β-bridge	trans	-78.2	143.8	177	-60.8	180	-173.4	166.7	0	110.7	A351 Q399	A351-K353 PolarHBondContact O-N 3.32Å; K353-Q399 PolarHBondContact N-O 3.18Å
354	G	90.5	Very high	93	Very high	50 Å²	50	57.1 Å²	57.1	52%	0.515	31%	0.309	S	S	.	.	S	Bend	trans	89.4	176.2	-180	0	0	0	0	0	114
355	E	89.4	Confident	92.6	Very high	194 Å²	194	54.3 Å²	54.3	91%	0.907	29%	0.292	S	S	*	.	S	Bend	trans	-87.4	-22	-173.8	-62.4	-179.5	173.9	0	0	113.6	R357	E355-R357 PolarHBondContact O-N 3.41Å
356	L	91.7	Very high	91.9	Very high	73 Å²	73	51.6 Å²	51.6	38%	0.382	28%	0.282	S	S	.	.			trans	-69.6	119.1	-177.8	-172.8	68.1	0	0	0	110.1	F392 W401 K403	L356-F392 HydrophobicContact CD1-CE1 4.16Å; L356-F392 HydrophobicContact CD2-CD1 4.21Å; L356-F392 HydrophobicContact CD2-CE1 4.24Å; L356-F392 HydrophobicContact CG-CE1 4.29Å; L356-W401 HydrophobicContact CB-CB 4.49Å; L356-W401 HydrophobicContact CD2-CB 4.29Å; L356-W401 HydrophobicContact CG-CB 4.38Å; L356-K403 HydrophobicContact CD2-CB 4.11Å
357	R	91.5	Very high	91	Very high	97 Å²	97	48.2 Å²	48.2	37%	0.366	27%	0.268	S	S	.	.			trans	-127.9	125.8	173.6	-67.3	-65.1	-179	130.1	-4.9	109.8	P352 E355	P352-R357 PolarHBondContact O-NH2 2.85Å; E355-R357 PolarHBondContact O-N 3.41Å
358	P	93.1	Very high	90.2	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.019	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-68.4	147.2	174.5	30.1	-33.9	0	0	0	109.9	D335 G360 Y377 F392 W401	D335-P358 VanDerWaalsContact CB-O 3.23Å; D335-P358 WeakPolarHBondContact CB-O 3.48Å; P358-G360 PolarHBondContact O-N 3.41Å; P358-Y377 HydrophobicContact CB-CD1 4.04Å; P358-Y377 HydrophobicContact CB-CE1 4.21Å; P358-Y377 HydrophobicContact CG-CD1 4.1Å; P358-Y377 HydrophobicContact CG-CE1 4.22Å; P358-F392 HydrophobicContact CB-CD1 4.25Å; P358-F392 HydrophobicContact CB-CD2 3.61Å; P358-F392 HydrophobicContact CB-CE1 4.32Å; P358-F392 HydrophobicContact CB-CE2 3.68Å; P358-F392 HydrophobicContact CB-CG 3.91Å; P358-F392 HydrophobicContact CB-CZ 4.06Å; P358-W401 HydrophobicContact CG-CD2 3.9Å; P358-W401 HydrophobicContact CG-CE3 4.11Å; P358-W401 HydrophobicContact CG-CG 4.49Å; P358-W401 HydrophobicContact CG-CH2 4.05Å; P358-W401 HydrophobicContact CG-CZ2 3.82Å; P358-W401 HydrophobicContact CG-CZ3 4.17Å
359	T	92.3	Very high	89.5	Confident	72 Å²	72	47.1 Å²	47.1	44%	0.442	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-62	134	171	-50.3	0	0	0	0	110.2	R361 T382	T359-R361 PolarHBondContact O-NE 2.68Å; T359-R361 PolarHBondContact O-NH2 2.75Å; T359-T382 HydrophobicContact CG2-CG2 4.19Å
360	G	92.5	Very high	88.4	Confident	11 Å²	11	43.8 Å²	43.8	11%	0.113	26%	0.255	C	S	.	.	P	Polyproline II helix	trans	-59.8	137.3	172.8	0	0	0	0	0	111.9	C333 F334 P358	C333-G360 WeakPolarHBondContact CB-O 3.31Å; F334-G360 WeakPolarHBondContact O-CA 3.31Å; P358-G360 PolarHBondContact O-N 3.41Å
361	R	94.6	Very high	87.4	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	28%	0.28	C	S	.	.			trans	-153.5	153.6	-167.3	58.7	-173.5	73.6	-147.6	3.7	113	G327 T359 A364 Y377 L379 T381 L388 D390	G327-R361 PolarHBondContact N-O 3.42Å; T359-R361 PolarHBondContact O-NE 2.68Å; T359-R361 PolarHBondContact O-NH2 2.75Å; R361-A364 HydrophobicContact CG-CB 4.06Å; R361-Y377 VanDerWaalsContact CD-CE1 3.43Å; R361-Y377 HydrophobicContact CG-CE1 3.6Å; R361-Y377 HydrophobicContact CG-CE2 4.05Å; R361-Y377 WeakPolarHBondContact CG-OH 3.17Å; R361-Y377 PolarHBondContact O-OH 3.35Å; R361-L379 VanDerWaalsContact CD-O 3.29Å; R361-L379 WeakPolarHBondContact CD-O 3.2Å; R361-L379 PolarHBondContact NH1-O 3.18Å; R361-T381 CarbonylContact C-O 3.53Å; R361-T381 VanDerWaalsContact CA-O 3.26Å; R361-T381 WeakPolarHBondContact CA-O 3.32Å; R361-L388 HydrophobicContact CB-CD1 3.52Å; R361-L388 HydrophobicContact CG-CD1 4.4Å; R361-L388 VanDerWaalsContact CZ-CD1 3.5Å; R361-D390 IonicContact CZ-OD1 3.38Å; R361-D390 VanDerWaalsContact CZ-OD1 3.23Å; R361-D390 PolarHBondContact NH1-O 2.87Å; R361-D390 IonicContact NH1-OD1 2.75Å; R361-D390 PolarHBondContact NH1-OD1 3.45Å; R361-D390 IonicContact NH2-OD1 3.98Å; R361-D390 PolarHBondContact NH2-OD1 2.81Å; R361-D390 IonicContact NH2-OD2 3.67Å; R361-D390 PolarHBondContact NH2-OD2 2.92Å
362	L	92.2	Very high	86.6	Confident	31 Å²	31	44.7 Å²	44.7	16%	0.162	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-98.5	139	172.6	-170.7	69.2	0	0	0	110.6	H311 C328 A364 G380 T381	H311-L362 VanDerWaalsContact CE1-CD1 3.48Å; H311-L362 WeakPolarHBondContact CE1-CD1 3.37Å; H311-L362 WeakPolarHBondContact O-CD1 3.27Å; C328-L362 HydrophobicContact CB-CD1 4.39Å; L362-A364 VanDerWaalsContact C-N 3.34Å; L362-A364 PolarHBondContact O-N 3.36Å; L362-G380 WeakPolarHBondContact O-CA 3.37Å; L362-T381 PolarHBondContact N-O 3.33Å; L362-T381 PolarHBondContact O-N 2.84Å; L362-T381 VanDerWaalsContact O-N 3.08Å
363	G	89.2	Confident	86.3	Confident	25 Å²	25	47.5 Å²	47.5	26%	0.258	28%	0.276	S	S	.	.	S	Bend	trans	63.2	42.3	171.9	0	0	0	0	0	112.4	G312	G312-G363 PolarHBondContact O-N 2.93Å
364	A	88.4	Confident	86.3	Confident	15 Å²	15	43 Å²	43	12%	0.124	26%	0.256	C	S	.	.			trans	-61.5	146.3	176.6	0	0	0	0	0	111.1	A314 R361 L362 Y377 G378	A314-A364 HydrophobicContact CB-CB 4.37Å; R361-A364 HydrophobicContact CG-CB 4.06Å; L362-A364 VanDerWaalsContact C-N 3.34Å; L362-A364 PolarHBondContact O-N 3.36Å; A364-Y377 HydrophobicContact CB-CD2 3.47Å; A364-Y377 VanDerWaalsContact CB-CD2 3.47Å; A364-Y377 HydrophobicContact CB-CE2 3.3Å; A364-Y377 HydrophobicContact CB-CG 4.36Å; A364-G378 CarbonylContact C-O 3.55Å; A364-G378 WeakPolarHBondContact CA-O 3.33Å
365	I	86.3	Confident	86.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	168.8	170.5	71.6	149.4	0	0	0	110.8	G378 L379 I391 M422 L434 W459	I365-G378 VanDerWaalsContact CG1-O 3.28Å; I365-G378 WeakPolarHBondContact CG1-O 3.14Å; I365-G378 PolarHBondContact N-O 3.27Å; I365-G378 PolarHBondContact O-N 2.8Å; I365-L379 HydrophobicContact CD1-CB 4.48Å; I365-L379 HydrophobicContact CD1-CD1 3.74Å; I365-L379 HydrophobicContact CD1-CG 3.85Å; I365-L379 HydrophobicContact CG1-CB 4Å; I365-L379 HydrophobicContact CG1-CD1 4.14Å; I365-L379 HydrophobicContact CG1-CG 3.9Å; I365-L379 HydrophobicContact CG2-CB 3.85Å; I365-L379 HydrophobicContact CG2-CD1 4.01Å; I365-L379 HydrophobicContact CG2-CG 4.28Å; I365-I391 HydrophobicContact CD1-CD1 3.96Å; I365-I391 HydrophobicContact CD1-CG1 4.41Å; I365-M422 HydrophobicContact CG2-CE 3.81Å; I365-M422 HydrophobicContact CG2-CG 3.95Å; I365-M422 HydrophobicContact CG2-SD 3.65Å; I365-L434 HydrophobicContact CB-CD1 4.35Å; I365-L434 HydrophobicContact CD1-CD1 4.41Å; I365-L434 HydrophobicContact CG2-CD1 3.54Å; I365-W459 HydrophobicContact CD1-CH2 3.84Å; I365-W459 HydrophobicContact CD1-CZ2 4.12Å
366	G	81.4	Confident	86.5	Confident	5 Å²	5	31.3 Å²	31.3	5%	0.052	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	89.5	-126	-172.1	0	0	0	0	0	110.4	I376 S424 L425	G366-I376 WeakPolarHBondContact CA-O 3.47Å; G366-S424 PolarHBondContact N-OG 2.93Å; G366-S424 PolarHBondContact O-OG 3.4Å; G366-L425 WeakPolarHBondContact O-CA 3.03Å
367	G	78.9	Confident	86.5	Confident	9 Å²	9	27.9 Å²	27.9	9%	0.093	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	119.7	-152.7	-167.9	0	0	0	0	0	110.5	I376 M426	G367-I376 PolarHBondContact N-O 2.84Å; G367-I376 PolarHBondContact O-N 3.08Å; G367-I376 VanDerWaalsContact O-N 3.11Å; G367-M426 VanDerWaalsContact O-SD 3.37Å
368	F	81.5	Confident	86.5	Confident	31 Å²	31	23.2 Å²	23.2	14%	0.136	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	138.6	-174.1	-64.4	-111.7	0	0	0	109.2	F315 G316 Y323 V325 I375 I396	F315-F368 WeakPolarHBondContact O-CD2 3.05Å; G316-F368 VanDerWaalsContact CA-CD2 3.42Å; G316-F368 VanDerWaalsContact N-CE2 3.32Å; Y323-F368 HydrophobicContact CD1-CE1 4.44Å; Y323-F368 HydrophobicContact CD2-CD1 4.29Å; Y323-F368 AromaticContact CD2-CE1 3.83Å; Y323-F368 HydrophobicContact CD2-CE1 3.83Å; Y323-F368 HydrophobicContact CG-CD1 4.47Å; Y323-F368 AromaticContact CG-CE1 3.58Å; Y323-F368 HydrophobicContact CG-CE1 3.58Å; Y323-F368 HydrophobicContact CG-CZ 4.12Å; V325-F368 HydrophobicContact CG2-CZ 4.16Å; F368-I375 HydrophobicContact CD1-CD1 4.27Å; F368-I375 HydrophobicContact CD1-CG1 3.8Å; F368-I375 HydrophobicContact CD1-CG2 4.37Å; F368-I375 HydrophobicContact CD2-CG2 3.95Å; F368-I375 HydrophobicContact CE1-CB 4.17Å; F368-I375 HydrophobicContact CE1-CD1 3.23Å; F368-I375 HydrophobicContact CE1-CG1 3.24Å; F368-I375 HydrophobicContact CE1-CG2 3.99Å; F368-I375 HydrophobicContact CE2-CD1 4.33Å; F368-I375 HydrophobicContact CE2-CG1 4.41Å; F368-I375 HydrophobicContact CE2-CG2 3.55Å; F368-I375 HydrophobicContact CG-CG2 4.35Å; F368-I375 HydrophobicContact CZ-CB 4.21Å; F368-I375 HydrophobicContact CZ-CD1 3.29Å; F368-I375 HydrophobicContact CZ-CG1 3.62Å; F368-I375 HydrophobicContact CZ-CG2 3.59Å; F368-I396 HydrophobicContact CE1-CD1 4.44Å
369	Y	81.5	Confident	86.4	Confident	33 Å²	33	23.6 Å²	23.6	13%	0.129	16%	0.155	C	C	.	.			trans	-87.6	133.3	165.1	-168.7	-108.7	0	0	0	108.7	T371 G372 M426 P429 P487	Y369-T371 WeakPolarHBondContact CD1-OG1 3.49Å; Y369-T371 WeakPolarHBondContact CE1-OG1 3.27Å; Y369-T371 PolarHBondContact O-N 2.99Å; Y369-T371 VanDerWaalsContact O-N 3.11Å; Y369-G372 PolarHBondContact O-N 2.97Å; Y369-M426 HydrophobicContact CD2-CB 4.23Å; Y369-M426 PolarHBondContact N-SD 3.48Å; Y369-P429 HydrophobicContact CD1-CB 4.27Å; Y369-P429 HydrophobicContact CD1-CG 3.66Å; Y369-P429 HydrophobicContact CE1-CG 3.51Å; Y369-P429 HydrophobicContact CG-CG 4.31Å; Y369-P487 HydrophobicContact CE2-CG 3.7Å; Y369-P487 VanDerWaalsContact OH-CD 3.26Å; Y369-P487 WeakPolarHBondContact OH-CD 3.04Å; Y369-P487 WeakPolarHBondContact OH-CG 3.23Å
370	A	71.7	Confident	86.4	Confident	40 Å²	40	20.1 Å²	20.1	33%	0.331	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.8	-172.8	0	0	0	0	0	113.4	N318	N318-A370 WeakPolarHBondContact CB-O 3.32Å; N318-A370 PolarHBondContact ND2-O 2.75Å; N318-A370 PolarHBondContact OD1-O 2.8Å
371	T	73.8	Confident	86.4	Confident	103 Å²	103	19.8 Å²	19.8	63%	0.632	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.4	12.1	174	65.5	0	0	0	0	113.1	Y369	Y369-T371 WeakPolarHBondContact CD1-OG1 3.49Å; Y369-T371 WeakPolarHBondContact CE1-OG1 3.27Å; Y369-T371 PolarHBondContact O-N 2.99Å; Y369-T371 VanDerWaalsContact O-N 3.11Å
372	G	75.6	Confident	86.3	Confident	10 Å²	10	20.6 Å²	20.6	10%	0.103	13%	0.134	C	C	.	.			trans	-80.9	152.4	-177	0	0	0	0	0	113.1	Y369	Y369-G372 PolarHBondContact O-N 2.97Å
373	S	86.1	Confident	86.1	Confident	67 Å²	67	22.6 Å²	22.6	47%	0.469	14%	0.144	S	C	.	.	S	Bend	trans	-99	10.1	172.3	57.4	0	0	0	0	113.2	I396 P397	S373-I396 VanDerWaalsContact O-CB 3.32Å; S373-I396 WeakPolarHBondContact O-CB 3.44Å; S373-I396 PolarHBondContact O-N 2.79Å; S373-P397 VanDerWaalsContact O-CD 3.31Å; S373-P397 WeakPolarHBondContact O-CD 3.46Å
374	H	89.7	Confident	86	Confident	33 Å²	33	27.1 Å²	27.1	15%	0.153	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	164.7	-174.7	66.5	-88	0	0	0	112.7	F394 P429	H374-F394 CarbonylContact C-O 3.56Å; H374-F394 WeakPolarHBondContact CA-O 3.21Å; H374-F394 VanDerWaalsContact CB-O 3.24Å; H374-F394 WeakPolarHBondContact CB-O 3.43Å; H374-P429 PolarHBondContact CE1-O 3.34Å; H374-P429 PolarHBondContact NE2-O 2.92Å
375	I	91.3	Very high	85.8	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	130.5	-179.4	-41.1	174.8	0	0	0	108	V325 F368 F393 F394 I396	V325-I375 HydrophobicContact CG2-CD1 3.84Å; V325-I375 HydrophobicContact CG2-CG2 4.39Å; F368-I375 HydrophobicContact CD1-CD1 4.27Å; F368-I375 HydrophobicContact CD1-CG1 3.8Å; F368-I375 HydrophobicContact CD1-CG2 4.37Å; F368-I375 HydrophobicContact CD2-CG2 3.95Å; F368-I375 HydrophobicContact CE1-CB 4.17Å; F368-I375 HydrophobicContact CE1-CD1 3.23Å; F368-I375 HydrophobicContact CE1-CG1 3.24Å; F368-I375 HydrophobicContact CE1-CG2 3.99Å; F368-I375 HydrophobicContact CE2-CD1 4.33Å; F368-I375 HydrophobicContact CE2-CG1 4.41Å; F368-I375 HydrophobicContact CE2-CG2 3.55Å; F368-I375 HydrophobicContact CG-CG2 4.35Å; F368-I375 HydrophobicContact CZ-CB 4.21Å; F368-I375 HydrophobicContact CZ-CD1 3.29Å; F368-I375 HydrophobicContact CZ-CG1 3.62Å; F368-I375 HydrophobicContact CZ-CG2 3.59Å; I375-F393 CarbonylContact O-C 3.53Å; I375-F393 WeakPolarHBondContact O-CA 3.19Å; I375-F394 HydrophobicContact CB-CB 4.01Å; I375-F394 HydrophobicContact CD1-CB 4.1Å; I375-F394 HydrophobicContact CD1-CD1 3.56Å; I375-F394 HydrophobicContact CD1-CE1 4.39Å; I375-F394 HydrophobicContact CD1-CG 4.2Å; I375-F394 HydrophobicContact CG1-CB 4.12Å; I375-F394 HydrophobicContact CG1-CD1 4.11Å; I375-F394 PolarHBondContact N-O 2.83Å; I375-F394 PolarHBondContact O-N 2.95Å; I375-I396 HydrophobicContact CD1-CD1 4.48Å; I375-I396 HydrophobicContact CD1-CG1 4.27Å; I375-I396 HydrophobicContact CG1-CD1 4.02Å; I375-I396 HydrophobicContact CG1-CG1 4.01Å
376	I	92.5	Very high	85.9	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	130.7	168	-56.5	-59.2	0	0	0	108.8	G366 G367 I391 F393 I404 M426 V432 V454	G366-I376 WeakPolarHBondContact CA-O 3.47Å; G367-I376 PolarHBondContact N-O 2.84Å; G367-I376 PolarHBondContact O-N 3.08Å; G367-I376 VanDerWaalsContact O-N 3.11Å; I376-I391 HydrophobicContact CG2-CG2 3.81Å; I376-F393 HydrophobicContact CD1-CB 3.8Å; I376-I404 HydrophobicContact CD1-CD1 3.91Å; I376-M426 HydrophobicContact CG1-CE 3.94Å; I376-M426 HydrophobicContact CG1-SD 4.14Å; I376-V432 HydrophobicContact CB-CG2 4.2Å; I376-V432 HydrophobicContact CG1-CG2 4.18Å; I376-V432 HydrophobicContact CG2-CG2 4.03Å; I376-V454 HydrophobicContact CD1-CB 4.48Å; I376-V454 HydrophobicContact CD1-CG1 3.76Å; I376-V454 HydrophobicContact CD1-CG2 3.79Å; I376-V454 HydrophobicContact CG1-CG2 3.96Å
377	Y	92.6	Very high	86.3	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	110.7	-176.9	-170.2	-113	0	0	0	110	A314 V325 G326 P358 R361 A364 F392 W401	A314-Y377 HydrophobicContact CB-CD2 3.93Å; A314-Y377 HydrophobicContact CB-CE2 3.96Å; V325-Y377 HydrophobicContact CB-CD2 4.37Å; V325-Y377 HydrophobicContact CB-CE2 4.28Å; V325-Y377 HydrophobicContact CG1-CD1 4.34Å; V325-Y377 HydrophobicContact CG1-CD2 3.82Å; V325-Y377 HydrophobicContact CG1-CE1 4.25Å; V325-Y377 HydrophobicContact CG1-CE2 3.72Å; V325-Y377 HydrophobicContact CG1-CG 4.12Å; G326-Y377 WeakPolarHBondContact CA-OH 3.22Å; P358-Y377 HydrophobicContact CB-CD1 4.04Å; P358-Y377 HydrophobicContact CB-CE1 4.21Å; P358-Y377 HydrophobicContact CG-CD1 4.1Å; P358-Y377 HydrophobicContact CG-CE1 4.22Å; R361-Y377 VanDerWaalsContact CD-CE1 3.43Å; R361-Y377 HydrophobicContact CG-CE1 3.6Å; R361-Y377 HydrophobicContact CG-CE2 4.05Å; R361-Y377 WeakPolarHBondContact CG-OH 3.17Å; R361-Y377 PolarHBondContact O-OH 3.35Å; A364-Y377 HydrophobicContact CB-CD2 3.47Å; A364-Y377 VanDerWaalsContact CB-CD2 3.47Å; A364-Y377 HydrophobicContact CB-CE2 3.3Å; A364-Y377 HydrophobicContact CB-CG 4.36Å; Y377-F392 PolarHBondContact N-O 3.07Å; Y377-F392 PolarHBondContact O-N 2.79Å; Y377-W401 HydrophobicContact CD1-CH2 4.13Å; Y377-W401 HydrophobicContact CD1-CZ3 4.4Å; Y377-W401 HydrophobicContact CG-CH2 4.18Å; Y377-W401 HydrophobicContact CG-CZ3 4.46Å
378	G	91.5	Very high	86.8	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	178.7	-176.2	0	0	0	0	0	114.6	A364 I365 D390	A364-G378 CarbonylContact C-O 3.55Å; A364-G378 WeakPolarHBondContact CA-O 3.33Å; I365-G378 VanDerWaalsContact CG1-O 3.28Å; I365-G378 WeakPolarHBondContact CG1-O 3.14Å; I365-G378 PolarHBondContact N-O 3.27Å; I365-G378 PolarHBondContact O-N 2.8Å; G378-D390 CarbonylContact C-O 3.49Å; G378-D390 WeakPolarHBondContact CA-O 3.03Å
379	L	91.1	Very high	87.1	Confident	10 Å²	10	38.3 Å²	38.3	5%	0.052	21%	0.211	C	C	.	.			trans	47.1	-148.6	-176.6	-53.7	-176	0	0	0	112	R361 I365 D390 L434 W459	R361-L379 VanDerWaalsContact CD-O 3.29Å; R361-L379 WeakPolarHBondContact CD-O 3.2Å; R361-L379 PolarHBondContact NH1-O 3.18Å; I365-L379 HydrophobicContact CD1-CB 4.48Å; I365-L379 HydrophobicContact CD1-CD1 3.74Å; I365-L379 HydrophobicContact CD1-CG 3.85Å; I365-L379 HydrophobicContact CG1-CB 4Å; I365-L379 HydrophobicContact CG1-CD1 4.14Å; I365-L379 HydrophobicContact CG1-CG 3.9Å; I365-L379 HydrophobicContact CG2-CB 3.85Å; I365-L379 HydrophobicContact CG2-CD1 4.01Å; I365-L379 HydrophobicContact CG2-CG 4.28Å; L379-D390 PolarHBondContact N-O 2.87Å; L379-L434 HydrophobicContact CD1-CD1 3.9Å; L379-W459 HydrophobicContact CD1-CH2 4.32Å; L379-W459 HydrophobicContact CD1-CZ2 4.23Å
380	G	91.7	Very high	87.5	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.212	C	C	.	.			trans	80.8	-161.5	-177.6	0	0	0	0	0	113.2	L362 L388	L362-G380 WeakPolarHBondContact O-CA 3.37Å; G380-L388 PolarHBondContact O-N 2.91Å
381	T	92.4	Very high	88.5	Confident	3 Å²	3	36.1 Å²	36.1	2%	0.018	20%	0.196	C	C	.	.	B	Isolated β-bridge	trans	-135.6	151.7	-176.2	44.9	0	0	0	0	113.3	R361 L362 Q386 F387 R420	R361-T381 CarbonylContact C-O 3.53Å; R361-T381 VanDerWaalsContact CA-O 3.26Å; R361-T381 WeakPolarHBondContact CA-O 3.32Å; L362-T381 PolarHBondContact N-O 3.33Å; L362-T381 PolarHBondContact O-N 2.84Å; L362-T381 VanDerWaalsContact O-N 3.08Å; T381-Q386 CarbonylContact C-O 3.59Å; T381-Q386 WeakPolarHBondContact CA-O 3.39Å; T381-F387 HydrophobicContact CG2-CD1 3.95Å; T381-F387 HydrophobicContact CG2-CE1 4.22Å; T381-F387 HydrophobicContact CG2-CG 4.19Å; T381-R420 HydrophobicContact CG2-CB 3.7Å; T381-R420 HydrophobicContact CG2-CG 4.46Å
382	T	92.3	Very high	89.4	Confident	18 Å²	18	31.5 Å²	31.5	11%	0.11	17%	0.168	C	C	.	.			trans	-78.6	170.6	166.3	68.2	0	0	0	0	111.1	T359 N384 D385 Q386 L388	T359-T382 HydrophobicContact CG2-CG2 4.19Å; T382-N384 PolarHBondContact O-N 3.16Å; T382-N384 VanDerWaalsContact O-N 3.13Å; T382-N384 PolarHBondContact OG1-N 3.22Å; T382-D385 PolarHBondContact O-N 3.32Å; T382-Q386 HydrophobicContact CG2-CB 4.4Å; T382-Q386 PolarHBondContact N-O 3.31Å; T382-Q386 WeakPolarHBondContact OG1-CB 3.12Å; T382-Q386 PolarHBondContact OG1-N 2.78Å; T382-L388 HydrophobicContact CG2-CD1 4.03Å; T382-L388 HydrophobicContact CG2-CD2 3.87Å; T382-L388 HydrophobicContact CG2-CG 4.09Å
383	I	88.2	Confident	90.2	Very high	72 Å²	72	33.9 Å²	33.9	37%	0.369	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-28.6	174.5	-168.4	62	0	0	0	112.8	D329 C333 D385	D329-I383 WeakPolarHBondContact O-CD1 2.96Å; C333-I383 PolarHBondContact SG-N 3.05Å; I383-D385 PolarHBondContact O-N 3Å
384	N	87.3	Confident	90.5	Very high	121 Å²	121	30.7 Å²	30.7	65%	0.647	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	17.5	178.1	-65.6	-35.7	0	0	0	113.4	T382 Q386	T382-N384 PolarHBondContact O-N 3.16Å; T382-N384 VanDerWaalsContact O-N 3.13Å; T382-N384 PolarHBondContact OG1-N 3.22Å; N384-Q386 HydrophobicContact CB-CG 4.31Å; N384-Q386 PolarHBondContact O-N 2.83Å; N384-Q386 VanDerWaalsContact O-N 3.15Å
385	D	83.9	Confident	90.6	Very high	67 Å²	67	30.5 Å²	30.5	36%	0.358	15%	0.153	S	C	.	.			trans	56.3	31.8	-177.9	-92.3	-20.8	0	0	0	113.4	T382 I383 R420 K662	T382-D385 PolarHBondContact O-N 3.32Å; I383-D385 PolarHBondContact O-N 3Å; D385-R420 IonicContact OD1-NH1 3.54Å; D385-R420 PolarHBondContact OD1-NH1 3.35Å; D385-R420 IonicContact OD2-NH1 3.3Å; D385-R420 PolarHBondContact OD2-NH1 3.44Å; D385-K662 PolarHBondContact O-NZ 2.84Å; D385-K662 VanDerWaalsContact O-NZ 3.08Å
386	Q	89.2	Confident	90.6	Very high	121 Å²	121	31.7 Å²	31.7	57%	0.565	16%	0.159	S	C	*	.	P	Polyproline II helix	trans	-88	124	170.5	-58.7	-175.9	-14.3	0	0	109.3	T381 T382 N384	T381-Q386 CarbonylContact C-O 3.59Å; T381-Q386 WeakPolarHBondContact CA-O 3.39Å; T382-Q386 HydrophobicContact CG2-CB 4.4Å; T382-Q386 PolarHBondContact N-O 3.31Å; T382-Q386 WeakPolarHBondContact OG1-CB 3.12Å; T382-Q386 PolarHBondContact OG1-N 2.78Å; N384-Q386 HydrophobicContact CB-CG 4.31Å; N384-Q386 PolarHBondContact O-N 2.83Å; N384-Q386 VanDerWaalsContact O-N 3.15Å
387	F	88.6	Confident	90.5	Very high	35 Å²	35	36.4 Å²	36.4	15%	0.154	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-73.3	128.2	177.1	-67.5	-94.2	0	0	0	110.5	T381 P418 R420 K440	T381-F387 HydrophobicContact CG2-CD1 3.95Å; T381-F387 HydrophobicContact CG2-CE1 4.22Å; T381-F387 HydrophobicContact CG2-CG 4.19Å; F387-P418 HydrophobicContact CB-CB 3.87Å; F387-P418 HydrophobicContact CD1-CB 4.48Å; F387-R420 HydrophobicContact CE1-CB 4.19Å; F387-R420 HydrophobicContact CE1-CG 3.96Å; F387-R420 HydrophobicContact CZ-CG 4.31Å; F387-K440 HydrophobicContact CB-CB 4.32Å; F387-K440 HydrophobicContact CB-CD 3.86Å; F387-K440 HydrophobicContact CB-CG 4.23Å; F387-K440 HydrophobicContact CD1-CB 3.95Å; F387-K440 HydrophobicContact CD2-CB 3.95Å; F387-K440 HydrophobicContact CD2-CD 4.2Å; F387-K440 HydrophobicContact CD2-CG 3.7Å; F387-K440 HydrophobicContact CE1-CB 4.21Å; F387-K440 HydrophobicContact CE2-CB 4.22Å; F387-K440 HydrophobicContact CE2-CG 4.18Å; F387-K440 HydrophobicContact CG-CB 3.8Å; F387-K440 HydrophobicContact CG-CD 4.12Å; F387-K440 HydrophobicContact CG-CG 3.91Å; F387-K440 HydrophobicContact CZ-CB 4.34Å
388	L	91	Very high	90.5	Very high	22 Å²	22	41.3 Å²	41.3	12%	0.115	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-95.8	151.3	176.3	-60.1	173.6	0	0	0	110.4	R361 G380 T382	R361-L388 HydrophobicContact CB-CD1 3.52Å; R361-L388 HydrophobicContact CG-CD1 4.4Å; R361-L388 VanDerWaalsContact CZ-CD1 3.5Å; G380-L388 PolarHBondContact O-N 2.91Å; T382-L388 HydrophobicContact CG2-CD1 4.03Å; T382-L388 HydrophobicContact CG2-CD2 3.87Å; T382-L388 HydrophobicContact CG2-CG 4.09Å
389	E	87.4	Confident	90.6	Very high	49 Å²	49	44.2 Å²	44.2	23%	0.229	23%	0.227	C	C	.	.			trans	-126.1	-11.2	-170.2	-47.9	-174.4	167.6	0	0	112	F409 P418 K440	E389-F409 HydrophobicContact CB-CB 4.49Å; E389-F409 VanDerWaalsContact CD-CB 3.43Å; E389-F409 HydrophobicContact CG-CB 4.32Å; E389-F409 WeakPolarHBondContact OE2-CB 3.41Å; E389-F409 PolarHBondContact OE2-N 2.93Å; E389-P418 HydrophobicContact CG-CB 4.14Å; E389-P418 HydrophobicContact CG-CG 3.64Å; E389-K440 IonicContact OE1-NZ 3.39Å; E389-K440 PolarHBondContact OE1-NZ 2.83Å
390	D	90.6	Very high	90.8	Very high	28 Å²	28	49.4 Å²	49.4	15%	0.15	25%	0.246	C	C	.	.			trans	-83.9	152.9	-177.6	52.9	2.6	0	0	0	112.3	R361 G378 L379 F392	R361-D390 IonicContact CZ-OD1 3.38Å; R361-D390 VanDerWaalsContact CZ-OD1 3.23Å; R361-D390 PolarHBondContact NH1-O 2.87Å; R361-D390 IonicContact NH1-OD1 2.75Å; R361-D390 PolarHBondContact NH1-OD1 3.45Å; R361-D390 IonicContact NH2-OD1 3.98Å; R361-D390 PolarHBondContact NH2-OD1 2.81Å; R361-D390 IonicContact NH2-OD2 3.67Å; R361-D390 PolarHBondContact NH2-OD2 2.92Å; G378-D390 CarbonylContact C-O 3.49Å; G378-D390 WeakPolarHBondContact CA-O 3.03Å; L379-D390 PolarHBondContact N-O 2.87Å; D390-F392 HydrophobicContact CB-CE2 3.83Å; D390-F392 HydrophobicContact CB-CZ 4.28Å; D390-F392 VanDerWaalsContact CG-CE2 3.42Å; D390-F392 WeakPolarHBondContact OD2-CE2 3.43Å; D390-F392 WeakPolarHBondContact OD2-CZ 3.49Å
391	I	92.2	Very high	90.9	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	132.9	174.6	-52.7	180	0	0	0	108.2	I365 I376 I404 I405 F452 W459	I365-I391 HydrophobicContact CD1-CD1 3.96Å; I365-I391 HydrophobicContact CD1-CG1 4.41Å; I376-I391 HydrophobicContact CG2-CG2 3.81Å; I391-I404 HydrophobicContact CB-CB 4.48Å; I391-I404 HydrophobicContact CG2-CB 4.49Å; I391-I404 HydrophobicContact CG2-CD1 4.11Å; I391-I404 PolarHBondContact O-N 3.23Å; I391-I405 HydrophobicContact CB-CB 4.46Å; I391-I405 HydrophobicContact CB-CD1 4.46Å; I391-I405 HydrophobicContact CB-CG1 4.28Å; I391-I405 HydrophobicContact CD1-CD1 3.44Å; I391-I405 VanDerWaalsContact CD1-CD1 3.44Å; I391-I405 HydrophobicContact CD1-CG1 4.15Å; I391-I405 HydrophobicContact CG1-CD1 3.98Å; I391-I405 HydrophobicContact CG1-CG1 4.32Å; I391-I405 PolarHBondContact O-N 2.88Å; I391-F452 HydrophobicContact CD1-CD1 4.26Å; I391-F452 HydrophobicContact CD1-CE1 3.95Å; I391-F452 HydrophobicContact CD1-CE2 4.33Å; I391-F452 HydrophobicContact CD1-CZ 3.99Å; I391-F452 HydrophobicContact CG2-CE1 4.39Å; I391-W459 HydrophobicContact CD1-CZ2 3.84Å
392	F	92.6	Very high	90.9	Very high	6 Å²	6	52.6 Å²	52.6	3%	0.026	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	157.1	177.6	-60.1	-95.3	0	0	0	110.5	L356 P358 Y377 D390 W401 Y402 K403	L356-F392 HydrophobicContact CD1-CE1 4.16Å; L356-F392 HydrophobicContact CD2-CD1 4.21Å; L356-F392 HydrophobicContact CD2-CE1 4.24Å; L356-F392 HydrophobicContact CG-CE1 4.29Å; P358-F392 HydrophobicContact CB-CD1 4.25Å; P358-F392 HydrophobicContact CB-CD2 3.61Å; P358-F392 HydrophobicContact CB-CE1 4.32Å; P358-F392 HydrophobicContact CB-CE2 3.68Å; P358-F392 HydrophobicContact CB-CG 3.91Å; P358-F392 HydrophobicContact CB-CZ 4.06Å; Y377-F392 PolarHBondContact N-O 3.07Å; Y377-F392 PolarHBondContact O-N 2.79Å; D390-F392 HydrophobicContact CB-CE2 3.83Å; D390-F392 HydrophobicContact CB-CZ 4.28Å; D390-F392 VanDerWaalsContact CG-CE2 3.42Å; D390-F392 WeakPolarHBondContact OD2-CE2 3.43Å; D390-F392 WeakPolarHBondContact OD2-CZ 3.49Å; F392-W401 HydrophobicContact CB-CE3 3.85Å; F392-W401 HydrophobicContact CB-CZ3 3.99Å; F392-Y402 CarbonylContact C-O 3.5Å; F392-Y402 WeakPolarHBondContact CA-O 3.3Å; F392-Y402 WeakPolarHBondContact CB-O 3.5Å; F392-K403 HydrophobicContact CD1-CB 3.95Å; F392-K403 HydrophobicContact CD1-CG 4.09Å; F392-K403 HydrophobicContact CE1-CB 3.93Å; F392-K403 HydrophobicContact CE1-CD 3.99Å; F392-K403 HydrophobicContact CE1-CG 3.81Å; F392-K403 HydrophobicContact CZ-CD 4.3Å; F392-K403 HydrophobicContact CZ-CG 4.33Å
393	F	91.9	Very high	90.8	Very high	59 Å²	59	55.8 Å²	55.8	26%	0.259	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.1	160.5	80	-92.5	0	0	0	111.1	I375 I376 D395 Y402 I404	I375-F393 CarbonylContact O-C 3.53Å; I375-F393 WeakPolarHBondContact O-CA 3.19Å; I376-F393 HydrophobicContact CD1-CB 3.8Å; F393-D395 HydrophobicContact CE2-CB 4.31Å; F393-Y402 VanDerWaalsContact CD1-CB 3.45Å; F393-Y402 HydrophobicContact CD1-CG 4.32Å; F393-Y402 AromaticContact CD2-CD2 3.89Å; F393-Y402 HydrophobicContact CD2-CD2 3.89Å; F393-Y402 HydrophobicContact CD2-CG 4.45Å; F393-Y402 HydrophobicContact CE1-CD1 4.41Å; F393-Y402 AromaticContact CE1-CD2 3.97Å; F393-Y402 HydrophobicContact CE1-CD2 3.97Å; F393-Y402 AromaticContact CE1-CG 3.61Å; F393-Y402 HydrophobicContact CE1-CG 3.61Å; F393-Y402 AromaticContact CE2-CD2 3.18Å; F393-Y402 HydrophobicContact CE2-CD2 3.18Å; F393-Y402 AromaticContact CE2-CE2 3.8Å; F393-Y402 HydrophobicContact CE2-CE2 3.8Å; F393-Y402 AromaticContact CE2-CG 3.75Å; F393-Y402 HydrophobicContact CE2-CG 3.75Å; F393-Y402 HydrophobicContact CZ-CD1 4.02Å; F393-Y402 AromaticContact CZ-CD2 3.23Å; F393-Y402 HydrophobicContact CZ-CD2 3.23Å; F393-Y402 AromaticContact CZ-CE2 3.95Å; F393-Y402 HydrophobicContact CZ-CE2 3.95Å; F393-Y402 AromaticContact CZ-CG 3.25Å; F393-Y402 HydrophobicContact CZ-CG 3.25Å; F393-Y402 PolarHBondContact N-O 2.93Å; F393-Y402 PolarHBondContact O-N 3.37Å; F393-I404 HydrophobicContact CB-CD1 3.99Å; F393-I404 HydrophobicContact CB-CG1 4.36Å; F393-I404 HydrophobicContact CD1-CD1 4.18Å; F393-I404 HydrophobicContact CD1-CG1 3.75Å
394	F	92.4	Very high	90.7	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	120.5	170.5	-174	-108.4	0	0	0	109.3	V337 P352 H374 I375 I396 Q399 W401	V337-F394 HydrophobicContact CG1-CE1 4.18Å; V337-F394 HydrophobicContact CG1-CZ 4.39Å; V337-F394 HydrophobicContact CG2-CE2 4.44Å; V337-F394 HydrophobicContact CG2-CZ 4.47Å; P352-F394 HydrophobicContact CB-CE2 3.94Å; P352-F394 HydrophobicContact CG-CE2 3.87Å; P352-F394 HydrophobicContact CG-CZ 4.43Å; H374-F394 CarbonylContact C-O 3.56Å; H374-F394 WeakPolarHBondContact CA-O 3.21Å; H374-F394 VanDerWaalsContact CB-O 3.24Å; H374-F394 WeakPolarHBondContact CB-O 3.43Å; I375-F394 HydrophobicContact CB-CB 4.01Å; I375-F394 HydrophobicContact CD1-CB 4.1Å; I375-F394 HydrophobicContact CD1-CD1 3.56Å; I375-F394 HydrophobicContact CD1-CE1 4.39Å; I375-F394 HydrophobicContact CD1-CG 4.2Å; I375-F394 HydrophobicContact CG1-CB 4.12Å; I375-F394 HydrophobicContact CG1-CD1 4.11Å; I375-F394 PolarHBondContact N-O 2.83Å; I375-F394 PolarHBondContact O-N 2.95Å; F394-I396 HydrophobicContact CD1-CG1 4.03Å; F394-I396 HydrophobicContact CE1-CG1 4.34Å; F394-Q399 VanDerWaalsContact CE2-C 3.49Å; F394-Q399 HydrophobicContact CZ-CB 4.02Å; F394-Q399 HydrophobicContact CZ-CG 4.45Å; F394-W401 HydrophobicContact CB-CD2 4.09Å; F394-W401 HydrophobicContact CB-CE3 3.69Å; F394-W401 HydrophobicContact CB-CH2 3.77Å; F394-W401 HydrophobicContact CB-CZ2 4.16Å; F394-W401 HydrophobicContact CB-CZ3 3.54Å; F394-W401 AromaticContact CD2-CD2 3.61Å; F394-W401 HydrophobicContact CD2-CD2 3.61Å; F394-W401 AromaticContact CD2-CE2 3.53Å; F394-W401 HydrophobicContact CD2-CE3 4.12Å; F394-W401 AromaticContact CD2-CG 3.91Å; F394-W401 HydrophobicContact CD2-CG 3.91Å; F394-W401 HydrophobicContact CD2-CH2 4.44Å; F394-W401 AromaticContact CD2-CZ2 3.98Å; F394-W401 HydrophobicContact CD2-CZ2 3.98Å; F394-W401 AromaticContact CD2-NE1 3.77Å; F394-W401 HydrophobicContact CG-CD2 4.3Å; F394-W401 HydrophobicContact CG-CE3 4.39Å; F394-W401 HydrophobicContact CG-CH2 4.36Å; F394-W401 HydrophobicContact CG-CZ2 4.26Å; F394-W401 HydrophobicContact CG-CZ3 4.44Å
395	D	91.7	Very high	90.3	Very high	29 Å²	29	48.6 Å²	48.6	16%	0.155	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	116.2	170.4	-174.9	-47.3	0	0	0	108.8	F393 P397 M398 Q399 R400 Y402	F393-D395 HydrophobicContact CE2-CB 4.31Å; D395-P397 WeakPolarHBondContact OD1-CD 3.31Å; D395-M398 HydrophobicContact CB-CB 4.07Å; D395-M398 WeakPolarHBondContact OD1-CB 3.28Å; D395-M398 WeakPolarHBondContact OD1-CG 3.22Å; D395-M398 PolarHBondContact OD1-N 2.9Å; D395-Q399 WeakPolarHBondContact O-CA 3.48Å; D395-Q399 PolarHBondContact O-N 2.84Å; D395-R400 PolarHBondContact N-O 2.87Å; D395-R400 PolarHBondContact O-N 3.13Å; D395-R400 VanDerWaalsContact O-N 3.14Å; D395-Y402 HydrophobicContact CB-CD2 4.42Å; D395-Y402 HydrophobicContact CB-CE2 3.92Å
396	I	90.7	Very high	89.5	Confident	26 Å²	26	53 Å²	53	13%	0.133	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-51.5	-175.6	-62.8	169.4	0	0	0	111.2	Y323 F368 S373 I375 F394 M398 Q399	Y323-I396 HydrophobicContact CE1-CG2 4.03Å; Y323-I396 HydrophobicContact CE2-CD1 4.28Å; Y323-I396 WeakPolarHBondContact OH-CG2 3.48Å; F368-I396 HydrophobicContact CE1-CD1 4.44Å; S373-I396 VanDerWaalsContact O-CB 3.32Å; S373-I396 WeakPolarHBondContact O-CB 3.44Å; S373-I396 PolarHBondContact O-N 2.79Å; I375-I396 HydrophobicContact CD1-CD1 4.48Å; I375-I396 HydrophobicContact CD1-CG1 4.27Å; I375-I396 HydrophobicContact CG1-CD1 4.02Å; I375-I396 HydrophobicContact CG1-CG1 4.01Å; F394-I396 HydrophobicContact CD1-CG1 4.03Å; F394-I396 HydrophobicContact CE1-CG1 4.34Å; I396-M398 VanDerWaalsContact C-N 3.34Å; I396-M398 PolarHBondContact O-N 3.18Å; I396-Q399 VanDerWaalsContact O-CG 3.25Å; I396-Q399 WeakPolarHBondContact O-CG 3.22Å; I396-Q399 PolarHBondContact O-N 3.42Å; I396-Q399 VanDerWaalsContact O-N 3.15Å
397	P	91.5	Very high	88.3	Confident	98 Å²	98	57.8 Å²	57.8	64%	0.636	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-43.9	175.3	-27.1	32.8	0	0	0	114	S373 D395 Q399	S373-P397 VanDerWaalsContact O-CD 3.31Å; S373-P397 WeakPolarHBondContact O-CD 3.46Å; D395-P397 WeakPolarHBondContact OD1-CD 3.31Å; P397-Q399 VanDerWaalsContact C-N 3.31Å
398	M	92.6	Very high	87	Confident	103 Å²	103	63.3 Å²	63.3	51%	0.507	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-16.6	179.4	-61.2	-167.3	-172.7	0	0	112.8	D395 I396 R400	D395-M398 HydrophobicContact CB-CB 4.07Å; D395-M398 WeakPolarHBondContact OD1-CB 3.28Å; D395-M398 WeakPolarHBondContact OD1-CG 3.22Å; D395-M398 PolarHBondContact OD1-N 2.9Å; I396-M398 VanDerWaalsContact C-N 3.34Å; I396-M398 PolarHBondContact O-N 3.18Å; M398-R400 VanDerWaalsContact C-N 3.32Å; M398-R400 HydrophobicContact CB-CB 4.24Å; M398-R400 PolarHBondContact O-N 3.34Å
399	Q	92.9	Very high	85.5	Confident	61 Å²	61	64.8 Å²	64.8	29%	0.285	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.1	51.2	-169.8	-62.7	-176.4	-20.2	0	0	111.7	P352 K353 F394 D395 I396 P397	P352-Q399 CarbonylContact C-O 3.54Å; P352-Q399 VanDerWaalsContact CA-O 3.26Å; P352-Q399 WeakPolarHBondContact CA-O 3.41Å; K353-Q399 PolarHBondContact N-O 3.18Å; F394-Q399 VanDerWaalsContact CE2-C 3.49Å; F394-Q399 HydrophobicContact CZ-CB 4.02Å; F394-Q399 HydrophobicContact CZ-CG 4.45Å; D395-Q399 WeakPolarHBondContact O-CA 3.48Å; D395-Q399 PolarHBondContact O-N 2.84Å; I396-Q399 VanDerWaalsContact O-CG 3.25Å; I396-Q399 WeakPolarHBondContact O-CG 3.22Å; I396-Q399 PolarHBondContact O-N 3.42Å; I396-Q399 VanDerWaalsContact O-N 3.15Å; P397-Q399 VanDerWaalsContact C-N 3.31Å
400	R	94.8	Very high	84.4	Confident	120 Å²	120	67.5 Å²	67.5	45%	0.453	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	139.2	-173.8	-177.2	167.4	-174.8	-177.8	4.9	112	D395 M398 Y402	D395-R400 PolarHBondContact N-O 2.87Å; D395-R400 PolarHBondContact O-N 3.13Å; D395-R400 VanDerWaalsContact O-N 3.14Å; M398-R400 VanDerWaalsContact C-N 3.32Å; M398-R400 HydrophobicContact CB-CB 4.24Å; M398-R400 PolarHBondContact O-N 3.34Å; R400-Y402 HydrophobicContact CB-CE2 3.98Å; R400-Y402 HydrophobicContact CG-CD2 4.43Å; R400-Y402 HydrophobicContact CG-CE2 3.9Å
401	W	94.3	Very high	83.3	Confident	3 Å²	3	69.4 Å²	69.4	1%	0.011	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	144.6	172.4	-71.7	109.7	0	0	0	112	V325 V337 L356 P358 Y377 F392 F394	V325-W401 HydrophobicContact CG1-CH2 3.84Å; V325-W401 HydrophobicContact CG1-CZ2 3.99Å; V337-W401 HydrophobicContact CG2-CZ2 3.61Å; L356-W401 HydrophobicContact CB-CB 4.49Å; L356-W401 HydrophobicContact CD2-CB 4.29Å; L356-W401 HydrophobicContact CG-CB 4.38Å; P358-W401 HydrophobicContact CG-CD2 3.9Å; P358-W401 HydrophobicContact CG-CE3 4.11Å; P358-W401 HydrophobicContact CG-CG 4.49Å; P358-W401 HydrophobicContact CG-CH2 4.05Å; P358-W401 HydrophobicContact CG-CZ2 3.82Å; P358-W401 HydrophobicContact CG-CZ3 4.17Å; Y377-W401 HydrophobicContact CD1-CH2 4.13Å; Y377-W401 HydrophobicContact CD1-CZ3 4.4Å; Y377-W401 HydrophobicContact CG-CH2 4.18Å; Y377-W401 HydrophobicContact CG-CZ3 4.46Å; F392-W401 HydrophobicContact CB-CE3 3.85Å; F392-W401 HydrophobicContact CB-CZ3 3.99Å; F394-W401 HydrophobicContact CB-CD2 4.09Å; F394-W401 HydrophobicContact CB-CE3 3.69Å; F394-W401 HydrophobicContact CB-CH2 3.77Å; F394-W401 HydrophobicContact CB-CZ2 4.16Å; F394-W401 HydrophobicContact CB-CZ3 3.54Å; F394-W401 AromaticContact CD2-CD2 3.61Å; F394-W401 HydrophobicContact CD2-CD2 3.61Å; F394-W401 AromaticContact CD2-CE2 3.53Å; F394-W401 HydrophobicContact CD2-CE3 4.12Å; F394-W401 AromaticContact CD2-CG 3.91Å; F394-W401 HydrophobicContact CD2-CG 3.91Å; F394-W401 HydrophobicContact CD2-CH2 4.44Å; F394-W401 AromaticContact CD2-CZ2 3.98Å; F394-W401 HydrophobicContact CD2-CZ2 3.98Å; F394-W401 AromaticContact CD2-NE1 3.77Å; F394-W401 HydrophobicContact CG-CD2 4.3Å; F394-W401 HydrophobicContact CG-CE3 4.39Å; F394-W401 HydrophobicContact CG-CH2 4.36Å; F394-W401 HydrophobicContact CG-CZ2 4.26Å; F394-W401 HydrophobicContact CG-CZ3 4.44Å
402	Y	92.1	Very high	82.5	Confident	67 Å²	67	70.6 Å²	70.6	26%	0.263	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	147	172.8	-62.9	-89.8	0	0	0	109.4	F392 F393 D395 R400	F392-Y402 CarbonylContact C-O 3.5Å; F392-Y402 WeakPolarHBondContact CA-O 3.3Å; F392-Y402 WeakPolarHBondContact CB-O 3.5Å; F393-Y402 VanDerWaalsContact CD1-CB 3.45Å; F393-Y402 HydrophobicContact CD1-CG 4.32Å; F393-Y402 AromaticContact CD2-CD2 3.89Å; F393-Y402 HydrophobicContact CD2-CD2 3.89Å; F393-Y402 HydrophobicContact CD2-CG 4.45Å; F393-Y402 HydrophobicContact CE1-CD1 4.41Å; F393-Y402 AromaticContact CE1-CD2 3.97Å; F393-Y402 HydrophobicContact CE1-CD2 3.97Å; F393-Y402 AromaticContact CE1-CG 3.61Å; F393-Y402 HydrophobicContact CE1-CG 3.61Å; F393-Y402 AromaticContact CE2-CD2 3.18Å; F393-Y402 HydrophobicContact CE2-CD2 3.18Å; F393-Y402 AromaticContact CE2-CE2 3.8Å; F393-Y402 HydrophobicContact CE2-CE2 3.8Å; F393-Y402 AromaticContact CE2-CG 3.75Å; F393-Y402 HydrophobicContact CE2-CG 3.75Å; F393-Y402 HydrophobicContact CZ-CD1 4.02Å; F393-Y402 AromaticContact CZ-CD2 3.23Å; F393-Y402 HydrophobicContact CZ-CD2 3.23Å; F393-Y402 AromaticContact CZ-CE2 3.95Å; F393-Y402 HydrophobicContact CZ-CE2 3.95Å; F393-Y402 AromaticContact CZ-CG 3.25Å; F393-Y402 HydrophobicContact CZ-CG 3.25Å; F393-Y402 PolarHBondContact N-O 2.93Å; F393-Y402 PolarHBondContact O-N 3.37Å; D395-Y402 HydrophobicContact CB-CD2 4.42Å; D395-Y402 HydrophobicContact CB-CE2 3.92Å; R400-Y402 HydrophobicContact CB-CE2 3.98Å; R400-Y402 HydrophobicContact CG-CD2 4.43Å; R400-Y402 HydrophobicContact CG-CE2 3.9Å
403	K	90.5	Very high	81.6	Confident	84 Å²	84	73.1 Å²	73.1	37%	0.365	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	128	179.8	-167.4	171.6	179.7	-174.3	0	109.7	L356 F392 I405 E406	L356-K403 HydrophobicContact CD2-CB 4.11Å; F392-K403 HydrophobicContact CD1-CB 3.95Å; F392-K403 HydrophobicContact CD1-CG 4.09Å; F392-K403 HydrophobicContact CE1-CB 3.93Å; F392-K403 HydrophobicContact CE1-CD 3.99Å; F392-K403 HydrophobicContact CE1-CG 3.81Å; F392-K403 HydrophobicContact CZ-CD 4.3Å; F392-K403 HydrophobicContact CZ-CG 4.33Å; K403-I405 WeakPolarHBondContact CE-O 3.12Å; K403-E406 HydrophobicContact CD-CG 4.02Å; K403-E406 HydrophobicContact CG-CG 4.29Å
404	I	86.1	Confident	81.1	Confident	13 Å²	13	77.3 Å²	77.3	7%	0.067	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-53.8	179.6	-62.1	178.1	0	0	0	110.2	I376 I391 F393 F452 V454 H457	I376-I404 HydrophobicContact CD1-CD1 3.91Å; I391-I404 HydrophobicContact CB-CB 4.48Å; I391-I404 HydrophobicContact CG2-CB 4.49Å; I391-I404 HydrophobicContact CG2-CD1 4.11Å; I391-I404 PolarHBondContact O-N 3.23Å; F393-I404 HydrophobicContact CB-CD1 3.99Å; F393-I404 HydrophobicContact CB-CG1 4.36Å; F393-I404 HydrophobicContact CD1-CD1 4.18Å; F393-I404 HydrophobicContact CD1-CG1 3.75Å; I404-F452 HydrophobicContact CG2-CE1 4.28Å; I404-F452 HydrophobicContact CG2-CZ 3.88Å; I404-V454 HydrophobicContact CD1-CG1 3.86Å; I404-H457 HydrophobicContact CG2-CB 4.49Å; I404-H457 PolarHBondContact O-CE1 3.26Å; I404-H457 VanDerWaalsContact O-CE1 3.27Å; I404-H457 PolarHBondContact O-ND1 3.22Å; I404-H457 VanDerWaalsContact O-ND1 3.11Å
405	I	80.3	Confident	80.8	Confident	30 Å²	30	79.3 Å²	79.3	15%	0.154	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	115.8	-178.1	-60.5	-171.3	0	0	0	109.3	I391 K403 F452	I391-I405 HydrophobicContact CB-CB 4.46Å; I391-I405 HydrophobicContact CB-CD1 4.46Å; I391-I405 HydrophobicContact CB-CG1 4.28Å; I391-I405 HydrophobicContact CD1-CD1 3.44Å; I391-I405 VanDerWaalsContact CD1-CD1 3.44Å; I391-I405 HydrophobicContact CD1-CG1 4.15Å; I391-I405 HydrophobicContact CG1-CD1 3.98Å; I391-I405 HydrophobicContact CG1-CG1 4.32Å; I391-I405 PolarHBondContact O-N 2.88Å; K403-I405 WeakPolarHBondContact CE-O 3.12Å; I405-F452 HydrophobicContact CD1-CE2 3.82Å; I405-F452 HydrophobicContact CD1-CZ 3.91Å; I405-F452 HydrophobicContact CG1-CE2 4.48Å; I405-F452 HydrophobicContact CG1-CZ 4.17Å
406	E	66.9	Low	80.6	Confident	158 Å²	158	78.3 Å²	78.3	74%	0.738	38%	0.376	S	S	*	.			trans	-98.5	-18.3	172.8	-69.8	-172.8	165.9	0	0	114	K403	K403-E406 HydrophobicContact CD-CG 4.02Å; K403-E406 HydrophobicContact CG-CG 4.29Å
407	R	62.8	Low	80.4	Confident	222 Å²	222	77.8 Å²	77.8	84%	0.838	37%	0.373	S	S	*	.	S	Bend	trans	-77.5	138.2	-170.6	-66.2	-175.7	-177.6	171.2	2.1	111.7
408	L	60.9	Low	80.3	Confident	152 Å²	152	73.2 Å²	73.2	80%	0.796	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-57.9	137.2	165.8	-79.7	137.4	0	0	0	109.9	V410	L408-V410 PolarHBondContact O-N 2.81Å
409	F	61.2	Low	80.2	Confident	52 Å²	52	68.3 Å²	68.3	23%	0.228	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-59.7	127.3	174.3	178.8	-97.9	0	0	0	110.3	E389 Y411 P416 H417 P418	E389-F409 HydrophobicContact CB-CB 4.49Å; E389-F409 VanDerWaalsContact CD-CB 3.43Å; E389-F409 HydrophobicContact CG-CB 4.32Å; E389-F409 WeakPolarHBondContact OE2-CB 3.41Å; E389-F409 PolarHBondContact OE2-N 2.93Å; F409-Y411 HydrophobicContact CE1-CD1 4.45Å; F409-P416 WeakPolarHBondContact CE2-O 3.38Å; F409-H417 HydrophobicContact CZ-CB 4.12Å; F409-H417 AromaticContact CZ-CD2 3.83Å; F409-H417 AromaticContact CZ-CG 3.72Å; F409-H417 AromaticContact CZ-ND1 3.98Å; F409-P418 HydrophobicContact CB-CG 4.36Å; F409-P418 HydrophobicContact CD1-CG 4.28Å; F409-P418 HydrophobicContact CD2-CG 4.29Å; F409-P418 HydrophobicContact CG-CG 4.05Å
410	V	63.6	Low	80.1	Confident	107 Å²	107	67.8 Å²	67.8	65%	0.648	32%	0.315	S	S	*	.			trans	-106.6	137.2	169.1	-177.3	0	0	0	0	107	L408 S412	L408-V410 PolarHBondContact O-N 2.81Å; V410-S412 VanDerWaalsContact O-CB 3.24Å; V410-S412 WeakPolarHBondContact O-CB 3.44Å; V410-S412 PolarHBondContact O-N 3Å
411	Y	67.6	Low	79.9	Confident	67 Å²	67	64 Å²	64	26%	0.263	30%	0.302	S	S	.	.			trans	-51.8	101.6	170.2	-81.4	-77	0	0	0	109.6	F409 H417 V667 L726	F409-Y411 HydrophobicContact CE1-CD1 4.45Å; Y411-H417 AromaticContact CD1-NE2 3.69Å; Y411-H417 AromaticContact CE1-NE2 3.93Å; Y411-V667 HydrophobicContact CE2-CG2 4.38Å; Y411-L726 HydrophobicContact CE1-CD2 3.8Å; Y411-L726 HydrophobicContact CE1-CG 4.48Å
412	S	74.9	Confident	79.9	Confident	25 Å²	25	64.8 Å²	64.8	18%	0.175	31%	0.306	C	S	.	.			trans	-140.9	135.1	-168.7	173.8	0	0	0	0	109.6	V410 F414	V410-S412 VanDerWaalsContact O-CB 3.24Å; V410-S412 WeakPolarHBondContact O-CB 3.44Å; V410-S412 PolarHBondContact O-N 3Å; S412-F414 PolarHBondContact O-N 3.46Å; S412-F414 WeakPolarHBondContact OG-CD2 3.48Å; S412-F414 PolarHBondContact OG-N 3.28Å; S412-F414 VanDerWaalsContact OG-N 3.11Å
413	P	73.1	Confident	80	Confident	60 Å²	60	61.9 Å²	61.9	39%	0.39	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-3.2	172.7	33.9	-36	0	0	0	112.5	W450	P413-W450 WeakPolarHBondContact O-CH2 3.43Å
414	F	81.9	Confident	80.2	Confident	147 Å²	147	59.2 Å²	59.2	65%	0.645	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	-4.7	-176.3	-52.7	-67.4	0	0	0	113.4	S412 W459	S412-F414 PolarHBondContact O-N 3.46Å; S412-F414 WeakPolarHBondContact OG-CD2 3.48Å; S412-F414 PolarHBondContact OG-N 3.28Å; S412-F414 VanDerWaalsContact OG-N 3.11Å; F414-W459 WeakPolarHBondContact O-CB 3.41Å
415	T	85.4	Confident	80.5	Confident	41 Å²	41	59.4 Å²	59.4	25%	0.252	29%	0.289	S	S	.	.	S	Bend	trans	-136.4	140.2	-179.1	52.7	0	0	0	0	110.1	H417 W459	T415-H417 PolarHBondContact O-N 2.98Å; T415-W459 HydrophobicContact CG2-CB 4.45Å; T415-W459 HydrophobicContact CG2-CG 4.45Å
416	P	88.8	Confident	81	Confident	8 Å²	8	58.2 Å²	58.2	5%	0.052	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-63.4	140.5	176.2	26.7	-33.2	0	0	0	110.3	F409 L434 W450 W459	F409-P416 WeakPolarHBondContact CE2-O 3.38Å; P416-L434 HydrophobicContact CB-CD2 3.92Å; P416-L434 HydrophobicContact CG-CD2 4.25Å; P416-W450 HydrophobicContact CB-CD2 4Å; P416-W450 HydrophobicContact CB-CG 3.95Å; P416-W450 HydrophobicContact CG-CD2 4.27Å; P416-W450 HydrophobicContact CG-CG 4.2Å; P416-W459 VanDerWaalsContact CD-CG 3.46Å; P416-W459 HydrophobicContact CG-CD2 3.61Å; P416-W459 HydrophobicContact CG-CE3 3.65Å; P416-W459 HydrophobicContact CG-CG 4.24Å; P416-W459 HydrophobicContact CG-CH2 3.85Å; P416-W459 HydrophobicContact CG-CZ2 3.84Å; P416-W459 HydrophobicContact CG-CZ3 3.76Å
417	H	86.6	Confident	82.2	Confident	15 Å²	15	51 Å²	51	7%	0.069	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-62.6	147.2	170.2	-67.8	59.1	0	0	0	110.3	F409 Y411 T415 R419	F409-H417 HydrophobicContact CZ-CB 4.12Å; F409-H417 AromaticContact CZ-CD2 3.83Å; F409-H417 AromaticContact CZ-CG 3.72Å; F409-H417 AromaticContact CZ-ND1 3.98Å; Y411-H417 AromaticContact CD1-NE2 3.69Å; Y411-H417 AromaticContact CE1-NE2 3.93Å; T415-H417 PolarHBondContact O-N 2.98Å; H417-R419 PolarHBondContact O-N 3.37Å; H417-R419 PolarHBondContact O-NE 2.72Å
418	P	88.5	Confident	83.4	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.013	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-52.9	140	172.9	-24.2	33.8	0	0	0	110	F387 E389 F409 S439 K440	F387-P418 HydrophobicContact CB-CB 3.87Å; F387-P418 HydrophobicContact CD1-CB 4.48Å; E389-P418 HydrophobicContact CG-CB 4.14Å; E389-P418 HydrophobicContact CG-CG 3.64Å; F409-P418 HydrophobicContact CB-CG 4.36Å; F409-P418 HydrophobicContact CD1-CG 4.28Å; F409-P418 HydrophobicContact CD2-CG 4.29Å; F409-P418 HydrophobicContact CG-CG 4.05Å; P418-S439 CarbonylContact O-C 3.5Å; P418-K440 HydrophobicContact CB-CB 4.11Å; P418-K440 HydrophobicContact CB-CD 4.06Å; P418-K440 HydrophobicContact CG-CD 4.13Å; P418-K440 VanDerWaalsContact O-CB 3.25Å; P418-K440 WeakPolarHBondContact O-CB 3.44Å; P418-K440 PolarHBondContact O-N 2.7Å
419	R	90.1	Very high	84.7	Confident	1 Å²	1	37.2 Å²	37.2	0%	0.004	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	163	-170.2	62.1	-172.4	68.7	-157.2	1.1	113.4	H417 M422 G436 C438 D448	H417-R419 PolarHBondContact O-N 3.37Å; H417-R419 PolarHBondContact O-NE 2.72Å; R419-M422 HydrophobicContact CG-CB 4.25Å; R419-M422 HydrophobicContact CG-CG 4.4Å; R419-G436 WeakPolarHBondContact CD-O 3.26Å; R419-G436 PolarHBondContact NH1-O 2.63Å; R419-G436 VanDerWaalsContact NH1-O 3.1Å; R419-C438 CarbonylContact C-O 3.57Å; R419-C438 WeakPolarHBondContact CA-O 3.44Å; R419-C438 WeakPolarHBondContact CB-O 3.46Å; R419-D448 IonicContact CZ-OD1 3.46Å; R419-D448 IonicContact CZ-OD2 2.73Å; R419-D448 IonicContact NH1-OD1 2.89Å; R419-D448 PolarHBondContact NH1-OD1 2.92Å; R419-D448 IonicContact NH1-OD2 2.69Å; R419-D448 PolarHBondContact NH1-OD2 2.74Å; R419-D448 IonicContact NH2-OD1 3.41Å; R419-D448 IonicContact NH2-OD2 3.69Å; R419-D448 PolarHBondContact NH2-OD2 2.71Å
420	R	90.9	Very high	86	Confident	50 Å²	50	36.7 Å²	36.7	19%	0.189	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	169.1	174.1	64.5	173.3	-170.1	-173.9	6.3	111.6	T381 D385 F387 M422 G437 C438	T381-R420 HydrophobicContact CG2-CB 3.7Å; T381-R420 HydrophobicContact CG2-CG 4.46Å; D385-R420 IonicContact OD1-NH1 3.54Å; D385-R420 PolarHBondContact OD1-NH1 3.35Å; D385-R420 IonicContact OD2-NH1 3.3Å; D385-R420 PolarHBondContact OD2-NH1 3.44Å; F387-R420 HydrophobicContact CE1-CB 4.19Å; F387-R420 HydrophobicContact CE1-CG 3.96Å; F387-R420 HydrophobicContact CZ-CG 4.31Å; R420-M422 PolarHBondContact O-N 3.04Å; R420-M422 VanDerWaalsContact O-N 3.12Å; R420-G437 CarbonylContact O-C 3.56Å; R420-G437 VanDerWaalsContact O-CA 3.32Å; R420-G437 WeakPolarHBondContact O-CA 3.31Å; R420-C438 HydrophobicContact CG-CB 4.08Å; R420-C438 PolarHBondContact N-O 2.91Å; R420-C438 PolarHBondContact O-N 2.04Å
421	H	92	Very high	87.3	Confident	40 Å²	40	34 Å²	34	19%	0.185	18%	0.181	C	C	.	.	S	Bend	trans	53.8	32.3	174.9	-57.7	-60.6	0	0	0	113.9	G437 M470 E471	H421-G437 VanDerWaalsContact O-CA 3.26Å; H421-G437 WeakPolarHBondContact O-CA 3.41Å; H421-M470 HydrophobicContact CB-CB 4.01Å; H421-M470 HydrophobicContact CB-CE 3.74Å; H421-M470 WeakPolarHBondContact CD2-CE 3.36Å; H421-M470 CarbonylContact O-C 3.52Å; H421-M470 WeakPolarHBondContact O-CA 3.44Å; H421-E471 HydrophobicContact CB-CG 3.57Å; H421-E471 IonicContact CE1-OE1 2.8Å; H421-E471 PolarHBondContact CE1-OE1 2.9Å; H421-E471 VanDerWaalsContact CE1-OE1 3.29Å; H421-E471 IonicContact CG-OE1 3.37Å; H421-E471 IonicContact ND1-OE1 3.7Å; H421-E471 PolarHBondContact ND1-OE1 3.11Å; H421-E471 PolarHBondContact O-N 2.97Å
422	M	93.6	Very high	88.6	Confident	20 Å²	20	30.9 Å²	30.9	10%	0.099	17%	0.169	C	C	.	.			trans	-87.2	169	-178.2	64.9	65.2	63.6	0	0	110.1	I365 R419 R420 S424 L434	I365-M422 HydrophobicContact CG2-CE 3.81Å; I365-M422 HydrophobicContact CG2-CG 3.95Å; I365-M422 HydrophobicContact CG2-SD 3.65Å; R419-M422 HydrophobicContact CG-CB 4.25Å; R419-M422 HydrophobicContact CG-CG 4.4Å; R420-M422 PolarHBondContact O-N 3.04Å; R420-M422 VanDerWaalsContact O-N 3.12Å; M422-S424 VanDerWaalsContact CE-CA 3.5Å; M422-S424 VanDerWaalsContact CE-N 3.31Å; M422-S424 WeakPolarHBondContact SD-CB 3.33Å; M422-S424 PolarHBondContact SD-N 3.05Å; M422-S424 VanDerWaalsContact SD-N 3.44Å; M422-L434 HydrophobicContact CE-CB 3.96Å; M422-L434 HydrophobicContact CE-CD1 3.48Å; M422-L434 VanDerWaalsContact CE-CD1 3.48Å; M422-L434 HydrophobicContact CE-CG 3.49Å; M422-L434 VanDerWaalsContact CE-CG 3.49Å
423	S	94.3	Very high	89.5	Confident	6 Å²	6	29.8 Å²	29.8	4%	0.042	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	115.5	171	-53.5	0	0	0	0	110.2	F435 A472	S423-F435 PolarHBondContact N-O 3.25Å; S423-F435 PolarHBondContact O-N 2.86Å; S423-A472 WeakPolarHBondContact OG-CB 3.25Å; S423-A472 PolarHBondContact OG-O 2.86Å
424	S	93.9	Very high	90.5	Very high	27 Å²	27	27 Å²	27	19%	0.189	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	146.2	-177.2	-171	0	0	0	0	111.8	G366 M422 V432 L433	G366-S424 PolarHBondContact N-OG 2.93Å; G366-S424 PolarHBondContact O-OG 3.4Å; M422-S424 VanDerWaalsContact CE-CA 3.5Å; M422-S424 VanDerWaalsContact CE-N 3.31Å; M422-S424 WeakPolarHBondContact SD-CB 3.33Å; M422-S424 PolarHBondContact SD-N 3.05Å; M422-S424 VanDerWaalsContact SD-N 3.44Å; S424-V432 WeakPolarHBondContact OG-CG1 3.14Å; S424-L433 WeakPolarHBondContact CA-O 3.47Å
425	L	93	Very high	91.2	Very high	18 Å²	18	20 Å²	20	9%	0.094	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	164.6	162.1	53.1	81.6	0	0	0	111.9	G366 V427 V432 L433 A474 T476 V490	G366-L425 WeakPolarHBondContact O-CA 3.03Å; L425-V427 HydrophobicContact CD1-CG1 3.46Å; L425-V427 VanDerWaalsContact CD1-CG1 3.46Å; L425-V432 WeakPolarHBondContact O-CA 3.31Å; L425-L433 HydrophobicContact CD1-CB 4.47Å; L425-L433 PolarHBondContact N-O 2.88Å; L425-L433 PolarHBondContact O-N 3.17Å; L425-A474 VanDerWaalsContact CD2-C 3.46Å; L425-A474 HydrophobicContact CD2-CB 3.65Å; L425-A474 HydrophobicContact CG-CB 4.46Å; L425-T476 WeakPolarHBondContact CD1-OG1 3.22Å; L425-V490 HydrophobicContact CD1-CG1 4.24Å; L425-V490 HydrophobicContact CD1-CG2 3.82Å; L425-V490 HydrophobicContact CD2-CG1 3.82Å; L425-V490 HydrophobicContact CG-CG1 4.38Å
426	M	91.6	Very high	91.5	Very high	4 Å²	4	18 Å²	18	2%	0.02	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	125.2	169.2	-63.2	-162.7	71.9	0	0	110.2	G367 Y369 I376 S428 V432 T476	G367-M426 VanDerWaalsContact O-SD 3.37Å; Y369-M426 HydrophobicContact CD2-CB 4.23Å; Y369-M426 PolarHBondContact N-SD 3.48Å; I376-M426 HydrophobicContact CG1-CE 3.94Å; I376-M426 HydrophobicContact CG1-SD 4.14Å; M426-S428 WeakPolarHBondContact CE-O 3.38Å; M426-V432 HydrophobicContact CG-CG2 4.36Å; M426-T476 PolarHBondContact O-OG1 2.73Å
427	V	91.3	Very high	91.6	Very high	7 Å²	7	17.6 Å²	17.6	4%	0.042	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	-18	175.2	-60.9	0	0	0	0	112.6	L425 E431 L433 L451 P487 V490 L519	L425-V427 HydrophobicContact CD1-CG1 3.46Å; L425-V427 VanDerWaalsContact CD1-CG1 3.46Å; V427-E431 HydrophobicContact CG2-CB 3.74Å; V427-E431 PolarHBondContact N-O 2.78Å; V427-L433 HydrophobicContact CG1-CB 3.65Å; V427-L451 HydrophobicContact CG2-CD1 3.71Å; V427-P487 WeakPolarHBondContact O-CB 3.49Å; V427-P487 WeakPolarHBondContact O-CG 3.15Å; V427-V490 HydrophobicContact CG1-CG2 3.56Å; V427-L519 HydrophobicContact CB-CD1 4.06Å; V427-L519 HydrophobicContact CB-CD2 3.74Å; V427-L519 HydrophobicContact CG1-CD1 4.44Å; V427-L519 HydrophobicContact CG1-CD2 3.82Å; V427-L519 HydrophobicContact CG2-CD2 4.21Å
428	S	88.9	Confident	91.7	Very high	23 Å²	23	17.1 Å²	17.1	16%	0.161	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	170.8	172.1	76.9	0	0	0	0	108.5	M426 S430 E431	M426-S428 WeakPolarHBondContact CE-O 3.38Å; S428-S430 PolarHBondContact O-N 3.45Å; S428-S430 PolarHBondContact OG-N 3.26Å; S428-E431 PolarHBondContact N-O 2.85Å; S428-E431 PolarHBondContact O-N 3.08Å; S428-E431 VanDerWaalsContact OG-CB 3.26Å; S428-E431 WeakPolarHBondContact OG-CB 3.42Å; S428-E431 WeakPolarHBondContact OG-CG 3.31Å; S428-E431 PolarHBondContact OG-N 3.45Å; S428-E431 VanDerWaalsContact OG-N 3.09Å
429	P	86.7	Confident	91.6	Very high	61 Å²	61	17.6 Å²	17.6	40%	0.396	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-17.4	174.7	-22.2	31.5	0	0	0	114.1	Y369 H374	Y369-P429 HydrophobicContact CD1-CB 4.27Å; Y369-P429 HydrophobicContact CD1-CG 3.66Å; Y369-P429 HydrophobicContact CE1-CG 3.51Å; Y369-P429 HydrophobicContact CG-CG 4.31Å; H374-P429 PolarHBondContact CE1-O 3.34Å; H374-P429 PolarHBondContact NE2-O 2.92Å
430	S	89	Confident	91.3	Very high	41 Å²	41	20.3 Å²	20.3	29%	0.287	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.8	5.5	-176	59.6	0	0	0	0	113.5	S428 N453 V454	S428-S430 PolarHBondContact O-N 3.45Å; S428-S430 PolarHBondContact OG-N 3.26Å; S430-N453 CarbonylContact O-C 3.56Å; S430-N453 WeakPolarHBondContact O-CA 3.24Å; S430-V454 WeakPolarHBondContact O-CB 3.47Å; S430-V454 WeakPolarHBondContact O-CG2 3.38Å; S430-V454 PolarHBondContact O-N 2.96Å
431	E	92.1	Very high	90.8	Very high	52 Å²	52	20 Å²	20	24%	0.243	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.3	-174.7	-60.6	-179.7	145.8	0	0	113	V427 S428 L451 F452	V427-E431 HydrophobicContact CG2-CB 3.74Å; V427-E431 PolarHBondContact N-O 2.78Å; S428-E431 PolarHBondContact N-O 2.85Å; S428-E431 PolarHBondContact O-N 3.08Å; S428-E431 VanDerWaalsContact OG-CB 3.26Å; S428-E431 WeakPolarHBondContact OG-CB 3.42Å; S428-E431 WeakPolarHBondContact OG-CG 3.31Å; S428-E431 PolarHBondContact OG-N 3.45Å; S428-E431 VanDerWaalsContact OG-N 3.09Å; E431-L451 HydrophobicContact CB-CD1 4.02Å; E431-L451 HydrophobicContact CB-CG 4.27Å; E431-F452 CarbonylContact C-O 3.37Å; E431-F452 VanDerWaalsContact CA-O 3.22Å; E431-F452 WeakPolarHBondContact CA-O 3.39Å
432	V	93.5	Very high	90.1	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	125.6	178.1	179.4	0	0	0	0	109.1	I376 S424 L425 M426 L451 F452 V454	I376-V432 HydrophobicContact CB-CG2 4.2Å; I376-V432 HydrophobicContact CG1-CG2 4.18Å; I376-V432 HydrophobicContact CG2-CG2 4.03Å; S424-V432 WeakPolarHBondContact OG-CG1 3.14Å; L425-V432 WeakPolarHBondContact O-CA 3.31Å; M426-V432 HydrophobicContact CG-CG2 4.36Å; V432-L451 CarbonylContact O-C 3.59Å; V432-L451 WeakPolarHBondContact O-CA 3.4Å; V432-F452 HydrophobicContact CB-CB 4.28Å; V432-F452 PolarHBondContact N-O 2.84Å; V432-F452 PolarHBondContact O-N 2.85Å; V432-V454 HydrophobicContact CG2-CG2 4.31Å
433	L	94.8	Very high	89.4	Confident	3 Å²	3	18.7 Å²	18.7	2%	0.016	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	132.9	169.9	-176.8	73.9	0	0	0	109.4	S424 L425 V427 L462 V490 Y517	S424-L433 WeakPolarHBondContact CA-O 3.47Å; L425-L433 HydrophobicContact CD1-CB 4.47Å; L425-L433 PolarHBondContact N-O 2.88Å; L425-L433 PolarHBondContact O-N 3.17Å; V427-L433 HydrophobicContact CG1-CB 3.65Å; L433-L462 HydrophobicContact CD1-CD1 3.38Å; L433-V490 HydrophobicContact CD2-CB 3.97Å; L433-V490 HydrophobicContact CD2-CG1 3.76Å; L433-V490 HydrophobicContact CD2-CG2 3.93Å; L433-Y517 HydrophobicContact CD1-CD1 4.47Å; L433-Y517 HydrophobicContact CD2-CD1 4.44Å
434	L	94.6	Very high	88.8	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	124.3	177	175.9	126.7	0	0	0	109	I365 L379 P416 M422 A449 W450 W459	I365-L434 HydrophobicContact CB-CD1 4.35Å; I365-L434 HydrophobicContact CD1-CD1 4.41Å; I365-L434 HydrophobicContact CG2-CD1 3.54Å; L379-L434 HydrophobicContact CD1-CD1 3.9Å; P416-L434 HydrophobicContact CB-CD2 3.92Å; P416-L434 HydrophobicContact CG-CD2 4.25Å; M422-L434 HydrophobicContact CE-CB 3.96Å; M422-L434 HydrophobicContact CE-CD1 3.48Å; M422-L434 VanDerWaalsContact CE-CD1 3.48Å; M422-L434 HydrophobicContact CE-CG 3.49Å; M422-L434 VanDerWaalsContact CE-CG 3.49Å; L434-A449 CarbonylContact O-C 3.51Å; L434-A449 VanDerWaalsContact O-CA 3.28Å; L434-A449 WeakPolarHBondContact O-CA 3.29Å; L434-W450 HydrophobicContact CB-CB 4.4Å; L434-W450 HydrophobicContact CD2-CB 4.07Å; L434-W450 HydrophobicContact CD2-CG 4.15Å; L434-W450 PolarHBondContact N-O 2.86Å; L434-W450 PolarHBondContact O-N 2.98Å; L434-W459 HydrophobicContact CB-CH2 4.31Å; L434-W459 HydrophobicContact CB-CZ3 3.96Å; L434-W459 HydrophobicContact CD1-CH2 4.03Å; L434-W459 HydrophobicContact CD1-CZ3 4.41Å; L434-W459 HydrophobicContact CD2-CZ3 4.35Å; L434-W459 HydrophobicContact CG-CZ3 4.49Å
435	F	94.7	Very high	88.5	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	137.8	177.5	175.6	-113.7	0	0	0	112.6	S423 A449 P466 R469 I492	S423-F435 PolarHBondContact N-O 3.25Å; S423-F435 PolarHBondContact O-N 2.86Å; F435-A449 HydrophobicContact CD2-CB 3.9Å; F435-P466 HydrophobicContact CE2-CB 4.12Å; F435-P466 HydrophobicContact CE2-CG 4.03Å; F435-P466 HydrophobicContact CZ-CB 3.71Å; F435-P466 HydrophobicContact CZ-CG 4.07Å; F435-R469 HydrophobicContact CE1-CG 3.61Å; F435-R469 HydrophobicContact CZ-CG 4.21Å; F435-I492 HydrophobicContact CB-CD1 3.89Å; F435-I492 HydrophobicContact CD1-CD1 3.5Å; F435-I492 VanDerWaalsContact CD1-CD1 3.5Å; F435-I492 HydrophobicContact CD1-CG2 3.98Å; F435-I492 HydrophobicContact CE1-CD1 4.2Å; F435-I492 HydrophobicContact CE1-CG2 4.07Å; F435-I492 HydrophobicContact CG-CD1 3.78Å
436	G	92.3	Very high	88.1	Confident	0 Å²	0	17 Å²	17	0%	0	10%	0.096	C	C	.	.			trans	64.8	-146.7	166.8	0	0	0	0	0	114.7	R419 T446 D448	R419-G436 WeakPolarHBondContact CD-O 3.26Å; R419-G436 PolarHBondContact NH1-O 2.63Å; R419-G436 VanDerWaalsContact NH1-O 3.1Å; G436-T446 VanDerWaalsContact C-CG2 3.47Å; G436-T446 VanDerWaalsContact CA-O 3.3Å; G436-T446 WeakPolarHBondContact CA-O 3.34Å; G436-T446 VanDerWaalsContact O-CG2 3.3Å; G436-T446 WeakPolarHBondContact O-CG2 2.95Å; G436-D448 PolarHBondContact N-O 2.8Å; G436-D448 VanDerWaalsContact N-O 3.11Å
437	G	91.9	Very high	87.9	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.099	C	C	.	.			trans	87.8	-157.3	-177.2	0	0	0	0	0	113.8	R420 H421 P445 T446 R469	R420-G437 CarbonylContact O-C 3.56Å; R420-G437 VanDerWaalsContact O-CA 3.32Å; R420-G437 WeakPolarHBondContact O-CA 3.31Å; H421-G437 VanDerWaalsContact O-CA 3.26Å; H421-G437 WeakPolarHBondContact O-CA 3.41Å; G437-P445 CarbonylContact O-C 3.47Å; G437-P445 VanDerWaalsContact O-CA 3.27Å; G437-P445 WeakPolarHBondContact O-CA 3.28Å; G437-T446 WeakPolarHBondContact O-CG2 3.36Å; G437-T446 PolarHBondContact O-N 3.41Å; G437-R469 PolarHBondContact N-O 2.99Å
438	C	88.5	Confident	87.7	Confident	4 Å²	4	17 Å²	17	3%	0.027	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	112.5	-178.9	-70.8	0	0	0	0	110.5	R419 R420 C444 M470	R419-C438 CarbonylContact C-O 3.57Å; R419-C438 WeakPolarHBondContact CA-O 3.44Å; R419-C438 WeakPolarHBondContact CB-O 3.46Å; R420-C438 HydrophobicContact CG-CB 4.08Å; R420-C438 PolarHBondContact N-O 2.91Å; R420-C438 PolarHBondContact O-N 2.04Å; C438-C444 HydrophobicContact CB-CB 3.57Å; C438-C444 WeakPolarHBondContact CB-SG 3.35Å; C438-C444 WeakPolarHBondContact SG-CB 3.34Å; C438-C444 CovalentContact SG-SG 2.03Å; C438-C444 PolarHBondContact SG-SG 2.89Å; C438-M470 PolarHBondContact SG-SD 2.69Å
439	S	86.5	Confident	87.9	Confident	13 Å²	13	16 Å²	16	9%	0.091	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	146.3	-178.2	63.3	0	0	0	0	112.4	P418 H441 G442 Q443	P418-S439 CarbonylContact O-C 3.5Å; S439-H441 PolarHBondContact O-N 2.89Å; S439-H441 VanDerWaalsContact O-N 3.1Å; S439-G442 PolarHBondContact O-N 3Å; S439-G442 WeakPolarHBondContact OG-CA 3.48Å; S439-G442 PolarHBondContact OG-N 2.77Å; S439-Q443 PolarHBondContact N-O 2.87Å; S439-Q443 PolarHBondContact OG-N 2.88Å; S439-Q443 PolarHBondContact OG-O 2.98Å
440	K	84.3	Confident	88.2	Confident	57 Å²	57	13.6 Å²	13.6	25%	0.248	7%	0.074	C	C	.	.	S	Bend	trans	-62	111.5	174.4	-175.8	-174.7	-176.7	173.3	0	108.9	F387 E389 P418 G442	F387-K440 HydrophobicContact CB-CB 4.32Å; F387-K440 HydrophobicContact CB-CD 3.86Å; F387-K440 HydrophobicContact CB-CG 4.23Å; F387-K440 HydrophobicContact CD1-CB 3.95Å; F387-K440 HydrophobicContact CD2-CB 3.95Å; F387-K440 HydrophobicContact CD2-CD 4.2Å; F387-K440 HydrophobicContact CD2-CG 3.7Å; F387-K440 HydrophobicContact CE1-CB 4.21Å; F387-K440 HydrophobicContact CE2-CB 4.22Å; F387-K440 HydrophobicContact CE2-CG 4.18Å; F387-K440 HydrophobicContact CG-CB 3.8Å; F387-K440 HydrophobicContact CG-CD 4.12Å; F387-K440 HydrophobicContact CG-CG 3.91Å; F387-K440 HydrophobicContact CZ-CB 4.34Å; E389-K440 IonicContact OE1-NZ 3.39Å; E389-K440 PolarHBondContact OE1-NZ 2.83Å; P418-K440 HydrophobicContact CB-CB 4.11Å; P418-K440 HydrophobicContact CB-CD 4.06Å; P418-K440 HydrophobicContact CG-CD 4.13Å; P418-K440 VanDerWaalsContact O-CB 3.25Å; P418-K440 WeakPolarHBondContact O-CB 3.44Å; P418-K440 PolarHBondContact O-N 2.7Å; K440-G442 PolarHBondContact O-N 3.35Å; K440-G442 VanDerWaalsContact O-N 3.08Å
441	H	78.4	Confident	88.5	Confident	44 Å²	44	12.2 Å²	12.2	20%	0.204	6%	0.063	C	C	.	.	S	Bend	trans	64.3	-3.2	-177.9	-47.1	-62	0	0	0	117.7	S439 L726	S439-H441 PolarHBondContact O-N 2.89Å; S439-H441 VanDerWaalsContact O-N 3.1Å; H441-L726 HydrophobicContact CB-CD2 4.43Å
442	G	77.9	Confident	88.5	Confident	5 Å²	5	9.7 Å²	9.7	5%	0.052	5%	0.051	C	C	.	.	S	Bend	trans	-97.3	-147.2	179	0	0	0	0	0	112.4	S439 K440	S439-G442 PolarHBondContact O-N 3Å; S439-G442 WeakPolarHBondContact OG-CA 3.48Å; S439-G442 PolarHBondContact OG-N 2.77Å; K440-G442 PolarHBondContact O-N 3.35Å; K440-G442 VanDerWaalsContact O-N 3.08Å
443	Q	78.6	Confident	88.4	Confident	27 Å²	27	11.4 Å²	11.4	13%	0.126	6%	0.06	C	C	.	.			trans	-73	145.7	178.6	-164	-179	-38.9	0	0	112.3	S439 P445 N591 L593	S439-Q443 PolarHBondContact N-O 2.87Å; S439-Q443 PolarHBondContact OG-N 2.88Å; S439-Q443 PolarHBondContact OG-O 2.98Å; Q443-P445 WeakPolarHBondContact CG-O 3.28Å; Q443-P445 PolarHBondContact NE2-O 2.93Å; Q443-N591 PolarHBondContact NE2-ND2 3.44Å; Q443-N591 PolarHBondContact OE1-ND2 2.84Å; Q443-L593 HydrophobicContact CB-CD2 4.3Å
444	C	83.3	Confident	88.2	Confident	5 Å²	5	12.3 Å²	12.3	3%	0.034	7%	0.066	C	C	.	.	S	Bend	trans	-147.6	114.8	173.5	173	0	0	0	0	110.1	C438 Q501 N660	C438-C444 HydrophobicContact CB-CB 3.57Å; C438-C444 WeakPolarHBondContact CB-SG 3.35Å; C438-C444 WeakPolarHBondContact SG-CB 3.34Å; C438-C444 CovalentContact SG-SG 2.03Å; C438-C444 PolarHBondContact SG-SG 2.89Å; C444-Q501 VanDerWaalsContact O-CD 3.31Å; C444-Q501 PolarHBondContact O-NE2 2.84Å; C444-Q501 PolarHBondContact O-OE1 2.83Å; C444-N660 WeakPolarHBondContact CB-OD1 3.44Å; C444-N660 PolarHBondContact SG-OD1 3.01Å; C444-N660 VanDerWaalsContact SG-OD1 3.34Å
445	P	86.1	Confident	87.9	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	10%	0.102	C	C	.	.	S	Bend	cis	-73.9	152.7	-3.8	32.9	-36.5	0	0	0	112.4	G437 Q443 P468 R469 M470 R497	G437-P445 CarbonylContact O-C 3.47Å; G437-P445 VanDerWaalsContact O-CA 3.27Å; G437-P445 WeakPolarHBondContact O-CA 3.28Å; Q443-P445 WeakPolarHBondContact CG-O 3.28Å; Q443-P445 PolarHBondContact NE2-O 2.93Å; P445-P468 HydrophobicContact CB-CB 4.36Å; P445-P468 HydrophobicContact CG-CB 4.09Å; P445-P468 WeakPolarHBondContact O-CB 3.33Å; P445-R469 VanDerWaalsContact CB-C 3.43Å; P445-M470 HydrophobicContact CB-CB 4.21Å; P445-M470 HydrophobicContact CB-CG 4.38Å; P445-R497 HydrophobicContact CG-CG 4.31Å
446	T	85.7	Confident	87.7	Confident	12 Å²	12	23.4 Å²	23.4	7%	0.074	13%	0.125	C	C	.	.			trans	-94.5	160.6	168.4	-174.5	0	0	0	0	111.2	G436 G437 D448 P468 R469	G436-T446 VanDerWaalsContact C-CG2 3.47Å; G436-T446 VanDerWaalsContact CA-O 3.3Å; G436-T446 WeakPolarHBondContact CA-O 3.34Å; G436-T446 VanDerWaalsContact O-CG2 3.3Å; G436-T446 WeakPolarHBondContact O-CG2 2.95Å; G437-T446 WeakPolarHBondContact O-CG2 3.36Å; G437-T446 PolarHBondContact O-N 3.41Å; T446-D448 WeakPolarHBondContact CB-OD1 3.27Å; T446-D448 WeakPolarHBondContact CG2-OD1 3.49Å; T446-D448 PolarHBondContact OG1-OD1 2.92Å; T446-P468 VanDerWaalsContact O-CA 3.29Å; T446-P468 WeakPolarHBondContact O-CA 3.38Å; T446-R469 PolarHBondContact O-N 3.13Å
447	G	86.4	Confident	87.5	Confident	7 Å²	7	27.9 Å²	27.9	7%	0.072	15%	0.146	C	C	.	.			trans	-125.4	13.4	179.3	0	0	0	0	0	113.5
448	D	88	Confident	87.4	Confident	4 Å²	4	32 Å²	32	2%	0.021	17%	0.171	C	C	.	.			trans	-74.4	146.9	171.3	60.9	-27.2	0	0	0	110.9	R419 G436 T446 W450 F464	R419-D448 IonicContact CZ-OD1 3.46Å; R419-D448 IonicContact CZ-OD2 2.73Å; R419-D448 IonicContact NH1-OD1 2.89Å; R419-D448 PolarHBondContact NH1-OD1 2.92Å; R419-D448 IonicContact NH1-OD2 2.69Å; R419-D448 PolarHBondContact NH1-OD2 2.74Å; R419-D448 IonicContact NH2-OD1 3.41Å; R419-D448 IonicContact NH2-OD2 3.69Å; R419-D448 PolarHBondContact NH2-OD2 2.71Å; G436-D448 PolarHBondContact N-O 2.8Å; G436-D448 VanDerWaalsContact N-O 3.11Å; T446-D448 WeakPolarHBondContact CB-OD1 3.27Å; T446-D448 WeakPolarHBondContact CG2-OD1 3.49Å; T446-D448 PolarHBondContact OG1-OD1 2.92Å; D448-W450 PolarHBondContact OD2-NE1 2.81Å; D448-F464 HydrophobicContact CB-CE1 3.67Å; D448-F464 HydrophobicContact CB-CZ 4.07Å
449	A	92.9	Very high	87.5	Confident	2 Å²	2	33 Å²	33	2%	0.017	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	144.6	174.9	0	0	0	0	0	109.9	L434 F435 L462 W524	L434-A449 CarbonylContact O-C 3.51Å; L434-A449 VanDerWaalsContact O-CA 3.28Å; L434-A449 WeakPolarHBondContact O-CA 3.29Å; F435-A449 HydrophobicContact CD2-CB 3.9Å; A449-L462 HydrophobicContact CB-CB 3.92Å; A449-L462 HydrophobicContact CB-CD1 4.08Å; A449-L462 HydrophobicContact CB-CG 4.49Å; A449-L462 WeakPolarHBondContact O-CB 3.31Å; A449-L462 PolarHBondContact O-N 2.87Å; A449-W524 HydrophobicContact CB-CH2 4.23Å; A449-W524 HydrophobicContact CB-CZ2 3.49Å; A449-W524 VanDerWaalsContact CB-CZ2 3.49Å
450	W	93.3	Very high	87.7	Confident	10 Å²	10	37.2 Å²	37.2	4%	0.038	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	145	-176.1	-60	79.7	0	0	0	110.9	P413 P416 L434 D448 W459 Q460	P413-W450 WeakPolarHBondContact O-CH2 3.43Å; P416-W450 HydrophobicContact CB-CD2 4Å; P416-W450 HydrophobicContact CB-CG 3.95Å; P416-W450 HydrophobicContact CG-CD2 4.27Å; P416-W450 HydrophobicContact CG-CG 4.2Å; L434-W450 HydrophobicContact CB-CB 4.4Å; L434-W450 HydrophobicContact CD2-CB 4.07Å; L434-W450 HydrophobicContact CD2-CG 4.15Å; L434-W450 PolarHBondContact N-O 2.86Å; L434-W450 PolarHBondContact O-N 2.98Å; D448-W450 PolarHBondContact OD2-NE1 2.81Å; W450-W459 HydrophobicContact CB-CE3 3.61Å; W450-W459 HydrophobicContact CB-CZ3 3.76Å; W450-W459 HydrophobicContact CE3-CB 4.11Å; W450-W459 HydrophobicContact CG-CE3 4.41Å; W450-W459 HydrophobicContact CZ3-CB 4.5Å; W450-Q460 CarbonylContact C-O 3.54Å; W450-Q460 VanDerWaalsContact CA-O 3.31Å; W450-Q460 WeakPolarHBondContact CA-O 3.35Å
451	L	93.7	Very high	88	Confident	11 Å²	11	37.3 Å²	37.3	6%	0.058	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	123.1	169.6	-166.9	72	0	0	0	108.4	V427 E431 V432 W459 Q460	V427-L451 HydrophobicContact CG2-CD1 3.71Å; E431-L451 HydrophobicContact CB-CD1 4.02Å; E431-L451 HydrophobicContact CB-CG 4.27Å; V432-L451 CarbonylContact O-C 3.59Å; V432-L451 WeakPolarHBondContact O-CA 3.4Å; L451-W459 WeakPolarHBondContact O-CA 3.41Å; L451-Q460 HydrophobicContact CB-CB 4.43Å; L451-Q460 PolarHBondContact N-O 2.73Å; L451-Q460 PolarHBondContact O-N 3.49Å
452	F	93.1	Very high	88.6	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123.7	173.9	-179.7	-116.5	0	0	0	109.9	I391 I404 I405 E431 V432 V454 W459	I391-F452 HydrophobicContact CD1-CD1 4.26Å; I391-F452 HydrophobicContact CD1-CE1 3.95Å; I391-F452 HydrophobicContact CD1-CE2 4.33Å; I391-F452 HydrophobicContact CD1-CZ 3.99Å; I391-F452 HydrophobicContact CG2-CE1 4.39Å; I404-F452 HydrophobicContact CG2-CE1 4.28Å; I404-F452 HydrophobicContact CG2-CZ 3.88Å; I405-F452 HydrophobicContact CD1-CE2 3.82Å; I405-F452 HydrophobicContact CD1-CZ 3.91Å; I405-F452 HydrophobicContact CG1-CE2 4.48Å; I405-F452 HydrophobicContact CG1-CZ 4.17Å; E431-F452 CarbonylContact C-O 3.37Å; E431-F452 VanDerWaalsContact CA-O 3.22Å; E431-F452 WeakPolarHBondContact CA-O 3.39Å; V432-F452 HydrophobicContact CB-CB 4.28Å; V432-F452 PolarHBondContact N-O 2.84Å; V432-F452 PolarHBondContact O-N 2.85Å; F452-V454 HydrophobicContact CD1-CG2 4.2Å; F452-V454 HydrophobicContact CE1-CG2 4.24Å; F452-W459 HydrophobicContact CB-CD2 3.92Å; F452-W459 HydrophobicContact CB-CE3 3.62Å; F452-W459 HydrophobicContact CB-CH2 3.72Å; F452-W459 HydrophobicContact CB-CZ2 3.97Å; F452-W459 HydrophobicContact CB-CZ3 3.54Å; F452-W459 AromaticContact CD2-CD1 3.77Å; F452-W459 AromaticContact CD2-CD2 3.65Å; F452-W459 HydrophobicContact CD2-CD2 3.65Å; F452-W459 AromaticContact CD2-CE2 3.43Å; F452-W459 VanDerWaalsContact CD2-CE2 3.43Å; F452-W459 HydrophobicContact CD2-CE3 4.25Å; F452-W459 AromaticContact CD2-CG 3.92Å; F452-W459 HydrophobicContact CD2-CG 3.92Å; F452-W459 AromaticContact CD2-CZ2 3.93Å; F452-W459 HydrophobicContact CD2-CZ2 3.93Å; F452-W459 AromaticContact CD2-NE1 3.47Å; F452-W459 AromaticContact CE2-NE1 3.76Å; F452-W459 HydrophobicContact CG-CD2 4.18Å; F452-W459 AromaticContact CG-CE2 3.95Å; F452-W459 HydrophobicContact CG-CE3 4.37Å; F452-W459 HydrophobicContact CG-CH2 4.24Å; F452-W459 AromaticContact CG-CZ2 4Å; F452-W459 HydrophobicContact CG-CZ2 4Å; F452-W459 HydrophobicContact CG-CZ3 4.42Å
453	N	92.1	Very high	88.9	Confident	35 Å²	35	39.1 Å²	39.1	19%	0.187	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	115.1	171.6	-173.7	-66.2	0	0	0	109.9	S430 Q455 S456 H457 V458	S430-N453 CarbonylContact O-C 3.56Å; S430-N453 WeakPolarHBondContact O-CA 3.24Å; N453-Q455 VanDerWaalsContact C-N 3.27Å; N453-Q455 PolarHBondContact O-N 3.26Å; N453-Q455 PolarHBondContact OD1-N 2.89Å; N453-S456 WeakPolarHBondContact CB-OG 3.24Å; N453-S456 PolarHBondContact OD1-N 3.05Å; N453-S456 PolarHBondContact OD1-OG 2.83Å; N453-H457 VanDerWaalsContact O-CA 3.26Å; N453-H457 WeakPolarHBondContact O-CA 3.32Å; N453-H457 PolarHBondContact O-N 3.16Å; N453-V458 PolarHBondContact N-O 3.29Å
454	V	88.8	Confident	89.2	Confident	22 Å²	22	42.8 Å²	42.8	13%	0.133	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-30	-177.1	175.5	0	0	0	0	112.2	I376 I404 S430 V432 F452 H457	I376-V454 HydrophobicContact CD1-CB 4.48Å; I376-V454 HydrophobicContact CD1-CG1 3.76Å; I376-V454 HydrophobicContact CD1-CG2 3.79Å; I376-V454 HydrophobicContact CG1-CG2 3.96Å; I404-V454 HydrophobicContact CD1-CG1 3.86Å; S430-V454 WeakPolarHBondContact O-CB 3.47Å; S430-V454 WeakPolarHBondContact O-CG2 3.38Å; S430-V454 PolarHBondContact O-N 2.96Å; V432-V454 HydrophobicContact CG2-CG2 4.31Å; F452-V454 HydrophobicContact CD1-CG2 4.2Å; F452-V454 HydrophobicContact CE1-CG2 4.24Å; V454-H457 PolarHBondContact O-CD2 2.87Å; V454-H457 PolarHBondContact O-NE2 3.08Å
455	Q	88.6	Confident	89.3	Confident	164 Å²	164	43 Å²	43	77%	0.766	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86	-42.8	-177	-171.8	179.3	13.4	0	0	112.4	N453 H457	N453-Q455 VanDerWaalsContact C-N 3.27Å; N453-Q455 PolarHBondContact O-N 3.26Å; N453-Q455 PolarHBondContact OD1-N 2.89Å; Q455-H457 PolarHBondContact O-CD2 3.44Å
456	S	90.5	Very high	89.3	Confident	69 Å²	69	43.2 Å²	43.2	48%	0.483	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-13.1	179.7	67.4	0	0	0	0	113.3	N453 V458	N453-S456 WeakPolarHBondContact CB-OG 3.24Å; N453-S456 PolarHBondContact OD1-N 3.05Å; N453-S456 PolarHBondContact OD1-OG 2.83Å; S456-V458 WeakPolarHBondContact O-CG2 3.21Å; S456-V458 PolarHBondContact O-N 2.85Å
457	H	88.5	Confident	89.3	Confident	95 Å²	95	42.8 Å²	42.8	44%	0.44	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	28.3	-176.4	-53.4	-169.6	0	0	0	112.1	I404 N453 V454 Q455	I404-H457 HydrophobicContact CG2-CB 4.49Å; I404-H457 PolarHBondContact O-CE1 3.26Å; I404-H457 VanDerWaalsContact O-CE1 3.27Å; I404-H457 PolarHBondContact O-ND1 3.22Å; I404-H457 VanDerWaalsContact O-ND1 3.11Å; N453-H457 VanDerWaalsContact O-CA 3.26Å; N453-H457 WeakPolarHBondContact O-CA 3.32Å; N453-H457 PolarHBondContact O-N 3.16Å; V454-H457 PolarHBondContact O-CD2 2.87Å; V454-H457 PolarHBondContact O-NE2 3.08Å; Q455-H457 PolarHBondContact O-CD2 3.44Å
458	V	90	Very high	89.3	Confident	85 Å²	85	42.7 Å²	42.7	52%	0.515	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	136.4	-177.5	177.7	0	0	0	0	110.5	N453 S456	N453-V458 PolarHBondContact N-O 3.29Å; S456-V458 WeakPolarHBondContact O-CG2 3.21Å; S456-V458 PolarHBondContact O-N 2.85Å
459	W	90.7	Very high	89.4	Confident	26 Å²	26	42.6 Å²	42.6	10%	0.098	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	133.1	168.3	-73	96.6	0	0	0	110.3	I365 L379 I391 F414 T415 P416 L434 W450 L451 F452	I365-W459 HydrophobicContact CD1-CH2 3.84Å; I365-W459 HydrophobicContact CD1-CZ2 4.12Å; L379-W459 HydrophobicContact CD1-CH2 4.32Å; L379-W459 HydrophobicContact CD1-CZ2 4.23Å; I391-W459 HydrophobicContact CD1-CZ2 3.84Å; F414-W459 WeakPolarHBondContact O-CB 3.41Å; T415-W459 HydrophobicContact CG2-CB 4.45Å; T415-W459 HydrophobicContact CG2-CG 4.45Å; P416-W459 VanDerWaalsContact CD-CG 3.46Å; P416-W459 HydrophobicContact CG-CD2 3.61Å; P416-W459 HydrophobicContact CG-CE3 3.65Å; P416-W459 HydrophobicContact CG-CG 4.24Å; P416-W459 HydrophobicContact CG-CH2 3.85Å; P416-W459 HydrophobicContact CG-CZ2 3.84Å; P416-W459 HydrophobicContact CG-CZ3 3.76Å; L434-W459 HydrophobicContact CB-CH2 4.31Å; L434-W459 HydrophobicContact CB-CZ3 3.96Å; L434-W459 HydrophobicContact CD1-CH2 4.03Å; L434-W459 HydrophobicContact CD1-CZ3 4.41Å; L434-W459 HydrophobicContact CD2-CZ3 4.35Å; L434-W459 HydrophobicContact CG-CZ3 4.49Å; W450-W459 HydrophobicContact CB-CE3 3.61Å; W450-W459 HydrophobicContact CB-CZ3 3.76Å; W450-W459 HydrophobicContact CE3-CB 4.11Å; W450-W459 HydrophobicContact CG-CE3 4.41Å; W450-W459 HydrophobicContact CZ3-CB 4.5Å; L451-W459 WeakPolarHBondContact O-CA 3.41Å; F452-W459 HydrophobicContact CB-CD2 3.92Å; F452-W459 HydrophobicContact CB-CE3 3.62Å; F452-W459 HydrophobicContact CB-CH2 3.72Å; F452-W459 HydrophobicContact CB-CZ2 3.97Å; F452-W459 HydrophobicContact CB-CZ3 3.54Å; F452-W459 AromaticContact CD2-CD1 3.77Å; F452-W459 AromaticContact CD2-CD2 3.65Å; F452-W459 HydrophobicContact CD2-CD2 3.65Å; F452-W459 AromaticContact CD2-CE2 3.43Å; F452-W459 VanDerWaalsContact CD2-CE2 3.43Å; F452-W459 HydrophobicContact CD2-CE3 4.25Å; F452-W459 AromaticContact CD2-CG 3.92Å; F452-W459 HydrophobicContact CD2-CG 3.92Å; F452-W459 AromaticContact CD2-CZ2 3.93Å; F452-W459 HydrophobicContact CD2-CZ2 3.93Å; F452-W459 AromaticContact CD2-NE1 3.47Å; F452-W459 AromaticContact CE2-NE1 3.76Å; F452-W459 HydrophobicContact CG-CD2 4.18Å; F452-W459 AromaticContact CG-CE2 3.95Å; F452-W459 HydrophobicContact CG-CE3 4.37Å; F452-W459 HydrophobicContact CG-CH2 4.24Å; F452-W459 AromaticContact CG-CZ2 4Å; F452-W459 HydrophobicContact CG-CZ2 4Å; F452-W459 HydrophobicContact CG-CZ3 4.42Å
460	Q	91.3	Very high	89.3	Confident	101 Å²	101	42.7 Å²	42.7	47%	0.472	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.7	172.9	-179.8	178.2	-0.3	0	0	109.2	W450 L451	W450-Q460 CarbonylContact C-O 3.54Å; W450-Q460 VanDerWaalsContact CA-O 3.31Å; W450-Q460 WeakPolarHBondContact CA-O 3.35Å; L451-Q460 HydrophobicContact CB-CB 4.43Å; L451-Q460 PolarHBondContact N-O 2.73Å; L451-Q460 PolarHBondContact O-N 3.49Å
461	S	89.9	Confident	89.4	Confident	60 Å²	60	43 Å²	43	42%	0.42	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	134.8	171.1	-175.4	0	0	0	0	109.9
462	L	90.3	Very high	89.4	Confident	8 Å²	8	43 Å²	43	4%	0.042	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-96.6	157.8	172	-62.1	-179.8	0	0	0	110.2	L433 A449 Y517 W524	L433-L462 HydrophobicContact CD1-CD1 3.38Å; A449-L462 HydrophobicContact CB-CB 3.92Å; A449-L462 HydrophobicContact CB-CD1 4.08Å; A449-L462 HydrophobicContact CB-CG 4.49Å; A449-L462 WeakPolarHBondContact O-CB 3.31Å; A449-L462 PolarHBondContact O-N 2.87Å; L462-Y517 HydrophobicContact CD1-CE1 4.19Å; L462-Y517 HydrophobicContact CD1-CE2 4.14Å; L462-Y517 WeakPolarHBondContact CD2-OH 3.3Å; L462-W524 HydrophobicContact CD1-CZ2 4.27Å
463	P	85.8	Confident	89.5	Confident	79 Å²	79	43.4 Å²	43.4	51%	0.513	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-65.3	141.8	179.3	24.3	-31.8	0	0	0	111.5	C465 W524	P463-C465 PolarHBondContact O-N 2.73Å; P463-W524 PolarHBondContact O-NE1 3.34Å; P463-W524 VanDerWaalsContact O-NE1 3.14Å
464	F	84	Confident	89.7	Confident	103 Å²	103	42.9 Å²	42.9	45%	0.452	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-67.1	125.9	173.6	-66	-86.9	0	0	0	110.1	D448	D448-F464 HydrophobicContact CB-CE1 3.67Å; D448-F464 HydrophobicContact CB-CZ 4.07Å
465	C	85	Confident	89.9	Confident	9 Å²	9	42.2 Å²	42.2	6%	0.061	23%	0.231	C	C	.	.			trans	-144.3	-56.5	173.7	175.3	0	0	0	0	112.1	P463 W524 C585	P463-C465 PolarHBondContact O-N 2.73Å; C465-W524 HydrophobicContact CB-CB 3.45Å; C465-W524 VanDerWaalsContact CB-CB 3.45Å; C465-W524 HydrophobicContact CB-CG 3.71Å; C465-W524 VanDerWaalsContact SG-CB 3.5Å; C465-C585 HydrophobicContact CB-CB 3.39Å; C465-C585 WeakPolarHBondContact CB-SG 3.3Å; C465-C585 WeakPolarHBondContact SG-CA 3.46Å; C465-C585 WeakPolarHBondContact SG-CB 3.3Å; C465-C585 CovalentContact SG-SG 2.02Å; C465-C585 PolarHBondContact SG-SG 3.22Å
466	P	86.3	Confident	90.1	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.032	20%	0.203	C	C	.	.	S	Bend	trans	-75.4	152.1	-174.6	-8.8	27.8	0	0	0	110.7	F435 V515 W524	F435-P466 HydrophobicContact CE2-CB 4.12Å; F435-P466 HydrophobicContact CE2-CG 4.03Å; F435-P466 HydrophobicContact CZ-CB 3.71Å; F435-P466 HydrophobicContact CZ-CG 4.07Å; P466-V515 HydrophobicContact CB-CB 4.4Å; P466-V515 HydrophobicContact CB-CG1 3.63Å; P466-V515 HydrophobicContact CB-CG2 3.89Å; P466-V515 HydrophobicContact CG-CG1 3.42Å; P466-V515 VanDerWaalsContact CG-CG1 3.42Å; P466-W524 HydrophobicContact CG-CD2 3.86Å; P466-W524 HydrophobicContact CG-CE3 3.5Å; P466-W524 VanDerWaalsContact CG-CE3 3.5Å; P466-W524 HydrophobicContact CG-CH2 4.3Å; P466-W524 HydrophobicContact CG-CZ3 3.71Å
467	S	85.1	Confident	90.1	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.021	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-63.6	142.5	176.5	-35.8	0	0	0	0	111.2	R469 Q587	S467-R469 PolarHBondContact O-N 3.38Å; S467-R469 PolarHBondContact O-NE 3.02Å; S467-R469 PolarHBondContact O-NH2 3.45Å; S467-Q587 PolarHBondContact OG-OE1 3.04Å
468	P	87.4	Confident	90	Very high	6 Å²	6	30.6 Å²	30.6	4%	0.039	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-52.2	129.1	174.3	-28.5	33.5	0	0	0	112.9	P445 T446 N589	P445-P468 HydrophobicContact CB-CB 4.36Å; P445-P468 HydrophobicContact CG-CB 4.09Å; P445-P468 WeakPolarHBondContact O-CB 3.33Å; T446-P468 VanDerWaalsContact O-CA 3.29Å; T446-P468 WeakPolarHBondContact O-CA 3.38Å; P468-N589 WeakPolarHBondContact CD-ND2 3.35Å; P468-N589 HydrophobicContact CG-CB 4.41Å
469	R	90.1	Very high	89.6	Confident	2 Å²	2	27.5 Å²	27.5	1%	0.008	16%	0.155	C	C	.	.			trans	-152.8	158.9	178.7	66.6	-166.2	77.5	-165.2	0.3	111.6	F435 G437 P445 T446 S467 A472 G494 L509 E513	F435-R469 HydrophobicContact CE1-CG 3.61Å; F435-R469 HydrophobicContact CZ-CG 4.21Å; G437-R469 PolarHBondContact N-O 2.99Å; P445-R469 VanDerWaalsContact CB-C 3.43Å; T446-R469 PolarHBondContact O-N 3.13Å; S467-R469 PolarHBondContact O-N 3.38Å; S467-R469 PolarHBondContact O-NE 3.02Å; S467-R469 PolarHBondContact O-NH2 3.45Å; R469-A472 HydrophobicContact CG-CB 3.88Å; R469-G494 WeakPolarHBondContact CD-O 3.25Å; R469-L509 HydrophobicContact CB-CD1 4.16Å; R469-E513 IonicContact CZ-OE1 3.68Å; R469-E513 IonicContact NH1-OE1 2.66Å; R469-E513 PolarHBondContact NH1-OE1 2.7Å; R469-E513 IonicContact NH2-OE1 3.95Å; R469-E513 PolarHBondContact NH2-OE1 2.96Å
470	M	91.4	Very high	88.8	Confident	4 Å²	4	30.3 Å²	30.3	2%	0.02	18%	0.179	C	C	.	.	B	Isolated β-bridge	trans	-127.1	156.2	173.5	61.9	-176.2	-79.7	0	0	109.9	H421 C438 P445 A472 G495 R496 Y498	H421-M470 HydrophobicContact CB-CB 4.01Å; H421-M470 HydrophobicContact CB-CE 3.74Å; H421-M470 WeakPolarHBondContact CD2-CE 3.36Å; H421-M470 CarbonylContact O-C 3.52Å; H421-M470 WeakPolarHBondContact O-CA 3.44Å; C438-M470 PolarHBondContact SG-SD 2.69Å; P445-M470 HydrophobicContact CB-CB 4.21Å; P445-M470 HydrophobicContact CB-CG 4.38Å; M470-A472 PolarHBondContact O-N 2.8Å; M470-G495 CarbonylContact O-C 3.58Å; M470-G495 WeakPolarHBondContact O-CA 3.21Å; M470-R496 HydrophobicContact CG-CB 4.26Å; M470-R496 PolarHBondContact N-O 2.93Å; M470-R496 VanDerWaalsContact N-O 3.14Å; M470-R496 PolarHBondContact O-N 2.98Å; M470-Y498 HydrophobicContact SD-CD2 4.38Å; M470-Y498 HydrophobicContact SD-CE2 3.54Å; M470-Y498 VanDerWaalsContact SD-CE2 3.54Å
471	E	94.1	Very high	87.8	Confident	16 Å²	16	32 Å²	32	8%	0.075	19%	0.191	C	C	.	.	S	Bend	trans	53.7	34	-179.4	-51.4	-170.8	136.7	0	0	112.7	H260 H421 A543	H260-E471 IonicContact CE1-OE1 2.81Å; H260-E471 PolarHBondContact CE1-OE1 2.8Å; H260-E471 IonicContact NE2-OE1 3.59Å; H260-E471 PolarHBondContact NE2-OE1 2.8Å; H421-E471 HydrophobicContact CB-CG 3.57Å; H421-E471 IonicContact CE1-OE1 2.8Å; H421-E471 PolarHBondContact CE1-OE1 2.9Å; H421-E471 VanDerWaalsContact CE1-OE1 3.29Å; H421-E471 IonicContact CG-OE1 3.37Å; H421-E471 IonicContact ND1-OE1 3.7Å; H421-E471 PolarHBondContact ND1-OE1 3.11Å; H421-E471 PolarHBondContact O-N 2.97Å; E471-A543 HydrophobicContact CB-CB 4.15Å; E471-A543 PolarHBondContact O-N 2.87Å
472	A	95.3	Very high	86.7	Confident	10 Å²	10	32.6 Å²	32.6	8%	0.083	19%	0.189	C	C	.	.			trans	-78.2	147	171.2	0	0	0	0	0	109.6	S423 R469 M470 I492	S423-A472 WeakPolarHBondContact OG-CB 3.25Å; S423-A472 PolarHBondContact OG-O 2.86Å; R469-A472 HydrophobicContact CG-CB 3.88Å; M470-A472 PolarHBondContact O-N 2.8Å; A472-I492 HydrophobicContact CB-CG2 3.8Å
473	S	94.8	Very high	85.7	Confident	10 Å²	10	39.8 Å²	39.8	7%	0.07	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	136.5	174.5	-53.6	0	0	0	0	108.9	I492 Y493 A544 T546	S473-I492 WeakPolarHBondContact O-CA 3.32Å; S473-Y493 PolarHBondContact N-O 3.06Å; S473-Y493 PolarHBondContact O-N 2.86Å; S473-A544 PolarHBondContact OG-O 2.83Å; S473-T546 WeakPolarHBondContact CB-OG1 3.38Å
474	A	94.9	Very high	84.9	Confident	23 Å²	23	43 Å²	43	19%	0.19	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.1	177.4	0	0	0	0	0	110.3	L425 L491 I492	L425-A474 VanDerWaalsContact CD2-C 3.46Å; L425-A474 HydrophobicContact CD2-CB 3.65Å; L425-A474 HydrophobicContact CG-CB 4.46Å; A474-L491 CarbonylContact C-O 3.53Å; A474-L491 VanDerWaalsContact CA-O 3.27Å; A474-L491 WeakPolarHBondContact CA-O 3.13Å; A474-I492 HydrophobicContact CB-CG1 4.16Å
475	V	94.2	Very high	84.5	Confident	9 Å²	9	40.6 Å²	40.6	6%	0.055	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	150.9	176.7	-62.6	0	0	0	0	111.5	L477 V490 L491 T546 V553	V475-L477 HydrophobicContact CG2-CD2 4.41Å; V475-V490 WeakPolarHBondContact O-CA 3.37Å; V475-L491 HydrophobicContact CG2-CB 3.9Å; V475-L491 HydrophobicContact CG2-CD2 4.11Å; V475-L491 PolarHBondContact N-O 3.27Å; V475-L491 PolarHBondContact O-N 2.87Å; V475-T546 WeakPolarHBondContact CG1-OG1 3.48Å; V475-V553 HydrophobicContact CG1-CG1 4.19Å; V475-V553 HydrophobicContact CG2-CB 4.44Å; V475-V553 HydrophobicContact CG2-CG1 3.77Å; V475-V553 HydrophobicContact CG2-CG2 3.76Å
476	T	92.3	Very high	84.4	Confident	28 Å²	28	45.2 Å²	45.2	17%	0.172	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	121.4	173	-54.1	0	0	0	0	109.3	L425 M426 L478 P487 S548	L425-T476 WeakPolarHBondContact CD1-OG1 3.22Å; M426-T476 PolarHBondContact O-OG1 2.73Å; T476-L478 HydrophobicContact CG2-CD2 4.34Å; T476-P487 HydrophobicContact CG2-CB 3.61Å; T476-P487 HydrophobicContact CG2-CG 4.09Å; T476-S548 VanDerWaalsContact O-CB 3.28Å; T476-S548 WeakPolarHBondContact O-CB 3.3Å; T476-S548 PolarHBondContact O-OG 3.04Å
477	L	91.4	Very high	84.5	Confident	22 Å²	22	46.1 Å²	46.1	12%	0.115	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	125.3	170.3	-58.3	-177.8	0	0	0	109.1	V475 A488 A489 L491 I516 V553 W576	V475-L477 HydrophobicContact CG2-CD2 4.41Å; L477-A488 PolarHBondContact O-N 3.32Å; L477-A489 HydrophobicContact CB-CB 4.46Å; L477-A489 HydrophobicContact CD1-CB 4.45Å; L477-A489 PolarHBondContact N-O 2.84Å; L477-A489 PolarHBondContact O-N 3.03Å; L477-L491 HydrophobicContact CD1-CB 4.05Å; L477-L491 HydrophobicContact CD1-CD1 4.22Å; L477-L491 HydrophobicContact CD2-CB 4.18Å; L477-L491 HydrophobicContact CD2-CD1 4.32Å; L477-L491 HydrophobicContact CG-CB 4Å; L477-I516 HydrophobicContact CD1-CD1 4.22Å; L477-V553 HydrophobicContact CD2-CG2 3.63Å; L477-W576 HydrophobicContact CD1-CG 4.22Å
478	L	86.4	Confident	84.6	Confident	33 Å²	33	46.3 Å²	46.3	17%	0.173	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	140.7	179.6	-59.2	171.1	0	0	0	109.7	M267 T476 P485 K486 P487 L550	M267-L478 HydrophobicContact SD-CD1 4.46Å; T476-L478 HydrophobicContact CG2-CD2 4.34Å; L478-P485 HydrophobicContact CB-CB 4.19Å; L478-P485 HydrophobicContact CD1-CB 4.21Å; L478-K486 CarbonylContact C-O 3.59Å; L478-K486 WeakPolarHBondContact CA-O 3.36Å; L478-P487 HydrophobicContact CD2-CG 4.44Å; L478-L550 HydrophobicContact CB-CD2 4.16Å; L478-L550 HydrophobicContact CD1-CD2 3.86Å
479	S	81.9	Confident	84.9	Confident	20 Å²	20	46 Å²	46	14%	0.14	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	133.8	167.2	166.7	0	0	0	0	109.3	D481 K486	S479-D481 VanDerWaalsContact C-N 3.33Å; S479-D481 WeakPolarHBondContact OG-CB 3.27Å; S479-D481 PolarHBondContact OG-N 2.82Å; S479-D481 PolarHBondContact OG-OD2 3.47Å; S479-K486 PolarHBondContact N-O 2.78Å
480	S	72.6	Confident	85.2	Confident	86 Å²	86	45.9 Å²	45.9	60%	0.601	26%	0.261	S	S	*	.	S	Bend	trans	-85.5	-1.8	172.1	56.9	0	0	0	0	113.6	D482	S480-D482 VanDerWaalsContact C-N 3.35Å
481	D	71.2	Confident	85.3	Confident	136 Å²	136	46 Å²	46	73%	0.727	26%	0.261	S	S	*	.	S	Bend	trans	-79	-22.2	-171.8	-55.2	-45.9	0	0	0	112.6	S479	S479-D481 VanDerWaalsContact C-N 3.33Å; S479-D481 WeakPolarHBondContact OG-CB 3.27Å; S479-D481 PolarHBondContact OG-N 2.82Å; S479-D481 PolarHBondContact OG-OD2 3.47Å
482	D	67.4	Low	85.4	Confident	73 Å²	73	45.2 Å²	45.2	39%	0.39	26%	0.258	S	S	.	.	S	Bend	trans	-94.8	152.2	179.8	-80.4	-45.5	0	0	0	111.6	S480 E484 K486	S480-D482 VanDerWaalsContact C-N 3.35Å; D482-E484 WeakPolarHBondContact CB-O 3.22Å; D482-E484 PolarHBondContact O-N 3.12Å; D482-K486 VanDerWaalsContact CG-NZ 3.25Å; D482-K486 IonicContact OD1-NZ 2.71Å; D482-K486 PolarHBondContact OD1-NZ 2.81Å; D482-K486 VanDerWaalsContact OD2-CD 3.29Å; D482-K486 WeakPolarHBondContact OD2-CD 3.29Å; D482-K486 WeakPolarHBondContact OD2-CE 3.45Å; D482-K486 IonicContact OD2-NZ 3.22Å; D482-K486 PolarHBondContact OD2-NZ 2.96Å
483	V	67.7	Low	85.4	Confident	158 Å²	158	45 Å²	45	96%	0.958	25%	0.254	S	S	*	.	S	Bend	trans	-58.2	-32.7	175.9	179.3	0	0	0	0	112
484	E	70.4	Confident	85.3	Confident	146 Å²	146	44.5 Å²	44.5	68%	0.682	25%	0.251	S	S	*	.	S	Bend	trans	-113.5	132.9	169.3	-71.2	-179.4	179.9	0	0	108.9	D482 K486	D482-E484 WeakPolarHBondContact CB-O 3.22Å; D482-E484 PolarHBondContact O-N 3.12Å; E484-K486 PolarHBondContact O-N 3.02Å; E484-K486 VanDerWaalsContact O-N 3.13Å
485	P	75.5	Confident	85.2	Confident	54 Å²	54	43.4 Å²	43.4	35%	0.351	24%	0.242	S	C	.	.			trans	-63.3	118	-178.6	25.1	-33.1	0	0	0	110.6	L478 L550	L478-P485 HydrophobicContact CB-CB 4.19Å; L478-P485 HydrophobicContact CD1-CB 4.21Å; P485-L550 HydrophobicContact CB-CD2 3.55Å; P485-L550 HydrophobicContact CG-CD2 4.1Å
486	K	82.1	Confident	84.9	Confident	105 Å²	105	45 Å²	45	46%	0.457	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	145.4	176.6	-65.7	-167.6	-162.4	124.1	0	111.7	L478 S479 D482 E484 A488	L478-K486 CarbonylContact C-O 3.59Å; L478-K486 WeakPolarHBondContact CA-O 3.36Å; S479-K486 PolarHBondContact N-O 2.78Å; D482-K486 VanDerWaalsContact CG-NZ 3.25Å; D482-K486 IonicContact OD1-NZ 2.71Å; D482-K486 PolarHBondContact OD1-NZ 2.81Å; D482-K486 VanDerWaalsContact OD2-CD 3.29Å; D482-K486 WeakPolarHBondContact OD2-CD 3.29Å; D482-K486 WeakPolarHBondContact OD2-CE 3.45Å; D482-K486 IonicContact OD2-NZ 3.22Å; D482-K486 PolarHBondContact OD2-NZ 2.96Å; E484-K486 PolarHBondContact O-N 3.02Å; E484-K486 VanDerWaalsContact O-N 3.13Å; K486-A488 PolarHBondContact O-N 3.09Å; K486-A488 VanDerWaalsContact O-N 3.15Å
487	P	87.4	Confident	84.3	Confident	24 Å²	24	44 Å²	44	16%	0.156	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	117.3	168.3	-25	34.3	0	0	0	111.6	Y369 V427 T476 L478 L519	Y369-P487 HydrophobicContact CE2-CG 3.7Å; Y369-P487 VanDerWaalsContact OH-CD 3.26Å; Y369-P487 WeakPolarHBondContact OH-CD 3.04Å; Y369-P487 WeakPolarHBondContact OH-CG 3.23Å; V427-P487 WeakPolarHBondContact O-CB 3.49Å; V427-P487 WeakPolarHBondContact O-CG 3.15Å; T476-P487 HydrophobicContact CG2-CB 3.61Å; T476-P487 HydrophobicContact CG2-CG 4.09Å; L478-P487 HydrophobicContact CD2-CG 4.44Å; P487-L519 HydrophobicContact CB-CD1 3.51Å
488	A	89.1	Confident	83.3	Confident	7 Å²	7	46.2 Å²	46.2	6%	0.058	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	-43.7	177.7	0	0	0	0	0	111.6	L477 K486 L519	L477-A488 PolarHBondContact O-N 3.32Å; K486-A488 PolarHBondContact O-N 3.09Å; K486-A488 VanDerWaalsContact O-N 3.15Å; A488-L519 WeakPolarHBondContact O-CB 3.46Å; A488-L519 PolarHBondContact O-N 2.76Å; A488-L519 VanDerWaalsContact O-N 3.13Å
489	A	93.5	Very high	82	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	166.3	-177.2	0	0	0	0	0	111.1	L477 I516 Y517 W576	L477-A489 HydrophobicContact CB-CB 4.46Å; L477-A489 HydrophobicContact CD1-CB 4.45Å; L477-A489 PolarHBondContact N-O 2.84Å; L477-A489 PolarHBondContact O-N 3.03Å; A489-I516 HydrophobicContact CB-CG2 3.81Å; A489-Y517 CarbonylContact C-O 3.53Å; A489-Y517 VanDerWaalsContact CA-O 3.22Å; A489-Y517 WeakPolarHBondContact CA-O 3.03Å; A489-Y517 WeakPolarHBondContact CB-O 3.24Å; A489-W576 HydrophobicContact CB-CZ2 4.05Å
490	V	94.8	Very high	80.7	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	129.3	170	176.7	0	0	0	0	109.2	L425 V427 L433 V475 I492 I516 Y517 L519	L425-V490 HydrophobicContact CD1-CG1 4.24Å; L425-V490 HydrophobicContact CD1-CG2 3.82Å; L425-V490 HydrophobicContact CD2-CG1 3.82Å; L425-V490 HydrophobicContact CG-CG1 4.38Å; V427-V490 HydrophobicContact CG1-CG2 3.56Å; L433-V490 HydrophobicContact CD2-CB 3.97Å; L433-V490 HydrophobicContact CD2-CG1 3.76Å; L433-V490 HydrophobicContact CD2-CG2 3.93Å; V475-V490 WeakPolarHBondContact O-CA 3.37Å; V490-I492 HydrophobicContact CG1-CG1 4.12Å; V490-I516 CarbonylContact O-C 3.57Å; V490-I516 WeakPolarHBondContact O-CA 3.43Å; V490-Y517 PolarHBondContact N-O 3.26Å; V490-Y517 PolarHBondContact O-N 2.87Å; V490-L519 HydrophobicContact CG2-CD1 4.33Å; V490-L519 HydrophobicContact CG2-CD2 4.18Å; V490-L519 HydrophobicContact CG2-CG 4.4Å
491	L	95.3	Very high	80.1	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.026	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	129.1	174.4	-177	151.7	0	0	0	109.7	A474 V475 L477 V514 V515 I516 L572	A474-L491 CarbonylContact C-O 3.53Å; A474-L491 VanDerWaalsContact CA-O 3.27Å; A474-L491 WeakPolarHBondContact CA-O 3.13Å; V475-L491 HydrophobicContact CG2-CB 3.9Å; V475-L491 HydrophobicContact CG2-CD2 4.11Å; V475-L491 PolarHBondContact N-O 3.27Å; V475-L491 PolarHBondContact O-N 2.87Å; L477-L491 HydrophobicContact CD1-CB 4.05Å; L477-L491 HydrophobicContact CD1-CD1 4.22Å; L477-L491 HydrophobicContact CD2-CB 4.18Å; L477-L491 HydrophobicContact CD2-CD1 4.32Å; L477-L491 HydrophobicContact CG-CB 4Å; L491-V514 HydrophobicContact CD1-CG1 3.51Å; L491-V514 HydrophobicContact CD2-CG1 4.08Å; L491-V514 HydrophobicContact CG-CG1 3.49Å; L491-V514 VanDerWaalsContact CG-CG1 3.49Å; L491-V515 CarbonylContact C-O 3.52Å; L491-V515 WeakPolarHBondContact CA-O 3.43Å; L491-I516 HydrophobicContact CB-CD1 3.86Å; L491-I516 HydrophobicContact CD1-CD1 3.89Å; L491-I516 HydrophobicContact CG-CD1 3.84Å; L491-L572 HydrophobicContact CD1-CD2 3.57Å
492	I	95.3	Very high	79.8	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	124.7	174.9	-54.7	179.9	0	0	0	108.3	F435 A472 S473 A474 V490 V515 W524	F435-I492 HydrophobicContact CB-CD1 3.89Å; F435-I492 HydrophobicContact CD1-CD1 3.5Å; F435-I492 VanDerWaalsContact CD1-CD1 3.5Å; F435-I492 HydrophobicContact CD1-CG2 3.98Å; F435-I492 HydrophobicContact CE1-CD1 4.2Å; F435-I492 HydrophobicContact CE1-CG2 4.07Å; F435-I492 HydrophobicContact CG-CD1 3.78Å; A472-I492 HydrophobicContact CB-CG2 3.8Å; S473-I492 WeakPolarHBondContact O-CA 3.32Å; A474-I492 HydrophobicContact CB-CG1 4.16Å; V490-I492 HydrophobicContact CG1-CG1 4.12Å; I492-V515 HydrophobicContact CB-CB 4.14Å; I492-V515 PolarHBondContact N-O 2.66Å; I492-V515 PolarHBondContact O-N 2.72Å; I492-W524 HydrophobicContact CD1-CH2 4Å; I492-W524 HydrophobicContact CD1-CZ3 3.97Å
493	Y	94.9	Very high	79.6	Confident	4 Å²	4	42 Å²	42	2%	0.016	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	150.4	-176.8	-178.9	-102.7	0	0	0	112	W243 S473 P511 E513 V514 P538 M555	W243-Y493 HydrophobicContact CH2-CD1 4.16Å; W243-Y493 HydrophobicContact CH2-CE1 4.26Å; W243-Y493 HydrophobicContact CH2-CG 4.48Å; W243-Y493 AromaticContact CZ2-CD1 3.89Å; W243-Y493 HydrophobicContact CZ2-CD1 3.89Å; W243-Y493 AromaticContact CZ2-CD2 3.93Å; W243-Y493 HydrophobicContact CZ2-CD2 3.93Å; W243-Y493 AromaticContact CZ2-CE1 3.84Å; W243-Y493 HydrophobicContact CZ2-CE1 3.84Å; W243-Y493 AromaticContact CZ2-CE2 3.88Å; W243-Y493 HydrophobicContact CZ2-CE2 3.88Å; W243-Y493 AromaticContact CZ2-CG 3.94Å; W243-Y493 HydrophobicContact CZ2-CG 3.94Å; W243-Y493 AromaticContact CZ2-CZ 3.84Å; S473-Y493 PolarHBondContact N-O 3.06Å; S473-Y493 PolarHBondContact O-N 2.86Å; Y493-P511 WeakPolarHBondContact CE2-O 3.43Å; Y493-P511 PolarHBondContact OH-O 3.29Å; Y493-E513 WeakPolarHBondContact CD2-O 3.23Å; Y493-V514 HydrophobicContact CD2-CG2 4.09Å; Y493-P538 HydrophobicContact CE1-CG 4.49Å; Y493-P538 WeakPolarHBondContact OH-CG 3.25Å; Y493-M555 HydrophobicContact CD1-SD 3.67Å; Y493-M555 HydrophobicContact CE1-CE 3.97Å; Y493-M555 HydrophobicContact CE1-SD 3.62Å
494	G	93.4	Very high	79.3	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.01	20%	0.204	C	C	.	.			trans	68.3	-147.8	176.2	0	0	0	0	0	113.1	R469 R541	R469-G494 WeakPolarHBondContact CD-O 3.25Å; G494-R541 CarbonylContact C-O 3.57Å; G494-R541 WeakPolarHBondContact CA-O 3.46Å
495	G	92.8	Very high	78.8	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.201	C	C	.	.			trans	99.1	168.7	-175.3	0	0	0	0	0	112.8	M470 L509 Q540 R541	M470-G495 CarbonylContact O-C 3.58Å; M470-G495 WeakPolarHBondContact O-CA 3.21Å; G495-L509 WeakPolarHBondContact O-CD1 3.42Å; G495-Q540 PolarHBondContact O-NE2 2.79Å; G495-R541 PolarHBondContact N-O 2.86Å
496	R	87.9	Confident	78	Confident	41 Å²	41	35.7 Å²	35.7	16%	0.155	20%	0.203	C	C	.	.	B	Isolated β-bridge	trans	-109.9	147.6	178.6	-173.1	173.4	-104.4	159.7	-6.1	110.9	M470 E559 A560	M470-R496 HydrophobicContact CG-CB 4.26Å; M470-R496 PolarHBondContact N-O 2.93Å; M470-R496 VanDerWaalsContact N-O 3.14Å; M470-R496 PolarHBondContact O-N 2.98Å; R496-E559 IonicContact CZ-OE1 3.13Å; R496-E559 IonicContact NH1-OE1 3.69Å; R496-E559 PolarHBondContact NH1-OE1 2.68Å; R496-E559 IonicContact NH1-OE2 2.68Å; R496-E559 IonicContact NH2-OE1 3.73Å; R496-E559 PolarHBondContact NH2-OE1 3.36Å; R496-A560 PolarHBondContact NH2-O 2.6Å
497	R	79.6	Confident	77.1	Confident	9 Å²	9	34 Å²	34	3%	0.034	20%	0.203	C	C	.	.			trans	-129.4	135.9	173	-169	178.3	-174.8	171.2	5.9	109.4	P445 H502 S506 Y561 N589	P445-R497 HydrophobicContact CG-CG 4.31Å; R497-H502 PolarHBondContact NE-CD2 2.81Å; R497-H502 PolarHBondContact NE-NE2 2.64Å; R497-H502 PolarHBondContact NH2-CE1 2.74Å; R497-H502 PolarHBondContact NH2-ND1 3.5Å; R497-H502 VanDerWaalsContact NH2-ND1 3.15Å; R497-H502 PolarHBondContact NH2-NE2 2.8Å; R497-S506 PolarHBondContact NH1-O 2.91Å; R497-Y561 PolarHBondContact N-OH 3.1Å; R497-N589 PolarHBondContact NH2-OD1 2.92Å
498	Y	71.1	Confident	76.2	Confident	67 Å²	67	37.3 Å²	37.3	26%	0.263	22%	0.217	S	C	.	.			trans	-85.7	116.2	172.4	-66.1	-66.3	0	0	0	109.9	M470 S500 H502	M470-Y498 HydrophobicContact SD-CD2 4.38Å; M470-Y498 HydrophobicContact SD-CE2 3.54Å; M470-Y498 VanDerWaalsContact SD-CE2 3.54Å; Y498-S500 VanDerWaalsContact C-N 3.3Å; Y498-S500 PolarHBondContact O-N 3.17Å; Y498-H502 PolarHBondContact O-CD2 2.86Å; Y498-H502 VanDerWaalsContact O-CD2 3.25Å
499	T	58.4	Low	75.8	Confident	83 Å²	83	37.4 Å²	37.4	51%	0.509	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-65.2	-34.4	-179.7	54.6	0	0	0	0	112.4	Q501 H502 P507	T499-Q501 PolarHBondContact O-N 2.8Å; T499-H502 PolarHBondContact O-N 3.11Å; T499-H502 VanDerWaalsContact O-N 3.11Å; T499-P507 HydrophobicContact CG2-CB 3.82Å
500	S	53.5	Low	75.3	Confident	50 Å²	50	42.2 Å²	42.2	35%	0.35	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-56.9	-19.5	-174.7	57	0	0	0	0	115.3	Y498 D659	Y498-S500 VanDerWaalsContact C-N 3.3Å; Y498-S500 PolarHBondContact O-N 3.17Å; S500-D659 VanDerWaalsContact CB-OD2 3.31Å; S500-D659 WeakPolarHBondContact CB-OD2 3.45Å; S500-D659 PolarHBondContact OG-OD2 3.48Å
501	Q	61.6	Low	74.8	Confident	5 Å²	5	44.2 Å²	44.2	2%	0.023	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-97.5	-15.7	-177.9	-63.9	178.8	21.1	0	0	113.3	C444 T499 N591 L592 A656	C444-Q501 VanDerWaalsContact O-CD 3.31Å; C444-Q501 PolarHBondContact O-NE2 2.84Å; C444-Q501 PolarHBondContact O-OE1 2.83Å; T499-Q501 PolarHBondContact O-N 2.8Å; Q501-N591 CarbonylContact O-C 3.38Å; Q501-N591 WeakPolarHBondContact O-CA 3.44Å; Q501-N591 WeakPolarHBondContact O-CB 3.48Å; Q501-L592 PolarHBondContact O-N 3.2Å; Q501-A656 PolarHBondContact NE2-O 3Å
502	H	64	Low	74.5	Confident	30 Å²	30	44.9 Å²	44.9	14%	0.139	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	136	-168.4	-68.8	-67.7	0	0	0	113.7	R497 Y498 T499	R497-H502 PolarHBondContact NE-CD2 2.81Å; R497-H502 PolarHBondContact NE-NE2 2.64Å; R497-H502 PolarHBondContact NH2-CE1 2.74Å; R497-H502 PolarHBondContact NH2-ND1 3.5Å; R497-H502 VanDerWaalsContact NH2-ND1 3.15Å; R497-H502 PolarHBondContact NH2-NE2 2.8Å; Y498-H502 PolarHBondContact O-CD2 2.86Å; Y498-H502 VanDerWaalsContact O-CD2 3.25Å; T499-H502 PolarHBondContact O-N 3.11Å; T499-H502 VanDerWaalsContact O-N 3.11Å
503	L	63.3	Low	74.2	Confident	91 Å²	91	45.5 Å²	45.5	48%	0.476	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-31.1	177.4	-74.7	157.9	0	0	0	112	F590 L592 L595	L503-F590 HydrophobicContact CB-CD1 4.01Å; L503-F590 HydrophobicContact CD1-CD1 3.89Å; L503-F590 HydrophobicContact CD1-CE1 3.8Å; L503-F590 PolarHBondContact N-O 3.11Å; L503-L592 HydrophobicContact CD1-CD1 4.32Å; L503-L595 HydrophobicContact CD1-CB 3.86Å; L503-L595 HydrophobicContact CD1-CD2 3.64Å; L503-L595 HydrophobicContact CD1-CG 4.34Å
504	L	62.2	Low	74.1	Confident	111 Å²	111	45.3 Å²	45.3	58%	0.581	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.3	138.9	176.4	-67.2	169.1	0	0	0	110.2	F590	L504-F590 HydrophobicContact CB-CB 4.18Å; L504-F590 HydrophobicContact CD1-CB 4.09Å; L504-F590 HydrophobicContact CG-CB 4.46Å; L504-F590 PolarHBondContact N-O 2.66Å
505	G	58.8	Low	74.1	Confident	59 Å²	59	45.3 Å²	45.3	61%	0.608	26%	0.258	S	S	*	.	S	Bend	trans	112.2	167	-177.3	0	0	0	0	0	113.3
506	S	59	Low	74.1	Confident	57 Å²	57	45.3 Å²	45.3	40%	0.399	26%	0.258	S	S	.	.			trans	-65.2	132	175.5	-173.8	0	0	0	0	110.2	R497 M508	R497-S506 PolarHBondContact NH1-O 2.91Å; S506-M508 WeakPolarHBondContact CB-O 3.3Å; S506-M508 PolarHBondContact O-N 2.74Å; S506-M508 PolarHBondContact OG-O 3.31Å
507	P	62.6	Low	74.4	Confident	69 Å²	69	43.7 Å²	43.7	45%	0.448	25%	0.251	S	S	.	.	S	Bend	trans	-66.1	-24.8	178	26.3	-33.4	0	0	0	112.3	T499	T499-P507 HydrophobicContact CG2-CB 3.82Å
508	M	68.8	Low	75	Confident	94 Å²	94	44.8 Å²	44.8	46%	0.463	26%	0.258	S	S	.	.	S	Bend	trans	-120	153.4	-176.2	-55.9	-172.7	94	0	0	110.3	S506 Y561	S506-M508 WeakPolarHBondContact CB-O 3.3Å; S506-M508 PolarHBondContact O-N 2.74Å; S506-M508 PolarHBondContact OG-O 3.31Å; M508-Y561 HydrophobicContact CE-CD1 3.5Å; M508-Y561 VanDerWaalsContact CE-CD1 3.5Å; M508-Y561 HydrophobicContact CE-CD2 4.49Å; M508-Y561 HydrophobicContact CE-CE1 3.93Å; M508-Y561 HydrophobicContact CE-CG 3.77Å
509	L	80.6	Confident	76	Confident	9 Å²	9	43.2 Å²	43.2	5%	0.047	25%	0.254	C	S	.	.			trans	-76.2	139.5	169.7	-65.9	166	0	0	0	108	R469 G495	R469-L509 HydrophobicContact CB-CD1 4.16Å; G495-L509 WeakPolarHBondContact O-CD1 3.42Å
510	E	82.8	Confident	77.5	Confident	100 Å²	100	45.1 Å²	45.1	47%	0.467	27%	0.266	S	S	.	.			trans	-69.6	135.3	175.4	-63.6	-66.2	160.4	0	0	109.7	D512 E513	E510-D512 PolarHBondContact O-N 2.95Å; E510-E513 HydrophobicContact CB-CB 4.12Å; E510-E513 VanDerWaalsContact O-CB 3.31Å; E510-E513 WeakPolarHBondContact O-CB 3.42Å; E510-E513 PolarHBondContact O-N 2.98Å
511	P	84.7	Confident	79.1	Confident	43 Å²	43	45 Å²	45	28%	0.279	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-23.2	-174.1	25.9	-34.4	0	0	0	114	Y493 L537	Y493-P511 WeakPolarHBondContact CE2-O 3.43Å; Y493-P511 PolarHBondContact OH-O 3.29Å; P511-L537 HydrophobicContact CB-CD1 4.47Å; P511-L537 HydrophobicContact CG-CD1 4.23Å
512	D	88.2	Confident	80.4	Confident	18 Å²	18	50.6 Å²	50.6	10%	0.096	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-1.2	175.6	67.2	-61.3	0	0	0	113.7	E510 V514 S528 S529 K530 L537 N582	E510-D512 PolarHBondContact O-N 2.95Å; D512-V514 PolarHBondContact O-N 2.86Å; D512-S528 WeakPolarHBondContact O-CA 3.42Å; D512-S528 WeakPolarHBondContact OD2-CB 3.26Å; D512-S528 PolarHBondContact OD2-OG 3.09Å; D512-S529 WeakPolarHBondContact CA-OG 3.31Å; D512-S529 PolarHBondContact O-N 3.08Å; D512-S529 PolarHBondContact O-OG 2.78Å; D512-K530 HydrophobicContact CB-CB 4.06Å; D512-L537 HydrophobicContact CB-CD1 3.85Å; D512-L537 HydrophobicContact CB-CD2 4.08Å; D512-N582 PolarHBondContact OD2-ND2 2.91Å
513	E	89.6	Confident	81.7	Confident	15 Å²	15	51.9 Å²	51.9	7%	0.07	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	118	-177.8	-169.5	-171.6	101.6	0	0	111.2	R469 Y493 E510 I526	R469-E513 IonicContact CZ-OE1 3.68Å; R469-E513 IonicContact NH1-OE1 2.66Å; R469-E513 PolarHBondContact NH1-OE1 2.7Å; R469-E513 IonicContact NH2-OE1 3.95Å; R469-E513 PolarHBondContact NH2-OE1 2.96Å; Y493-E513 WeakPolarHBondContact CD2-O 3.23Å; E510-E513 HydrophobicContact CB-CB 4.12Å; E510-E513 VanDerWaalsContact O-CB 3.31Å; E510-E513 WeakPolarHBondContact O-CB 3.42Å; E510-E513 PolarHBondContact O-N 2.98Å; E513-I526 HydrophobicContact CG-CG2 3.46Å; E513-I526 VanDerWaalsContact CG-CG2 3.46Å
514	V	92.8	Very high	83.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	122.9	172.5	-177.9	0	0	0	0	108.9	L241 L491 Y493 D512 I516 R527 L572	L241-V514 HydrophobicContact CD1-CB 4.38Å; L241-V514 HydrophobicContact CD1-CG1 4.13Å; L491-V514 HydrophobicContact CD1-CG1 3.51Å; L491-V514 HydrophobicContact CD2-CG1 4.08Å; L491-V514 HydrophobicContact CG-CG1 3.49Å; L491-V514 VanDerWaalsContact CG-CG1 3.49Å; Y493-V514 HydrophobicContact CD2-CG2 4.09Å; D512-V514 PolarHBondContact O-N 2.86Å; V514-I516 HydrophobicContact CG1-CD1 3.78Å; V514-I516 HydrophobicContact CG1-CG1 4.38Å; V514-R527 PolarHBondContact N-O 2.8Å; V514-R527 PolarHBondContact O-N 2.87Å; V514-L572 HydrophobicContact CG2-CD2 4.48Å
515	V	93.4	Very high	84.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	126.2	179.2	175.8	0	0	0	0	108.8	P466 L491 I492 W524	P466-V515 HydrophobicContact CB-CB 4.4Å; P466-V515 HydrophobicContact CB-CG1 3.63Å; P466-V515 HydrophobicContact CB-CG2 3.89Å; P466-V515 HydrophobicContact CG-CG1 3.42Å; P466-V515 VanDerWaalsContact CG-CG1 3.42Å; L491-V515 CarbonylContact C-O 3.52Å; L491-V515 WeakPolarHBondContact CA-O 3.43Å; I492-V515 HydrophobicContact CB-CB 4.14Å; I492-V515 PolarHBondContact N-O 2.66Å; I492-V515 PolarHBondContact O-N 2.72Å; V515-W524 HydrophobicContact CG1-CE3 3.57Å; V515-W524 HydrophobicContact CG1-CZ3 3.58Å
516	I	93.9	Very high	85.9	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	129.6	179	-55.1	-62.5	0	0	0	110	L477 A489 V490 L491 V514 W524 S525 R527 W576	L477-I516 HydrophobicContact CD1-CD1 4.22Å; A489-I516 HydrophobicContact CB-CG2 3.81Å; V490-I516 CarbonylContact O-C 3.57Å; V490-I516 WeakPolarHBondContact O-CA 3.43Å; L491-I516 HydrophobicContact CB-CD1 3.86Å; L491-I516 HydrophobicContact CD1-CD1 3.89Å; L491-I516 HydrophobicContact CG-CD1 3.84Å; V514-I516 HydrophobicContact CG1-CD1 3.78Å; V514-I516 HydrophobicContact CG1-CG1 4.38Å; I516-W524 CarbonylContact O-C 3.58Å; I516-W524 WeakPolarHBondContact O-CA 3.47Å; I516-S525 PolarHBondContact N-O 3.31Å; I516-S525 PolarHBondContact O-N 3.18Å; I516-R527 HydrophobicContact CG1-CB 4.47Å; I516-R527 HydrophobicContact CG1-CG 3.84Å; I516-W576 HydrophobicContact CB-CE3 4.47Å; I516-W576 HydrophobicContact CD1-CB 4.13Å; I516-W576 HydrophobicContact CD1-CG 4.49Å; I516-W576 HydrophobicContact CG1-CB 4.16Å; I516-W576 HydrophobicContact CG1-CE3 4.47Å; I516-W576 HydrophobicContact CG2-CD2 3.95Å; I516-W576 HydrophobicContact CG2-CE3 3.81Å; I516-W576 HydrophobicContact CG2-CG 4.46Å; I516-W576 HydrophobicContact CG2-CH2 4.5Å; I516-W576 HydrophobicContact CG2-CZ3 4.1Å
517	Y	94.3	Very high	87.5	Confident	7 Å²	7	40.4 Å²	40.4	3%	0.027	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	111.1	164.7	-175.1	-113.8	0	0	0	109.6	L433 L462 A489 V490 L519 W524	L433-Y517 HydrophobicContact CD1-CD1 4.47Å; L433-Y517 HydrophobicContact CD2-CD1 4.44Å; L462-Y517 HydrophobicContact CD1-CE1 4.19Å; L462-Y517 HydrophobicContact CD1-CE2 4.14Å; L462-Y517 WeakPolarHBondContact CD2-OH 3.3Å; A489-Y517 CarbonylContact C-O 3.53Å; A489-Y517 VanDerWaalsContact CA-O 3.22Å; A489-Y517 WeakPolarHBondContact CA-O 3.03Å; A489-Y517 WeakPolarHBondContact CB-O 3.24Å; V490-Y517 PolarHBondContact N-O 3.26Å; V490-Y517 PolarHBondContact O-N 2.87Å; Y517-L519 HydrophobicContact CD1-CD2 3.82Å; Y517-L519 HydrophobicContact CE1-CD2 3.88Å; Y517-L519 PolarHBondContact O-N 3.04Å; Y517-W524 AromaticContact CD2-CD2 3.61Å; Y517-W524 HydrophobicContact CD2-CD2 3.61Å; Y517-W524 AromaticContact CD2-CE2 3.46Å; Y517-W524 VanDerWaalsContact CD2-CE2 3.46Å; Y517-W524 HydrophobicContact CD2-CE3 4.1Å; Y517-W524 AromaticContact CD2-CG 3.96Å; Y517-W524 HydrophobicContact CD2-CG 3.96Å; Y517-W524 HydrophobicContact CD2-CH2 4.3Å; Y517-W524 AromaticContact CD2-CZ2 3.81Å; Y517-W524 HydrophobicContact CD2-CZ2 3.81Å; Y517-W524 HydrophobicContact CD2-CZ3 4.44Å; Y517-W524 AromaticContact CD2-NE1 3.77Å; Y517-W524 HydrophobicContact CE2-CD2 4.5Å; Y517-W524 HydrophobicContact CE2-CZ2 4.45Å; Y517-W524 AromaticContact CE2-NE1 3.95Å; Y517-W524 HydrophobicContact CG-CD2 4.3Å; Y517-W524 HydrophobicContact CG-CE3 4.36Å; Y517-W524 HydrophobicContact CG-CH2 4.22Å; Y517-W524 HydrophobicContact CG-CZ2 4.12Å; Y517-W524 HydrophobicContact CG-CZ3 4.35Å
518	D	92.5	Very high	88.7	Confident	33 Å²	33	37.6 Å²	37.6	18%	0.176	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	119.1	175.1	178.6	-4.3	0	0	0	109.5	V520 G521 K522 S523 W576	D518-V520 WeakPolarHBondContact OD1-CA 3.43Å; D518-V520 WeakPolarHBondContact OD1-CB 3.46Å; D518-V520 PolarHBondContact OD1-N 3.21Å; D518-G521 PolarHBondContact OD1-N 3.43Å; D518-G521 PolarHBondContact OD2-N 3.14Å; D518-K522 WeakPolarHBondContact O-CA 3.44Å; D518-K522 PolarHBondContact O-N 3.37Å; D518-S523 PolarHBondContact N-O 3.49Å; D518-S523 PolarHBondContact O-N 2.99Å; D518-W576 HydrophobicContact CB-CH2 4.32Å
519	L	91.6	Very high	89.7	Confident	33 Å²	33	33.1 Å²	33.1	17%	0.173	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-27.2	-178.7	-66.2	172.6	0	0	0	112.3	V427 P487 A488 V490 Y517	V427-L519 HydrophobicContact CB-CD1 4.06Å; V427-L519 HydrophobicContact CB-CD2 3.74Å; V427-L519 HydrophobicContact CG1-CD1 4.44Å; V427-L519 HydrophobicContact CG1-CD2 3.82Å; V427-L519 HydrophobicContact CG2-CD2 4.21Å; P487-L519 HydrophobicContact CB-CD1 3.51Å; A488-L519 WeakPolarHBondContact O-CB 3.46Å; A488-L519 PolarHBondContact O-N 2.76Å; A488-L519 VanDerWaalsContact O-N 3.13Å; V490-L519 HydrophobicContact CG2-CD1 4.33Å; V490-L519 HydrophobicContact CG2-CD2 4.18Å; V490-L519 HydrophobicContact CG2-CG 4.4Å; Y517-L519 HydrophobicContact CD1-CD2 3.82Å; Y517-L519 HydrophobicContact CE1-CD2 3.88Å; Y517-L519 PolarHBondContact O-N 3.04Å
520	V	88.7	Confident	89.8	Confident	124 Å²	124	39.9 Å²	39.9	75%	0.752	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-51.8	179.1	-177.4	0	0	0	0	109.8	D518 K522	D518-V520 WeakPolarHBondContact OD1-CA 3.43Å; D518-V520 WeakPolarHBondContact OD1-CB 3.46Å; D518-V520 PolarHBondContact OD1-N 3.21Å; V520-K522 VanDerWaalsContact C-N 3.29Å; V520-K522 PolarHBondContact O-N 2.95Å
521	G	87.7	Confident	89.6	Confident	46 Å²	46	38.9 Å²	38.9	47%	0.474	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-12.8	178.3	0	0	0	0	0	114.4	D518 S523	D518-G521 PolarHBondContact OD1-N 3.43Å; D518-G521 PolarHBondContact OD2-N 3.14Å; G521-S523 PolarHBondContact O-N 2.98Å
522	K	89.6	Confident	88.8	Confident	124 Å²	124	46.3 Å²	46.3	54%	0.539	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	50	40.8	-173.8	-61	-168.3	175.6	-168.6	0	112.9	D518 V520	D518-K522 WeakPolarHBondContact O-CA 3.44Å; D518-K522 PolarHBondContact O-N 3.37Å; V520-K522 VanDerWaalsContact C-N 3.29Å; V520-K522 PolarHBondContact O-N 2.95Å
523	S	90.9	Very high	87.6	Confident	57 Å²	57	52.2 Å²	52.2	40%	0.399	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	149.3	-172.9	75.1	0	0	0	0	112	D518 G521	D518-S523 PolarHBondContact N-O 3.49Å; D518-S523 PolarHBondContact O-N 2.99Å; G521-S523 PolarHBondContact O-N 2.98Å
524	W	91.7	Very high	86.5	Confident	18 Å²	18	53.2 Å²	53.2	7%	0.068	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	143.3	175.3	-67.9	100.1	0	0	0	110.6	A449 L462 P463 C465 P466 I492 V515 I516 Y517	A449-W524 HydrophobicContact CB-CH2 4.23Å; A449-W524 HydrophobicContact CB-CZ2 3.49Å; A449-W524 VanDerWaalsContact CB-CZ2 3.49Å; L462-W524 HydrophobicContact CD1-CZ2 4.27Å; P463-W524 PolarHBondContact O-NE1 3.34Å; P463-W524 VanDerWaalsContact O-NE1 3.14Å; C465-W524 HydrophobicContact CB-CB 3.45Å; C465-W524 VanDerWaalsContact CB-CB 3.45Å; C465-W524 HydrophobicContact CB-CG 3.71Å; C465-W524 VanDerWaalsContact SG-CB 3.5Å; P466-W524 HydrophobicContact CG-CD2 3.86Å; P466-W524 HydrophobicContact CG-CE3 3.5Å; P466-W524 VanDerWaalsContact CG-CE3 3.5Å; P466-W524 HydrophobicContact CG-CH2 4.3Å; P466-W524 HydrophobicContact CG-CZ3 3.71Å; I492-W524 HydrophobicContact CD1-CH2 4Å; I492-W524 HydrophobicContact CD1-CZ3 3.97Å; V515-W524 HydrophobicContact CG1-CE3 3.57Å; V515-W524 HydrophobicContact CG1-CZ3 3.58Å; I516-W524 CarbonylContact O-C 3.58Å; I516-W524 WeakPolarHBondContact O-CA 3.47Å; Y517-W524 AromaticContact CD2-CD2 3.61Å; Y517-W524 HydrophobicContact CD2-CD2 3.61Å; Y517-W524 AromaticContact CD2-CE2 3.46Å; Y517-W524 VanDerWaalsContact CD2-CE2 3.46Å; Y517-W524 HydrophobicContact CD2-CE3 4.1Å; Y517-W524 AromaticContact CD2-CG 3.96Å; Y517-W524 HydrophobicContact CD2-CG 3.96Å; Y517-W524 HydrophobicContact CD2-CH2 4.3Å; Y517-W524 AromaticContact CD2-CZ2 3.81Å; Y517-W524 HydrophobicContact CD2-CZ2 3.81Å; Y517-W524 HydrophobicContact CD2-CZ3 4.44Å; Y517-W524 AromaticContact CD2-NE1 3.77Å; Y517-W524 HydrophobicContact CE2-CD2 4.5Å; Y517-W524 HydrophobicContact CE2-CZ2 4.45Å; Y517-W524 AromaticContact CE2-NE1 3.95Å; Y517-W524 HydrophobicContact CG-CD2 4.3Å; Y517-W524 HydrophobicContact CG-CE3 4.36Å; Y517-W524 HydrophobicContact CG-CH2 4.22Å; Y517-W524 HydrophobicContact CG-CZ2 4.12Å; Y517-W524 HydrophobicContact CG-CZ3 4.35Å
525	S	90.5	Very high	85.1	Confident	16 Å²	16	57.4 Å²	57.4	11%	0.112	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	140.6	166.1	65.5	0	0	0	0	110.5	I516 R527	I516-S525 PolarHBondContact N-O 3.31Å; I516-S525 PolarHBondContact O-N 3.18Å; S525-R527 PolarHBondContact OG-NE 3.24Å
526	I	90.7	Very high	84.6	Confident	2 Å²	2	59 Å²	59	1%	0.01	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	116.1	174.4	-58.1	176.6	0	0	0	106.9	E513 T581 N582	E513-I526 HydrophobicContact CG-CG2 3.46Å; E513-I526 VanDerWaalsContact CG-CG2 3.46Å; I526-T581 CarbonylContact O-C 3.49Å; I526-T581 VanDerWaalsContact O-CA 3.31Å; I526-T581 WeakPolarHBondContact O-CA 3.38Å; I526-T581 WeakPolarHBondContact O-CG2 3.49Å; I526-N582 HydrophobicContact CG2-CB 4.39Å; I526-N582 PolarHBondContact O-N 3.31Å
527	R	91.2	Very high	84.5	Confident	41 Å²	41	61.7 Å²	61.7	16%	0.155	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	150	-174.6	-59.2	-63.1	176.3	156	0.2	110.3	V514 I516 S525 S579 A580 T581	V514-R527 PolarHBondContact N-O 2.8Å; V514-R527 PolarHBondContact O-N 2.87Å; I516-R527 HydrophobicContact CG1-CB 4.47Å; I516-R527 HydrophobicContact CG1-CG 3.84Å; S525-R527 PolarHBondContact OG-NE 3.24Å; R527-S579 WeakPolarHBondContact CD-O 3.42Å; R527-S579 PolarHBondContact NH1-O 3.15Å; R527-A580 WeakPolarHBondContact CA-O 3.36Å; R527-T581 PolarHBondContact NH1-OG1 2.96Å; R527-T581 VanDerWaalsContact NH1-OG1 3.08Å
528	S	89.3	Confident	84.4	Confident	9 Å²	9	61.4 Å²	61.4	6%	0.063	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	136.5	168.9	-175.1	0	0	0	0	110.5	D512 K530 S579 A580 N582	D512-S528 WeakPolarHBondContact O-CA 3.42Å; D512-S528 WeakPolarHBondContact OD2-CB 3.26Å; D512-S528 PolarHBondContact OD2-OG 3.09Å; S528-K530 VanDerWaalsContact C-N 3.34Å; S528-K530 WeakPolarHBondContact OG-CB 3.46Å; S528-K530 PolarHBondContact OG-N 3.29Å; S528-S579 WeakPolarHBondContact O-CB 3.36Å; S528-S579 PolarHBondContact O-OG 2.94Å; S528-A580 PolarHBondContact N-O 2.93Å; S528-N582 WeakPolarHBondContact CB-ND2 3.35Å; S528-N582 WeakPolarHBondContact CB-OD1 3.46Å
529	S	89	Confident	84.3	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.348	C	S	.	.			trans	-94.4	12.1	164.8	67	0	0	0	0	113	L241 W243 D512 Y531	L241-S529 CarbonylContact O-C 3.53Å; L241-S529 VanDerWaalsContact O-CA 3.24Å; L241-S529 WeakPolarHBondContact O-CA 3.32Å; W243-S529 PolarHBondContact NE1-OG 3.13Å; W243-S529 VanDerWaalsContact NE1-OG 3.09Å; D512-S529 WeakPolarHBondContact CA-OG 3.31Å; D512-S529 PolarHBondContact O-N 3.08Å; D512-S529 PolarHBondContact O-OG 2.78Å; S529-Y531 PolarHBondContact O-N 2.65Å
530	K	82.9	Confident	84.3	Confident	152 Å²	152	63.2 Å²	63.2	66%	0.661	34%	0.344	S	S	*	.			trans	-78.8	112.3	178.1	-167.5	176.5	-178.4	177.6	0	108.7	D512 S528	D512-K530 HydrophobicContact CB-CB 4.06Å; S528-K530 VanDerWaalsContact C-N 3.34Å; S528-K530 WeakPolarHBondContact OG-CB 3.46Å; S528-K530 PolarHBondContact OG-N 3.29Å
531	Y	77.8	Confident	84.6	Confident	78 Å²	78	57.4 Å²	57.4	31%	0.306	31%	0.309	S	S	.	.			trans	-117.5	137.6	178.4	-172.4	-110.4	0	0	0	109.9	V239 S240 H242 S529 D533 S534	V239-Y531 HydrophobicContact CG1-CD2 4.27Å; V239-Y531 HydrophobicContact CG1-CE1 4.25Å; V239-Y531 HydrophobicContact CG1-CE2 3.65Å; S240-Y531 VanDerWaalsContact OG-CD2 3.3Å; S240-Y531 WeakPolarHBondContact OG-CD2 3.43Å; H242-Y531 HydrophobicContact CB-CD1 4.27Å; H242-Y531 HydrophobicContact CB-CG 4.04Å; S529-Y531 PolarHBondContact O-N 2.65Å; Y531-D533 HydrophobicContact CD1-CB 4.06Å; Y531-D533 HydrophobicContact CE1-CB 3.84Å; Y531-D533 PolarHBondContact O-N 2.76Å; Y531-S534 WeakPolarHBondContact O-CB 3.46Å; Y531-S534 PolarHBondContact O-N 2.76Å; Y531-S534 PolarHBondContact O-OG 2.89Å
532	E	68.1	Low	84.9	Confident	199 Å²	199	55.2 Å²	55.2	93%	0.93	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-35.4	-171.8	-69.9	-178.7	168.9	0	0	112.8
533	D	64.6	Low	85.2	Confident	142 Å²	142	49.6 Å²	49.6	76%	0.759	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	12.8	179.6	-70.3	-28.4	0	0	0	114.4	Y531	Y531-D533 HydrophobicContact CD1-CB 4.06Å; Y531-D533 HydrophobicContact CE1-CB 3.84Å; Y531-D533 PolarHBondContact O-N 2.76Å
534	S	64.9	Low	85.5	Confident	36 Å²	36	47.4 Å²	47.4	25%	0.252	25%	0.249	S	C	.	.			trans	-71.2	142.3	-175.8	60.3	0	0	0	0	113.5	Y531 G536	Y531-S534 WeakPolarHBondContact O-CB 3.46Å; Y531-S534 PolarHBondContact O-N 2.76Å; Y531-S534 PolarHBondContact O-OG 2.89Å; S534-G536 PolarHBondContact O-N 2.03Å
535	S	64.2	Low	85.7	Confident	89 Å²	89	46.8 Å²	46.8	62%	0.622	25%	0.247	S	C	*	.	S	Bend	trans	-69.2	15.1	177.5	55.5	0	0	0	0	114.9
536	G	83.6	Confident	85.9	Confident	33 Å²	33	47 Å²	47	34%	0.34	25%	0.247	S	C	.	.			trans	105.9	169.5	-168.6	0	0	0	0	0	113.1	S534	S534-G536 PolarHBondContact O-N 2.03Å
537	L	90.4	Very high	86.1	Confident	57 Å²	57	47.2 Å²	47.2	30%	0.298	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-103	148.3	178.5	-67.1	167	0	0	0	110.3	P511 D512	P511-L537 HydrophobicContact CB-CD1 4.47Å; P511-L537 HydrophobicContact CG-CD1 4.23Å; D512-L537 HydrophobicContact CB-CD1 3.85Å; D512-L537 HydrophobicContact CB-CD2 4.08Å
538	P	92.7	Very high	86.1	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.006	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-60	143.4	167.7	24.2	-31.8	0	0	0	110.5	W243 Y493 Q540 M555 W570	W243-P538 HydrophobicContact CB-CG 4.5Å; W243-P538 HydrophobicContact CD2-CG 3.67Å; W243-P538 HydrophobicContact CE3-CG 4.18Å; W243-P538 HydrophobicContact CG-CG 3.82Å; W243-P538 HydrophobicContact CZ2-CG 4.31Å; Y493-P538 HydrophobicContact CE1-CG 4.49Å; Y493-P538 WeakPolarHBondContact OH-CG 3.25Å; P538-Q540 PolarHBondContact O-N 3.44Å; P538-M555 HydrophobicContact CB-CE 3.66Å; P538-M555 HydrophobicContact CG-CE 3.95Å; P538-W570 HydrophobicContact CB-CD2 3.97Å; P538-W570 HydrophobicContact CB-CG 4.13Å; P538-W570 HydrophobicContact CB-CZ2 4.2Å
539	E	91.3	Very high	86.2	Confident	82 Å²	82	46.1 Å²	46.1	38%	0.383	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-58.8	138.8	171.2	-172.2	175.8	178.4	0	0	109.9	R541 A560 R564 L566	E539-R541 PolarHBondContact O-N 3.33Å; E539-R541 PolarHBondContact O-NE 2.92Å; E539-R541 PolarHBondContact O-NH2 3.08Å; E539-A560 WeakPolarHBondContact OE1-CB 3.02Å; E539-R564 IonicContact OE1-NH2 3.26Å; E539-R564 PolarHBondContact OE1-NH2 3.07Å; E539-R564 IonicContact OE2-NH2 2.84Å; E539-R564 PolarHBondContact OE2-NH2 2.95Å; E539-L566 HydrophobicContact CB-CD1 4.46Å
540	Q	90.4	Very high	86	Confident	21 Å²	21	49.9 Å²	49.9	10%	0.098	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-61.7	130	178.9	-177.8	67.9	18.9	0	0	110.2	G495 P538 Y561	G495-Q540 PolarHBondContact O-NE2 2.79Å; P538-Q540 PolarHBondContact O-N 3.44Å; Q540-Y561 HydrophobicContact CB-CD2 4.23Å; Q540-Y561 HydrophobicContact CB-CE2 4.26Å; Q540-Y561 HydrophobicContact CG-CD2 3.78Å; Q540-Y561 HydrophobicContact CG-CE2 3.32Å
541	R	94.6	Very high	86	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.008	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	163	-168.9	65.7	-169.7	72.6	-160.3	-2.1	113.3	G494 G495 E539 A544 G557 E559 L566 D568	G494-R541 CarbonylContact C-O 3.57Å; G494-R541 WeakPolarHBondContact CA-O 3.46Å; G495-R541 PolarHBondContact N-O 2.86Å; E539-R541 PolarHBondContact O-N 3.33Å; E539-R541 PolarHBondContact O-NE 2.92Å; E539-R541 PolarHBondContact O-NH2 3.08Å; R541-A544 HydrophobicContact CG-CB 3.99Å; R541-G557 VanDerWaalsContact CD-O 3.25Å; R541-G557 WeakPolarHBondContact CD-O 3.27Å; R541-G557 PolarHBondContact NH1-O 3.41Å; R541-E559 CarbonylContact C-O 3.57Å; R541-E559 VanDerWaalsContact CA-O 3.23Å; R541-E559 WeakPolarHBondContact CA-O 3.46Å; R541-L566 HydrophobicContact CB-CD1 4.02Å; R541-L566 VanDerWaalsContact CZ-CD1 3.41Å; R541-D568 IonicContact CZ-OD1 2.84Å; R541-D568 IonicContact CZ-OD2 3.33Å; R541-D568 IonicContact NH1-OD1 3.23Å; R541-D568 PolarHBondContact NH1-OD1 3.39Å; R541-D568 IonicContact NH1-OD2 3.37Å; R541-D568 IonicContact NH2-OD1 3.68Å; R541-D568 PolarHBondContact NH2-OD1 2.73Å; R541-D568 IonicContact NH2-OD2 3.94Å; R541-D568 PolarHBondContact NH2-OD2 3.05Å
542	S	94.7	Very high	86.7	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.007	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	159	172.6	54.6	0	0	0	0	110.7	A544 G558 E559	S542-A544 PolarHBondContact O-N 3.2Å; S542-A544 VanDerWaalsContact O-N 3.09Å; S542-G558 CarbonylContact O-C 3.51Å; S542-G558 VanDerWaalsContact O-CA 3.23Å; S542-G558 WeakPolarHBondContact O-CA 3.16Å; S542-E559 PolarHBondContact N-O 3.24Å; S542-E559 PolarHBondContact O-N 3.5Å; S542-E559 PolarHBondContact OG-O 3.06Å
543	A	95.6	Very high	88	Confident	6 Å²	6	36.4 Å²	36.4	5%	0.05	22%	0.216	C	C	.	.	S	Bend	trans	56.3	28.3	176.2	0	0	0	0	0	114.5	K259 H260 E471	K259-A543 WeakPolarHBondContact CA-O 3.45Å; K259-A543 HydrophobicContact CB-CB 3.79Å; K259-A543 HydrophobicContact CD-CB 4.28Å; K259-A543 HydrophobicContact CG-CB 4.45Å; H260-A543 WeakPolarHBondContact CE1-CB 3.41Å; H260-A543 PolarHBondContact N-O 3.35Å; H260-A543 WeakPolarHBondContact NE2-CB 3.05Å; E471-A543 HydrophobicContact CB-CB 4.15Å; E471-A543 PolarHBondContact O-N 2.87Å
544	A	97	Very high	89.5	Confident	11 Å²	11	30.2 Å²	30.2	9%	0.091	18%	0.182	C	C	.	.			trans	-74.1	147.5	173.9	0	0	0	0	0	110.4	S473 R541 S542 M555 G557	S473-A544 PolarHBondContact OG-O 2.83Å; R541-A544 HydrophobicContact CG-CB 3.99Å; S542-A544 PolarHBondContact O-N 3.2Å; S542-A544 VanDerWaalsContact O-N 3.09Å; A544-M555 HydrophobicContact CB-CG 3.93Å; A544-M555 HydrophobicContact CB-SD 4.09Å; A544-G557 WeakPolarHBondContact CB-O 3.13Å
545	S	96.1	Very high	91	Very high	5 Å²	5	28.5 Å²	28.5	4%	0.035	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	127.6	-176.7	-36.9	0	0	0	0	108.6	A261 F263 M555 F556	A261-S545 PolarHBondContact O-OG 3.49Å; F263-S545 VanDerWaalsContact CB-CB 3.48Å; S545-M555 CarbonylContact O-C 3.54Å; S545-M555 WeakPolarHBondContact O-CA 3.21Å; S545-F556 PolarHBondContact N-O 3.14Å; S545-F556 PolarHBondContact O-N 2.96Å
546	T	96	Very high	92.6	Very high	20 Å²	20	24.2 Å²	24.2	12%	0.123	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	140.8	-172.8	54.6	0	0	0	0	112.8	S473 V475 Y554 M555	S473-T546 WeakPolarHBondContact CB-OG1 3.38Å; V475-T546 WeakPolarHBondContact CG1-OG1 3.48Å; T546-Y554 CarbonylContact C-O 3.57Å; T546-Y554 WeakPolarHBondContact CA-O 3.04Å; T546-M555 HydrophobicContact CG2-CB 3.92Å; T546-M555 HydrophobicContact CG2-CG 3.85Å
547	A	94.2	Very high	93.3	Very high	7 Å²	7	22.7 Å²	22.7	6%	0.058	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	138.2	175.8	0	0	0	0	0	109.5	F263 V553 Y554	F263-A547 HydrophobicContact CD1-CB 3.61Å; F263-A547 HydrophobicContact CE1-CB 3.97Å; A547-V553 WeakPolarHBondContact O-CA 3.23Å; A547-Y554 PolarHBondContact N-O 2.85Å; A547-Y554 PolarHBondContact O-N 2.82Å
548	S	91.9	Very high	93.6	Very high	25 Å²	25	20 Å²	20	18%	0.175	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	137.7	175.4	-166.3	0	0	0	0	110.6	T476	T476-S548 VanDerWaalsContact O-CB 3.28Å; T476-S548 WeakPolarHBondContact O-CB 3.3Å; T476-S548 PolarHBondContact O-OG 3.04Å
549	T	89.7	Confident	93.7	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.012	11%	0.114	C	C	.	.			trans	-88.5	-162.5	158.4	79.3	0	0	0	0	108.7	Y265 T551 E552 Y554	Y265-T549 HydrophobicContact CD1-CG2 3.84Å; Y265-T549 HydrophobicContact CD2-CG2 4.08Å; Y265-T549 HydrophobicContact CE1-CG2 3.6Å; Y265-T549 HydrophobicContact CE2-CG2 3.84Å; Y265-T549 HydrophobicContact CG-CG2 4.05Å; T549-T551 VanDerWaalsContact C-N 3.33Å; T549-T551 PolarHBondContact OG1-N 3.37Å; T549-E552 PolarHBondContact N-O 3.29Å; T549-E552 PolarHBondContact OG1-N 3.49Å; T549-E552 PolarHBondContact OG1-O 2.58Å; T549-E552 VanDerWaalsContact OG1-O 3.13Å; T549-E552 PolarHBondContact OG1-OE2 3.42Å; T549-Y554 HydrophobicContact CG2-CD2 3.79Å; T549-Y554 HydrophobicContact CG2-CE2 3.51Å
550	L	84.5	Confident	93.8	Very high	79 Å²	79	17 Å²	17	41%	0.414	10%	0.096	S	C	.	.	S	Bend	trans	-74.2	-23.6	170.1	-65.3	175	0	0	0	113	M267 L478 P485	M267-L550 HydrophobicContact SD-CD2 4.14Å; M267-L550 HydrophobicContact SD-CG 4.31Å; L478-L550 HydrophobicContact CB-CD2 4.16Å; L478-L550 HydrophobicContact CD1-CD2 3.86Å; P485-L550 HydrophobicContact CB-CD2 3.55Å; P485-L550 HydrophobicContact CG-CD2 4.1Å
551	T	84.5	Confident	93.6	Very high	86 Å²	86	18.6 Å²	18.6	53%	0.528	10%	0.102	S	C	.	.	S	Bend	trans	-133	-22.6	-167.7	41	0	0	0	0	113.7	T549	T549-T551 VanDerWaalsContact C-N 3.33Å; T549-T551 PolarHBondContact OG1-N 3.37Å
552	E	91.7	Very high	93.3	Very high	54 Å²	54	23.4 Å²	23.4	25%	0.252	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	158.7	-176.7	-47.4	86.6	-164	0	0	112.2	T549 M571 L572 A573	T549-E552 PolarHBondContact N-O 3.29Å; T549-E552 PolarHBondContact OG1-N 3.49Å; T549-E552 PolarHBondContact OG1-O 2.58Å; T549-E552 VanDerWaalsContact OG1-O 3.13Å; T549-E552 PolarHBondContact OG1-OE2 3.42Å; E552-M571 HydrophobicContact CB-CG 3.71Å; E552-M571 HydrophobicContact CB-SD 4.04Å; E552-M571 HydrophobicContact CG-CG 4.08Å; E552-M571 HydrophobicContact CG-SD 3.82Å; E552-L572 CarbonylContact C-O 3.51Å; E552-L572 VanDerWaalsContact CA-O 3.28Å; E552-L572 WeakPolarHBondContact CA-O 2.95Å; E552-A573 HydrophobicContact CG-CB 4.16Å
553	V	95.2	Very high	93	Very high	5 Å²	5	25.2 Å²	25.2	3%	0.03	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	122.8	171	179.5	0	0	0	0	109.3	V475 L477 A547 M571 L572	V475-V553 HydrophobicContact CG1-CG1 4.19Å; V475-V553 HydrophobicContact CG2-CB 4.44Å; V475-V553 HydrophobicContact CG2-CG1 3.77Å; V475-V553 HydrophobicContact CG2-CG2 3.76Å; L477-V553 HydrophobicContact CD2-CG2 3.63Å; A547-V553 WeakPolarHBondContact O-CA 3.23Å; V553-M571 CarbonylContact O-C 3.52Å; V553-M571 VanDerWaalsContact O-CA 3.31Å; V553-M571 WeakPolarHBondContact O-CA 2.99Å; V553-L572 HydrophobicContact CB-CB 4.22Å; V553-L572 PolarHBondContact N-O 2.91Å; V553-L572 PolarHBondContact O-N 3.29Å
554	Y	96.6	Very high	92.9	Very high	12 Å²	12	30.3 Å²	30.3	5%	0.047	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	138.9	173.2	-74	-69.5	0	0	0	110.7	V246 V272 V293 T546 A547 T549 F569 W570 M571	V246-Y554 HydrophobicContact CG2-CD1 3.84Å; V246-Y554 HydrophobicContact CG2-CE1 3.78Å; V272-Y554 HydrophobicContact CG2-CD2 4.12Å; V272-Y554 HydrophobicContact CG2-CE2 4.47Å; V272-Y554 HydrophobicContact CG2-CG 4.45Å; V293-Y554 VanDerWaalsContact CG1-OH 3.32Å; V293-Y554 WeakPolarHBondContact CG1-OH 3.14Å; V293-Y554 HydrophobicContact CG2-CE2 4.24Å; T546-Y554 CarbonylContact C-O 3.57Å; T546-Y554 WeakPolarHBondContact CA-O 3.04Å; A547-Y554 PolarHBondContact N-O 2.85Å; A547-Y554 PolarHBondContact O-N 2.82Å; T549-Y554 HydrophobicContact CG2-CD2 3.79Å; T549-Y554 HydrophobicContact CG2-CE2 3.51Å; Y554-F569 AromaticContact CD1-CE2 3.75Å; Y554-F569 HydrophobicContact CD1-CE2 3.75Å; Y554-F569 AromaticContact CD1-CZ 3.59Å; Y554-F569 HydrophobicContact CD1-CZ 3.59Å; Y554-F569 HydrophobicContact CE1-CZ 4.24Å; Y554-F569 HydrophobicContact CG-CE2 4.18Å; Y554-F569 HydrophobicContact CG-CZ 4.14Å; Y554-W570 CarbonylContact C-O 3.57Å; Y554-W570 WeakPolarHBondContact CA-O 3.49Å; Y554-M571 HydrophobicContact CD1-CB 4.04Å; Y554-M571 HydrophobicContact CD1-CG 4.22Å; Y554-M571 HydrophobicContact CE1-CB 3.93Å; Y554-M571 HydrophobicContact CE1-CG 3.88Å; Y554-M571 HydrophobicContact CE1-SD 3.82Å
555	M	96.9	Very high	92.9	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.1	177.9	-179.9	179.8	68.2	0	0	110.6	W243 Y493 P538 A544 S545 T546 F569 W570	W243-M555 HydrophobicContact CH2-CB 4.32Å; W243-M555 HydrophobicContact CH2-CE 3.91Å; W243-M555 HydrophobicContact CH2-SD 4.07Å; W243-M555 HydrophobicContact CZ3-CB 4.14Å; W243-M555 HydrophobicContact CZ3-CE 3.91Å; W243-M555 HydrophobicContact CZ3-SD 4.5Å; Y493-M555 HydrophobicContact CD1-SD 3.67Å; Y493-M555 HydrophobicContact CE1-CE 3.97Å; Y493-M555 HydrophobicContact CE1-SD 3.62Å; P538-M555 HydrophobicContact CB-CE 3.66Å; P538-M555 HydrophobicContact CG-CE 3.95Å; A544-M555 HydrophobicContact CB-CG 3.93Å; A544-M555 HydrophobicContact CB-SD 4.09Å; S545-M555 CarbonylContact O-C 3.54Å; S545-M555 WeakPolarHBondContact O-CA 3.21Å; T546-M555 HydrophobicContact CG2-CB 3.92Å; T546-M555 HydrophobicContact CG2-CG 3.85Å; M555-F569 WeakPolarHBondContact O-CD2 3.18Å; M555-W570 HydrophobicContact CB-CB 4.48Å; M555-W570 HydrophobicContact CE-CB 4.04Å; M555-W570 HydrophobicContact CE-CG 4.24Å; M555-W570 PolarHBondContact N-O 3.38Å; M555-W570 PolarHBondContact O-N 3.3Å
556	F	97.6	Very high	92.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	135.7	178.1	-177.3	-94.7	0	0	0	112.3	P255 R258 F263 L274 W298 S545 D567 F569	P255-F556 HydrophobicContact CB-CE1 4.08Å; P255-F556 HydrophobicContact CB-CZ 3.76Å; P255-F556 HydrophobicContact CG-CE1 4.05Å; P255-F556 HydrophobicContact CG-CE2 3.78Å; P255-F556 HydrophobicContact CG-CZ 3.44Å; P255-F556 VanDerWaalsContact CG-CZ 3.44Å; R258-F556 HydrophobicContact CG-CE1 3.96Å; F263-F556 HydrophobicContact CE2-CB 3.88Å; F263-F556 HydrophobicContact CZ-CB 3.85Å; L274-F556 HydrophobicContact CD1-CD1 4.24Å; L274-F556 HydrophobicContact CD2-CD1 3.98Å; L274-F556 HydrophobicContact CD2-CE1 3.86Å; W298-F556 HydrophobicContact CZ2-CD2 4.14Å; W298-F556 HydrophobicContact CZ2-CE2 4.36Å; S545-F556 PolarHBondContact N-O 3.14Å; S545-F556 PolarHBondContact O-N 2.96Å; F556-D567 WeakPolarHBondContact CE2-O 3.4Å; F556-D567 HydrophobicContact CZ-CB 4.31Å; F556-F569 HydrophobicContact CB-CD2 4.08Å; F556-F569 HydrophobicContact CD2-CB 4Å; F556-F569 HydrophobicContact CD2-CD2 4.15Å; F556-F569 HydrophobicContact CD2-CG 4.21Å
557	G	97.1	Very high	92.9	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	64.1	-144.6	171	0	0	0	0	0	114.2	R541 A544 L566 D568	R541-G557 VanDerWaalsContact CD-O 3.25Å; R541-G557 WeakPolarHBondContact CD-O 3.27Å; R541-G557 PolarHBondContact NH1-O 3.41Å; A544-G557 WeakPolarHBondContact CB-O 3.13Å; G557-L566 WeakPolarHBondContact CA-O 3.49Å; G557-D568 PolarHBondContact N-O 3.06Å
558	G	96.8	Very high	92.9	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	105.1	-176.8	-171.8	0	0	0	0	0	112.9	R258 S542 L566	R258-G558 PolarHBondContact O-N 2.79Å; S542-G558 CarbonylContact O-C 3.51Å; S542-G558 VanDerWaalsContact O-CA 3.23Å; S542-G558 WeakPolarHBondContact O-CA 3.16Å; G558-L566 PolarHBondContact O-N 3.13Å
559	E	95.1	Very high	93.1	Very high	20 Å²	20	31.7 Å²	31.7	9%	0.093	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.1	177.8	-169.3	-172.7	140.3	0	0	110	K259 R496 R541 S542 L565	K259-E559 HydrophobicContact CD-CB 4.13Å; K259-E559 WeakPolarHBondContact CD-OE2 3.2Å; K259-E559 IonicContact NZ-OE2 3.06Å; K259-E559 PolarHBondContact NZ-OE2 3.42Å; R496-E559 IonicContact CZ-OE1 3.13Å; R496-E559 IonicContact NH1-OE1 3.69Å; R496-E559 PolarHBondContact NH1-OE1 2.68Å; R496-E559 IonicContact NH1-OE2 2.68Å; R496-E559 IonicContact NH2-OE1 3.73Å; R496-E559 PolarHBondContact NH2-OE1 3.36Å; R541-E559 CarbonylContact C-O 3.57Å; R541-E559 VanDerWaalsContact CA-O 3.23Å; R541-E559 WeakPolarHBondContact CA-O 3.46Å; S542-E559 PolarHBondContact N-O 3.24Å; S542-E559 PolarHBondContact O-N 3.5Å; S542-E559 PolarHBondContact OG-O 3.06Å; E559-L565 HydrophobicContact CB-CD2 3.94Å; E559-L565 HydrophobicContact CG-CD2 4.1Å
560	A	93.3	Very high	93.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	168.5	173.7	0	0	0	0	0	111.8	R496 E539 D562 G563 R564 L566	R496-A560 PolarHBondContact NH2-O 2.6Å; E539-A560 WeakPolarHBondContact OE1-CB 3.02Å; A560-D562 VanDerWaalsContact C-N 3.25Å; A560-D562 WeakPolarHBondContact CB-OD1 3.38Å; A560-D562 PolarHBondContact O-N 3.41Å; A560-G563 PolarHBondContact O-N 2.67Å; A560-G563 VanDerWaalsContact O-N 3.07Å; A560-R564 PolarHBondContact N-O 3.39Å; A560-L566 HydrophobicContact CB-CD1 4.23Å; A560-L566 HydrophobicContact CB-CD2 4.26Å; A560-L566 HydrophobicContact CB-CG 4.28Å
561	Y	86.8	Confident	93.9	Very high	55 Å²	55	29.7 Å²	29.7	22%	0.216	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-26	-178.7	-93.5	-102.3	0	0	0	113.8	R497 M508 Q540 G563	R497-Y561 PolarHBondContact N-OH 3.1Å; M508-Y561 HydrophobicContact CE-CD1 3.5Å; M508-Y561 VanDerWaalsContact CE-CD1 3.5Å; M508-Y561 HydrophobicContact CE-CD2 4.49Å; M508-Y561 HydrophobicContact CE-CE1 3.93Å; M508-Y561 HydrophobicContact CE-CG 3.77Å; Q540-Y561 HydrophobicContact CB-CD2 4.23Å; Q540-Y561 HydrophobicContact CB-CE2 4.26Å; Q540-Y561 HydrophobicContact CG-CD2 3.78Å; Q540-Y561 HydrophobicContact CG-CE2 3.32Å; Y561-G563 PolarHBondContact O-N 3.47Å
562	D	87.6	Confident	94.3	Very high	104 Å²	104	25.7 Å²	25.7	56%	0.556	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-5.4	173.6	64.8	-5.4	0	0	0	113.3	A560 R564	A560-D562 VanDerWaalsContact C-N 3.25Å; A560-D562 WeakPolarHBondContact CB-OD1 3.38Å; A560-D562 PolarHBondContact O-N 3.41Å; D562-R564 WeakPolarHBondContact OD1-CB 3.29Å; D562-R564 PolarHBondContact OD1-N 2.79Å; D562-R564 IonicContact OD2-CZ 3.03Å; D562-R564 IonicContact OD2-NE 3.82Å; D562-R564 PolarHBondContact OD2-NE 2.02Å; D562-R564 VanDerWaalsContact OD2-NE 3.13Å; D562-R564 IonicContact OD2-NH2 2.8Å
563	G	88.2	Confident	94.3	Very high	38 Å²	38	23.8 Å²	23.8	39%	0.392	12%	0.123	S	C	.	.	S	Bend	trans	88.9	-1.1	-178	0	0	0	0	0	114.1	A560 Y561	A560-G563 PolarHBondContact O-N 2.67Å; A560-G563 VanDerWaalsContact O-N 3.07Å; Y561-G563 PolarHBondContact O-N 3.47Å
564	R	94.6	Very high	94	Very high	114 Å²	114	25.1 Å²	25.1	43%	0.43	14%	0.138	S	C	.	.			trans	-76.5	138.1	179.7	-165.4	172.2	46.6	79.9	10.2	110	E539 A560 D562	E539-R564 IonicContact OE1-NH2 3.26Å; E539-R564 PolarHBondContact OE1-NH2 3.07Å; E539-R564 IonicContact OE2-NH2 2.84Å; E539-R564 PolarHBondContact OE2-NH2 2.95Å; A560-R564 PolarHBondContact N-O 3.39Å; D562-R564 WeakPolarHBondContact OD1-CB 3.29Å; D562-R564 PolarHBondContact OD1-N 2.79Å; D562-R564 IonicContact OD2-CZ 3.03Å; D562-R564 IonicContact OD2-NE 3.82Å; D562-R564 PolarHBondContact OD2-NE 2.02Å; D562-R564 VanDerWaalsContact OD2-NE 3.13Å; D562-R564 IonicContact OD2-NH2 2.8Å
565	L	96.9	Very high	93.6	Very high	16 Å²	16	26.8 Å²	26.8	8%	0.084	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	144.6	173.9	-65.2	178.7	0	0	0	110.5	A257 K259 G279 E280 E559	A257-L565 HydrophobicContact CB-CB 3.84Å; K259-L565 HydrophobicContact CB-CD2 4.05Å; K259-L565 HydrophobicContact CD-CD2 3.89Å; K259-L565 HydrophobicContact CG-CD2 3.86Å; G279-L565 VanDerWaalsContact O-CD1 3.3Å; G279-L565 WeakPolarHBondContact O-CD1 3.34Å; E280-L565 HydrophobicContact CG-CD1 4.12Å; E280-L565 VanDerWaalsContact N-CD1 3.35Å; E559-L565 HydrophobicContact CB-CD2 3.94Å; E559-L565 HydrophobicContact CG-CD2 4.1Å
566	L	96.7	Very high	93.2	Very high	7 Å²	7	27.8 Å²	27.8	4%	0.037	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	153.2	-178.9	-57.7	177.5	0	0	0	110	A257 R258 E539 R541 G557 G558 A560 D568	A257-L566 VanDerWaalsContact CA-O 3.27Å; A257-L566 WeakPolarHBondContact CA-O 3.05Å; R258-L566 PolarHBondContact N-O 3.1Å; E539-L566 HydrophobicContact CB-CD1 4.46Å; R541-L566 HydrophobicContact CB-CD1 4.02Å; R541-L566 VanDerWaalsContact CZ-CD1 3.41Å; G557-L566 WeakPolarHBondContact CA-O 3.49Å; G558-L566 PolarHBondContact O-N 3.13Å; A560-L566 HydrophobicContact CB-CD1 4.23Å; A560-L566 HydrophobicContact CB-CD2 4.26Å; A560-L566 HydrophobicContact CB-CG 4.28Å; L566-D568 WeakPolarHBondContact CB-OD1 3.31Å
567	D	94.8	Very high	92.7	Very high	57 Å²	57	33.2 Å²	33.2	31%	0.305	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	3.4	174.9	63.6	14.5	0	0	0	112.3	R254 A257 F556	R254-D567 IonicContact CZ-OD1 2.77Å; R254-D567 IonicContact CZ-OD2 2.69Å; R254-D567 IonicContact NH1-OD1 3.45Å; R254-D567 IonicContact NH1-OD2 3.52Å; R254-D567 PolarHBondContact NH1-OD2 2.82Å; R254-D567 VanDerWaalsContact NH2-C 3.26Å; R254-D567 PolarHBondContact NH2-O 3.34Å; R254-D567 IonicContact NH2-OD1 3.55Å; R254-D567 PolarHBondContact NH2-OD1 3.11Å; R254-D567 IonicContact NH2-OD2 2.68Å; R254-D567 PolarHBondContact NH2-OD2 2.7Å; A257-D567 HydrophobicContact CB-CB 3.91Å; F556-D567 WeakPolarHBondContact CE2-O 3.4Å; F556-D567 HydrophobicContact CZ-CB 4.31Å
568	D	94.8	Very high	92.3	Very high	14 Å²	14	38.6 Å²	38.6	8%	0.075	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	142.5	-176.4	56.4	-19.8	0	0	0	112.2	R245 R541 G557 L566 W570	R245-D568 IonicContact NH2-OD2 3.44Å; R541-D568 IonicContact CZ-OD1 2.84Å; R541-D568 IonicContact CZ-OD2 3.33Å; R541-D568 IonicContact NH1-OD1 3.23Å; R541-D568 PolarHBondContact NH1-OD1 3.39Å; R541-D568 IonicContact NH1-OD2 3.37Å; R541-D568 IonicContact NH2-OD1 3.68Å; R541-D568 PolarHBondContact NH2-OD1 2.73Å; R541-D568 IonicContact NH2-OD2 3.94Å; R541-D568 PolarHBondContact NH2-OD2 3.05Å; G557-D568 PolarHBondContact N-O 3.06Å; L566-D568 WeakPolarHBondContact CB-OD1 3.31Å; D568-W570 PolarHBondContact OD2-NE1 3.2Å
569	F	95.6	Very high	91.9	Very high	3 Å²	3	38.7 Å²	38.7	1%	0.013	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.5	-176.6	-167.1	-156.8	0	0	0	111.5	V246 F263 F291 W298 Y554 M555 F556	V246-F569 HydrophobicContact CB-CB 4.4Å; V246-F569 HydrophobicContact CB-CD1 3.55Å; V246-F569 HydrophobicContact CB-CE1 3.93Å; V246-F569 HydrophobicContact CB-CG 3.96Å; V246-F569 HydrophobicContact CG1-CD1 3.72Å; V246-F569 HydrophobicContact CG1-CE1 3.69Å; V246-F569 HydrophobicContact CG2-CD1 3.79Å; V246-F569 HydrophobicContact CG2-CD2 4.12Å; V246-F569 HydrophobicContact CG2-CE1 3.91Å; V246-F569 HydrophobicContact CG2-CE2 4.21Å; V246-F569 HydrophobicContact CG2-CG 3.89Å; V246-F569 HydrophobicContact CG2-CZ 4.1Å; V246-F569 PolarHBondContact N-O 3.33Å; F263-F569 AromaticContact CZ-CE2 3.84Å; F263-F569 HydrophobicContact CZ-CE2 3.84Å; F263-F569 HydrophobicContact CZ-CZ 4.37Å; F291-F569 HydrophobicContact CB-CE1 4.42Å; F291-F569 AromaticContact CD1-CE1 3.64Å; F291-F569 HydrophobicContact CD1-CE1 3.64Å; F291-F569 HydrophobicContact CD1-CZ 4.15Å; F291-F569 AromaticContact CD2-CE1 3.96Å; F291-F569 HydrophobicContact CD2-CE1 3.96Å; F291-F569 AromaticContact CE1-CE1 3.72Å; F291-F569 HydrophobicContact CE1-CE1 3.72Å; F291-F569 HydrophobicContact CE1-CZ 4.44Å; F291-F569 HydrophobicContact CE2-CD1 4.41Å; F291-F569 HydrophobicContact CE2-CE1 4.04Å; F291-F569 AromaticContact CG-CE1 3.75Å; F291-F569 HydrophobicContact CG-CE1 3.75Å; F291-F569 HydrophobicContact CG-CZ 4.43Å; F291-F569 HydrophobicContact CZ-CD1 4.49Å; F291-F569 AromaticContact CZ-CE1 3.92Å; F291-F569 HydrophobicContact CZ-CE1 3.92Å; W298-F569 HydrophobicContact CH2-CE1 4.49Å; W298-F569 AromaticContact CZ2-CD1 3.7Å; W298-F569 HydrophobicContact CZ2-CD1 3.7Å; W298-F569 AromaticContact CZ2-CE1 3.69Å; W298-F569 HydrophobicContact CZ2-CE1 3.69Å; W298-F569 HydrophobicContact CZ2-CG 4.14Å; W298-F569 HydrophobicContact CZ2-CZ 4.15Å; Y554-F569 AromaticContact CD1-CE2 3.75Å; Y554-F569 HydrophobicContact CD1-CE2 3.75Å; Y554-F569 AromaticContact CD1-CZ 3.59Å; Y554-F569 HydrophobicContact CD1-CZ 3.59Å; Y554-F569 HydrophobicContact CE1-CZ 4.24Å; Y554-F569 HydrophobicContact CG-CE2 4.18Å; Y554-F569 HydrophobicContact CG-CZ 4.14Å; M555-F569 WeakPolarHBondContact O-CD2 3.18Å; F556-F569 HydrophobicContact CB-CD2 4.08Å; F556-F569 HydrophobicContact CD2-CB 4Å; F556-F569 HydrophobicContact CD2-CD2 4.15Å; F556-F569 HydrophobicContact CD2-CG 4.21Å
570	W	95.7	Very high	91.4	Very high	3 Å²	3	40.8 Å²	40.8	1%	0.011	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	154.2	-174.2	-71	89.8	0	0	0	112	W243 K244 R245 P538 Y554 M555 D568	W243-W570 HydrophobicContact CB-CE3 3.93Å; W243-W570 HydrophobicContact CB-CZ3 4.01Å; W243-W570 HydrophobicContact CE3-CB 3.88Å; W243-W570 HydrophobicContact CZ3-CB 3.97Å; K244-W570 VanDerWaalsContact C-CE3 3.43Å; R245-W570 HydrophobicContact CG-CD2 3.9Å; R245-W570 HydrophobicContact CG-CE3 3.83Å; R245-W570 HydrophobicContact CG-CH2 3.57Å; R245-W570 HydrophobicContact CG-CZ2 3.62Å; R245-W570 HydrophobicContact CG-CZ3 3.66Å; R245-W570 VanDerWaalsContact CZ-CZ2 3.45Å; P538-W570 HydrophobicContact CB-CD2 3.97Å; P538-W570 HydrophobicContact CB-CG 4.13Å; P538-W570 HydrophobicContact CB-CZ2 4.2Å; Y554-W570 CarbonylContact C-O 3.57Å; Y554-W570 WeakPolarHBondContact CA-O 3.49Å; M555-W570 HydrophobicContact CB-CB 4.48Å; M555-W570 HydrophobicContact CE-CB 4.04Å; M555-W570 HydrophobicContact CE-CG 4.24Å; M555-W570 PolarHBondContact N-O 3.38Å; M555-W570 PolarHBondContact O-N 3.3Å; D568-W570 PolarHBondContact OD2-NE1 3.2Å
571	M	94.5	Very high	90.9	Very high	35 Å²	35	44.5 Å²	44.5	17%	0.172	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	129.9	172.9	-178.9	-179	73	0	0	108.7	K244 V246 E552 V553 Y554 A573	K244-M571 HydrophobicContact CD-CE 4.46Å; K244-M571 PolarHBondContact N-O 3.01Å; K244-M571 PolarHBondContact O-N 3.4Å; V246-M571 HydrophobicContact CG2-CB 3.85Å; E552-M571 HydrophobicContact CB-CG 3.71Å; E552-M571 HydrophobicContact CB-SD 4.04Å; E552-M571 HydrophobicContact CG-CG 4.08Å; E552-M571 HydrophobicContact CG-SD 3.82Å; V553-M571 CarbonylContact O-C 3.52Å; V553-M571 VanDerWaalsContact O-CA 3.31Å; V553-M571 WeakPolarHBondContact O-CA 2.99Å; Y554-M571 HydrophobicContact CD1-CB 4.04Å; Y554-M571 HydrophobicContact CD1-CG 4.22Å; Y554-M571 HydrophobicContact CE1-CB 3.93Å; Y554-M571 HydrophobicContact CE1-CG 3.88Å; Y554-M571 HydrophobicContact CE1-SD 3.82Å; M571-A573 HydrophobicContact CE-CB 4.48Å
572	L	94.4	Very high	90.1	Very high	3 Å²	3	45.6 Å²	45.6	2%	0.016	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.8	170	-176.3	62.4	0	0	0	107.9	L241 W243 L491 V514 E552 V553	L241-L572 HydrophobicContact CB-CD1 4Å; L241-L572 HydrophobicContact CD2-CD1 4.36Å; L241-L572 HydrophobicContact CD2-CD2 4.18Å; L241-L572 HydrophobicContact CD2-CG 4.03Å; W243-L572 HydrophobicContact CD2-CB 4.16Å; W243-L572 HydrophobicContact CD2-CD1 3.81Å; W243-L572 HydrophobicContact CE3-CB 3.77Å; W243-L572 HydrophobicContact CE3-CD1 4.3Å; W243-L572 HydrophobicContact CG-CD1 4.07Å; W243-L572 HydrophobicContact CH2-CB 3.84Å; W243-L572 HydrophobicContact CH2-CD2 4.23Å; W243-L572 HydrophobicContact CH2-CG 4.48Å; W243-L572 HydrophobicContact CZ2-CB 4.18Å; W243-L572 HydrophobicContact CZ2-CD1 4.18Å; W243-L572 HydrophobicContact CZ2-CD2 3.98Å; W243-L572 HydrophobicContact CZ2-CG 4.36Å; W243-L572 HydrophobicContact CZ3-CB 3.62Å; L491-L572 HydrophobicContact CD1-CD2 3.57Å; V514-L572 HydrophobicContact CG2-CD2 4.48Å; E552-L572 CarbonylContact C-O 3.51Å; E552-L572 VanDerWaalsContact CA-O 3.28Å; E552-L572 WeakPolarHBondContact CA-O 2.95Å; V553-L572 HydrophobicContact CB-CB 4.22Å; V553-L572 PolarHBondContact N-O 2.91Å; V553-L572 PolarHBondContact O-N 3.29Å
573	A	91.1	Very high	88.9	Confident	13 Å²	13	45.1 Å²	45.1	11%	0.107	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	161.5	179	0	0	0	0	0	110.4	L241 H242 E552 M571	L241-A573 CarbonylContact C-O 3.53Å; L241-A573 VanDerWaalsContact CA-O 3.3Å; L241-A573 WeakPolarHBondContact CA-O 3.48Å; H242-A573 PolarHBondContact N-O 3.22Å; H242-A573 PolarHBondContact ND1-O 3.21Å; H242-A573 PolarHBondContact O-N 3.39Å; E552-A573 HydrophobicContact CG-CB 4.16Å; M571-A573 HydrophobicContact CE-CB 4.48Å
574	G	88.8	Confident	87.5	Confident	34 Å²	34	51.5 Å²	51.5	35%	0.351	26%	0.263	S	S	.	.	S	Bend	trans	107.3	171.3	179.3	0	0	0	0	0	113.6	V239 L241	V239-G574 CarbonylContact O-C 3.58Å; V239-G574 VanDerWaalsContact O-CA 3.22Å; V239-G574 WeakPolarHBondContact O-CA 3.16Å; L241-G574 WeakPolarHBondContact CD2-O 3.16Å
575	D	88.6	Confident	86.3	Confident	47 Å²	47	48.6 Å²	48.6	25%	0.251	26%	0.259	S	S	.	.	B	Isolated β-bridge	trans	-92.8	126.3	176.5	-167.5	-12.4	0	0	0	110.3	V239 R577 E578	V239-D575 PolarHBondContact O-N 3.17Å; D575-R577 PolarHBondContact O-N 3.47Å; D575-R577 WeakPolarHBondContact OD1-CB 3.49Å; D575-R577 WeakPolarHBondContact OD1-CG 3.43Å; D575-R577 PolarHBondContact OD1-N 2.98Å; D575-R577 IonicContact OD1-NH1 2.76Å; D575-R577 PolarHBondContact OD1-NH1 3.32Å; D575-R577 IonicContact OD2-NH1 3.21Å; D575-E578 HydrophobicContact CB-CG 4.29Å; D575-E578 PolarHBondContact O-N 3.4Å
576	W	88.1	Confident	84.4	Confident	20 Å²	20	55.4 Å²	55.4	8%	0.076	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-21.3	175.7	65.8	-92.2	0	0	0	113.3	L241 L477 A489 I516 D518 E578 S579	L241-W576 HydrophobicContact CD1-CB 3.69Å; L241-W576 HydrophobicContact CD2-CB 4.3Å; L241-W576 HydrophobicContact CG-CB 4.07Å; L477-W576 HydrophobicContact CD1-CG 4.22Å; A489-W576 HydrophobicContact CB-CZ2 4.05Å; I516-W576 HydrophobicContact CB-CE3 4.47Å; I516-W576 HydrophobicContact CD1-CB 4.13Å; I516-W576 HydrophobicContact CD1-CG 4.49Å; I516-W576 HydrophobicContact CG1-CB 4.16Å; I516-W576 HydrophobicContact CG1-CE3 4.47Å; I516-W576 HydrophobicContact CG2-CD2 3.95Å; I516-W576 HydrophobicContact CG2-CE3 3.81Å; I516-W576 HydrophobicContact CG2-CG 4.46Å; I516-W576 HydrophobicContact CG2-CH2 4.5Å; I516-W576 HydrophobicContact CG2-CZ3 4.1Å; D518-W576 HydrophobicContact CB-CH2 4.32Å; W576-E578 VanDerWaalsContact C-N 3.32Å; W576-S579 PolarHBondContact O-N 3.48Å
577	R	88.2	Confident	82.7	Confident	114 Å²	114	58.1 Å²	58.1	43%	0.43	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-34	176.7	-65.6	179.6	-178.5	85	-4.8	112.3	D575	D575-R577 PolarHBondContact O-N 3.47Å; D575-R577 WeakPolarHBondContact OD1-CB 3.49Å; D575-R577 WeakPolarHBondContact OD1-CG 3.43Å; D575-R577 PolarHBondContact OD1-N 2.98Å; D575-R577 IonicContact OD1-NH1 2.76Å; D575-R577 PolarHBondContact OD1-NH1 3.32Å; D575-R577 IonicContact OD2-NH1 3.21Å
578	E	88.1	Confident	81.1	Confident	113 Å²	113	61.2 Å²	61.2	53%	0.528	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-15	179.4	-60.3	-59	149.6	0	0	112.5	A238 D575 W576	A238-E578 HydrophobicContact CB-CG 3.69Å; D575-E578 HydrophobicContact CB-CG 4.29Å; D575-E578 PolarHBondContact O-N 3.4Å; W576-E578 VanDerWaalsContact C-N 3.32Å
579	S	88.7	Confident	79.7	Confident	2 Å²	2	62.6 Å²	62.6	1%	0.014	33%	0.331	C	S	.	.	S	Bend	trans	-67.7	135	173.3	-75.3	0	0	0	0	112.7	L241 R527 S528 W576 T581	L241-S579 WeakPolarHBondContact CB-OG 3.35Å; L241-S579 WeakPolarHBondContact CG-OG 3.36Å; L241-S579 PolarHBondContact N-OG 3.23Å; R527-S579 WeakPolarHBondContact CD-O 3.42Å; R527-S579 PolarHBondContact NH1-O 3.15Å; S528-S579 WeakPolarHBondContact O-CB 3.36Å; S528-S579 PolarHBondContact O-OG 2.94Å; W576-S579 PolarHBondContact O-N 3.48Å; S579-T581 PolarHBondContact O-N 3.16Å
580	A	85.1	Confident	78.7	Confident	65 Å²	65	64.8 Å²	64.8	54%	0.537	34%	0.341	S	S	.	.			trans	-54.8	138.9	173.3	0	0	0	0	0	111.2	R527 S528	R527-A580 WeakPolarHBondContact CA-O 3.36Å; S528-A580 PolarHBondContact N-O 2.93Å
581	T	82.4	Confident	77.9	Confident	78 Å²	78	64.7 Å²	64.7	48%	0.479	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	112.2	173.8	-55.9	0	0	0	0	109.1	I526 R527 S579 Q583	I526-T581 CarbonylContact O-C 3.49Å; I526-T581 VanDerWaalsContact O-CA 3.31Å; I526-T581 WeakPolarHBondContact O-CA 3.38Å; I526-T581 WeakPolarHBondContact O-CG2 3.49Å; R527-T581 PolarHBondContact NH1-OG1 2.96Å; R527-T581 VanDerWaalsContact NH1-OG1 3.08Å; S579-T581 PolarHBondContact O-N 3.16Å; T581-Q583 PolarHBondContact O-N 3.02Å
582	N	68.9	Low	77.5	Confident	78 Å²	78	64.1 Å²	64.1	42%	0.417	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-26.9	-177.1	-85.5	-7.9	0	0	0	113	D512 I526 S528	D512-N582 PolarHBondContact OD2-ND2 2.91Å; I526-N582 HydrophobicContact CG2-CB 4.39Å; I526-N582 PolarHBondContact O-N 3.31Å; S528-N582 WeakPolarHBondContact CB-ND2 3.35Å; S528-N582 WeakPolarHBondContact CB-OD1 3.46Å
583	Q	62.6	Low	76.9	Confident	93 Å²	93	65 Å²	65	44%	0.435	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163	146.2	-177.5	-136.6	166.6	-3.2	0	0	113.8	T581	T581-Q583 PolarHBondContact O-N 3.02Å
584	K	58.8	Low	76.5	Confident	173 Å²	173	65.5 Å²	65.5	75%	0.752	35%	0.347	S	S	*	.			trans	-67.8	143.4	161.5	-68.9	-179.4	179.6	177.4	0	108.4	Q586	K584-Q586 PolarHBondContact O-N 3.28Å
585	C	68.7	Low	76.5	Confident	53 Å²	53	65.9 Å²	65.9	36%	0.358	34%	0.341	S	S	.	.	S	Bend	trans	-58.8	52.6	178.4	-65	0	0	0	0	115.5	C465	C465-C585 HydrophobicContact CB-CB 3.39Å; C465-C585 WeakPolarHBondContact CB-SG 3.3Å; C465-C585 WeakPolarHBondContact SG-CA 3.46Å; C465-C585 WeakPolarHBondContact SG-CB 3.3Å; C465-C585 CovalentContact SG-SG 2.02Å; C465-C585 PolarHBondContact SG-SG 3.22Å
586	Q	58.4	Low	76.6	Confident	159 Å²	159	64.4 Å²	64.4	74%	0.743	33%	0.332	S	S	*	.			trans	-125.3	22.3	-173.1	-70.4	-171.2	-28.9	0	0	112.6	K584 V588	K584-Q586 PolarHBondContact O-N 3.28Å; Q586-V588 PolarHBondContact O-N 3.36Å; Q586-V588 VanDerWaalsContact O-N 3.07Å
587	Q	59.7	Low	76.7	Confident	63 Å²	63	64.6 Å²	64.6	29%	0.294	34%	0.34	S	S	.	.			trans	-70.4	107.1	173.1	-76	-171	-3.6	0	0	110.3	S467 N589	S467-Q587 PolarHBondContact OG-OE1 3.04Å; Q587-N589 PolarHBondContact O-N 3.42Å
588	V	61.5	Low	76.8	Confident	122 Å²	122	63.7 Å²	63.7	74%	0.739	34%	0.344	S	S	*	.			trans	-77.9	102.3	168.4	-176.2	0	0	0	0	108	Q586 F590	Q586-V588 PolarHBondContact O-N 3.36Å; Q586-V588 VanDerWaalsContact O-N 3.07Å; V588-F590 PolarHBondContact O-N 3.21Å
589	N	65.9	Low	77.1	Confident	43 Å²	43	60 Å²	60	23%	0.23	33%	0.327	C	S	.	.			trans	-79.7	99.1	173.9	-73.8	-63.3	0	0	0	109.6	P468 R497 Q587	P468-N589 WeakPolarHBondContact CD-ND2 3.35Å; P468-N589 HydrophobicContact CG-CB 4.41Å; R497-N589 PolarHBondContact NH2-OD1 2.92Å; Q587-N589 PolarHBondContact O-N 3.42Å
590	F	75.5	Confident	77.4	Confident	49 Å²	49	60.8 Å²	60.8	22%	0.215	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	117.2	172.7	-162.7	-105.5	0	0	0	110.4	L503 L504 V588 A594 L595 L598	L503-F590 HydrophobicContact CB-CD1 4.01Å; L503-F590 HydrophobicContact CD1-CD1 3.89Å; L503-F590 HydrophobicContact CD1-CE1 3.8Å; L503-F590 PolarHBondContact N-O 3.11Å; L504-F590 HydrophobicContact CB-CB 4.18Å; L504-F590 HydrophobicContact CD1-CB 4.09Å; L504-F590 HydrophobicContact CG-CB 4.46Å; L504-F590 PolarHBondContact N-O 2.66Å; V588-F590 PolarHBondContact O-N 3.21Å; F590-A594 HydrophobicContact CD2-CB 3.93Å; F590-A594 HydrophobicContact CE2-CB 3.85Å; F590-L595 HydrophobicContact CE1-CB 3.77Å; F590-L595 HydrophobicContact CE1-CD1 4.05Å; F590-L595 HydrophobicContact CE1-CG 4.39Å; F590-L595 HydrophobicContact CZ-CB 3.8Å; F590-L595 HydrophobicContact CZ-CD1 3.96Å; F590-L595 HydrophobicContact CZ-CG 4.49Å; F590-L598 HydrophobicContact CE2-CD1 4.42Å; F590-L598 HydrophobicContact CZ-CD1 4.38Å
591	N	78.6	Confident	77.8	Confident	2 Å²	2	59 Å²	59	1%	0.011	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	170.7	-179	64.7	15.2	0	0	0	111.1	Q443 Q501 L593 A594 L595	Q443-N591 PolarHBondContact NE2-ND2 3.44Å; Q443-N591 PolarHBondContact OE1-ND2 2.84Å; Q501-N591 CarbonylContact O-C 3.38Å; Q501-N591 WeakPolarHBondContact O-CA 3.44Å; Q501-N591 WeakPolarHBondContact O-CB 3.48Å; N591-L593 PolarHBondContact O-N 3.01Å; N591-L593 PolarHBondContact OD1-N 2.9Å; N591-A594 WeakPolarHBondContact O-CB 3.38Å; N591-A594 PolarHBondContact O-N 3.18Å; N591-A594 VanDerWaalsContact O-N 3.09Å; N591-A594 VanDerWaalsContact OD1-CB 3.25Å; N591-A594 WeakPolarHBondContact OD1-CB 3.08Å; N591-A594 PolarHBondContact OD1-N 3.37Å; N591-L595 PolarHBondContact O-N 3.45Å
592	L	84.6	Confident	78.2	Confident	22 Å²	22	56.5 Å²	56.5	12%	0.115	30%	0.302	C	S	.	.	H	α-helix	trans	-63.7	-27.5	-178.1	-167.4	60.6	0	0	0	112.3	Q501 L503 L595 H596 C652 Q655 A656	Q501-L592 PolarHBondContact O-N 3.2Å; L503-L592 HydrophobicContact CD1-CD1 4.32Å; L592-L595 HydrophobicContact CD1-CD2 4.15Å; L592-H596 WeakPolarHBondContact O-CB 3.17Å; L592-H596 PolarHBondContact O-N 2.98Å; L592-C652 HydrophobicContact CD1-CB 3.65Å; L592-C652 VanDerWaalsContact CD1-SG 3.56Å; L592-C652 WeakPolarHBondContact CD2-O 3.3Å; L592-C652 HydrophobicContact CG-CB 3.88Å; L592-C652 WeakPolarHBondContact CG-O 3.4Å; L592-Q655 HydrophobicContact CD2-CB 3.65Å; L592-Q655 HydrophobicContact CD2-CG 3.65Å; L592-A656 HydrophobicContact CB-CB 4Å; L592-A656 HydrophobicContact CD2-CB 4.15Å; L592-A656 HydrophobicContact CG-CB 4.11Å
593	L	83.2	Confident	79.5	Confident	23 Å²	23	52.8 Å²	52.8	12%	0.12	28%	0.282	C	S	.	.	H	α-helix	trans	-69.8	-40.7	173.1	-173.9	61.4	0	0	0	112	Q443 N591 H596 G597 A656 I727	Q443-L593 HydrophobicContact CB-CD2 4.3Å; N591-L593 PolarHBondContact O-N 3.01Å; N591-L593 PolarHBondContact OD1-N 2.9Å; L593-H596 WeakPolarHBondContact O-CB 3.42Å; L593-H596 PolarHBondContact O-N 3.04Å; L593-G597 PolarHBondContact O-N 2.93Å; L593-A656 HydrophobicContact CB-CB 4.42Å; L593-I727 HydrophobicContact CD2-CG2 3.67Å; L593-I727 HydrophobicContact CG-CG2 3.87Å
594	A	82.5	Confident	81	Confident	23 Å²	23	49.1 Å²	49.1	19%	0.19	27%	0.265	C	S	.	.	H	α-helix	trans	-66.5	-39.9	173	0	0	0	0	0	111	F590 N591 G597 L598	F590-A594 HydrophobicContact CD2-CB 3.93Å; F590-A594 HydrophobicContact CE2-CB 3.85Å; N591-A594 WeakPolarHBondContact O-CB 3.38Å; N591-A594 PolarHBondContact O-N 3.18Å; N591-A594 VanDerWaalsContact O-N 3.09Å; N591-A594 VanDerWaalsContact OD1-CB 3.25Å; N591-A594 WeakPolarHBondContact OD1-CB 3.08Å; N591-A594 PolarHBondContact OD1-N 3.37Å; A594-G597 PolarHBondContact O-N 2.95Å; A594-L598 WeakPolarHBondContact O-CB 3.46Å; A594-L598 PolarHBondContact O-N 2.97Å
595	L	88.2	Confident	82.5	Confident	42 Å²	42	41.2 Å²	41.2	22%	0.22	23%	0.231	C	C	.	.	H	α-helix	trans	-61.5	-45.2	172.7	-177	60.1	0	0	0	111.4	L503 F590 N591 L592 G597 L598 L599	L503-L595 HydrophobicContact CD1-CB 3.86Å; L503-L595 HydrophobicContact CD1-CD2 3.64Å; L503-L595 HydrophobicContact CD1-CG 4.34Å; F590-L595 HydrophobicContact CE1-CB 3.77Å; F590-L595 HydrophobicContact CE1-CD1 4.05Å; F590-L595 HydrophobicContact CE1-CG 4.39Å; F590-L595 HydrophobicContact CZ-CB 3.8Å; F590-L595 HydrophobicContact CZ-CD1 3.96Å; F590-L595 HydrophobicContact CZ-CG 4.49Å; N591-L595 PolarHBondContact O-N 3.45Å; L592-L595 HydrophobicContact CD1-CD2 4.15Å; L595-G597 PolarHBondContact O-N 3.48Å; L595-L598 PolarHBondContact O-N 3.28Å; L595-L599 HydrophobicContact CD1-CD1 4.05Å; L595-L599 HydrophobicContact CD1-CD2 4.35Å; L595-L599 HydrophobicContact CD1-CG 3.96Å; L595-L599 HydrophobicContact CD2-CD1 4.47Å; L595-L599 HydrophobicContact CG-CD1 3.84Å; L595-L599 HydrophobicContact CG-CG 4.22Å; L595-L599 WeakPolarHBondContact O-CB 3.42Å; L595-L599 VanDerWaalsContact O-CG 3.23Å; L595-L599 WeakPolarHBondContact O-CG 3.38Å; L595-L599 PolarHBondContact O-N 3.35Å
596	H	91.2	Very high	83.5	Confident	16 Å²	16	42.9 Å²	42.9	7%	0.074	24%	0.236	C	C	.	.	H	α-helix	trans	-54	-51.7	171.8	162.3	75.7	0	0	0	111.4	L592 L593 L598 L599 M600 G649 C652 H668	L592-H596 WeakPolarHBondContact O-CB 3.17Å; L592-H596 PolarHBondContact O-N 2.98Å; L593-H596 WeakPolarHBondContact O-CB 3.42Å; L593-H596 PolarHBondContact O-N 3.04Å; H596-L598 VanDerWaalsContact C-N 3.31Å; H596-L598 PolarHBondContact O-N 3.07Å; H596-L599 PolarHBondContact O-N 3.31Å; H596-M600 VanDerWaalsContact CE1-CG 3.41Å; H596-M600 WeakPolarHBondContact CE1-CG 3.42Å; H596-M600 WeakPolarHBondContact O-CB 3.31Å; H596-M600 VanDerWaalsContact O-CG 3.26Å; H596-M600 WeakPolarHBondContact O-CG 3.42Å; H596-M600 PolarHBondContact O-N 3Å; H596-G649 PolarHBondContact ND1-O 3.35Å; H596-C652 HydrophobicContact CB-CB 3.93Å; H596-H668 AromaticContact NE2-NE2 3.83Å
597	G	90.1	Very high	85.1	Confident	24 Å²	24	37.9 Å²	37.9	25%	0.247	21%	0.214	C	C	.	.	H	α-helix	trans	-58.3	-42.1	178.8	0	0	0	0	0	112.6	L593 A594 L595 S601	L593-G597 PolarHBondContact O-N 2.93Å; A594-G597 PolarHBondContact O-N 2.95Å; L595-G597 PolarHBondContact O-N 3.48Å; G597-S601 WeakPolarHBondContact O-CB 3.15Å; G597-S601 PolarHBondContact O-N 3.07Å; G597-S601 PolarHBondContact O-OG 2.51Å
598	L	90.4	Very high	86.8	Confident	95 Å²	95	35.5 Å²	35.5	50%	0.497	20%	0.203	S	C	.	.	H	α-helix	trans	-64.9	-50.7	177.4	-173	157.6	0	0	0	111.6	F590 A594 L595 H596 M600 S601 A602	F590-L598 HydrophobicContact CE2-CD1 4.42Å; F590-L598 HydrophobicContact CZ-CD1 4.38Å; A594-L598 WeakPolarHBondContact O-CB 3.46Å; A594-L598 PolarHBondContact O-N 2.97Å; L595-L598 PolarHBondContact O-N 3.28Å; H596-L598 VanDerWaalsContact C-N 3.31Å; H596-L598 PolarHBondContact O-N 3.07Å; L598-M600 PolarHBondContact O-N 3.28Å; L598-S601 PolarHBondContact O-N 3.16Å; L598-A602 VanDerWaalsContact O-CB 3.3Å; L598-A602 WeakPolarHBondContact O-CB 3.48Å; L598-A602 PolarHBondContact O-N 2.95Å
599	L	94.9	Very high	88.2	Confident	34 Å²	34	30.1 Å²	30.1	18%	0.178	17%	0.171	C	C	.	.	H	α-helix	trans	-62.9	-43.7	-179.4	-66.8	173.2	0	0	0	111.6	L595 H596 S603 I645 A648	L595-L599 HydrophobicContact CD1-CD1 4.05Å; L595-L599 HydrophobicContact CD1-CD2 4.35Å; L595-L599 HydrophobicContact CD1-CG 3.96Å; L595-L599 HydrophobicContact CD2-CD1 4.47Å; L595-L599 HydrophobicContact CG-CD1 3.84Å; L595-L599 HydrophobicContact CG-CG 4.22Å; L595-L599 WeakPolarHBondContact O-CB 3.42Å; L595-L599 VanDerWaalsContact O-CG 3.23Å; L595-L599 WeakPolarHBondContact O-CG 3.38Å; L595-L599 PolarHBondContact O-N 3.35Å; H596-L599 PolarHBondContact O-N 3.31Å; L599-S603 PolarHBondContact O-N 3.49Å; L599-S603 VanDerWaalsContact O-N 3.09Å; L599-S603 PolarHBondContact O-OG 3.36Å; L599-I645 HydrophobicContact CB-CG2 3.82Å; L599-I645 HydrophobicContact CD2-CG2 3.87Å; L599-I645 HydrophobicContact CG-CG2 4.42Å; L599-I645 VanDerWaalsContact O-CG2 3.26Å; L599-I645 WeakPolarHBondContact O-CG2 3.49Å; L599-A648 HydrophobicContact CD1-CB 4.25Å
600	M	94.5	Very high	89.3	Confident	19 Å²	19	30.6 Å²	30.6	9%	0.094	18%	0.181	C	C	.	.	H	α-helix	trans	-65.6	-44.8	177	-69.6	-55.3	-159.3	0	0	111.5	H596 L598 S603 F604 V646 A650 I676	H596-M600 VanDerWaalsContact CE1-CG 3.41Å; H596-M600 WeakPolarHBondContact CE1-CG 3.42Å; H596-M600 WeakPolarHBondContact O-CB 3.31Å; H596-M600 VanDerWaalsContact O-CG 3.26Å; H596-M600 WeakPolarHBondContact O-CG 3.42Å; H596-M600 PolarHBondContact O-N 3Å; L598-M600 PolarHBondContact O-N 3.28Å; M600-S603 PolarHBondContact O-N 3.12Å; M600-F604 HydrophobicContact CB-CD2 4.43Å; M600-F604 WeakPolarHBondContact O-CB 3.12Å; M600-F604 WeakPolarHBondContact O-CD2 3.45Å; M600-F604 PolarHBondContact O-N 3.25Å; M600-F604 HydrophobicContact SD-CD2 4.3Å; M600-F604 HydrophobicContact SD-CE2 3.91Å; M600-V646 HydrophobicContact CE-CG1 4.38Å; M600-V646 HydrophobicContact SD-CB 4.48Å; M600-V646 HydrophobicContact SD-CG1 4.23Å; M600-V646 HydrophobicContact SD-CG2 4.43Å; M600-A650 HydrophobicContact CE-CB 4.1Å; M600-I676 HydrophobicContact CE-CD1 4.04Å
601	S	92.2	Very high	90.1	Very high	27 Å²	27	28.5 Å²	28.5	19%	0.189	17%	0.173	C	C	.	.	H	α-helix	trans	-63.9	-44.8	177.7	-59.4	0	0	0	0	111.5	G597 L598 S603 A605	G597-S601 WeakPolarHBondContact O-CB 3.15Å; G597-S601 PolarHBondContact O-N 3.07Å; G597-S601 PolarHBondContact O-OG 2.51Å; L598-S601 PolarHBondContact O-N 3.16Å; S601-S603 VanDerWaalsContact C-N 3.26Å; S601-S603 PolarHBondContact O-N 3.49Å; S601-A605 WeakPolarHBondContact O-CA 3.39Å; S601-A605 WeakPolarHBondContact O-CB 3.42Å; S601-A605 PolarHBondContact O-N 3.46Å
602	A	92.4	Very high	90.6	Very high	27 Å²	27	30.4 Å²	30.4	22%	0.223	19%	0.189	C	C	.	.	I	π-helix	trans	-58.4	-39.1	176.5	0	0	0	0	0	112	L598 L606 I607	L598-A602 VanDerWaalsContact O-CB 3.3Å; L598-A602 WeakPolarHBondContact O-CB 3.48Å; L598-A602 PolarHBondContact O-N 2.95Å; A602-L606 VanDerWaalsContact O-CB 3.31Å; A602-L606 WeakPolarHBondContact O-CB 3.38Å; A602-L606 PolarHBondContact O-N 2.92Å; A602-I607 PolarHBondContact O-N 2.98Å
603	S	94.9	Very high	90.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.19	C	C	.	.	I	π-helix	trans	-74.7	-56.1	179.2	-57.8	0	0	0	0	112.6	L599 M600 S601 I607 L608 G642 I645	L599-S603 PolarHBondContact O-N 3.49Å; L599-S603 VanDerWaalsContact O-N 3.09Å; L599-S603 PolarHBondContact O-OG 3.36Å; M600-S603 PolarHBondContact O-N 3.12Å; S601-S603 VanDerWaalsContact C-N 3.26Å; S601-S603 PolarHBondContact O-N 3.49Å; S603-I607 PolarHBondContact O-N 2.8Å; S603-L608 WeakPolarHBondContact O-CB 3.35Å; S603-L608 WeakPolarHBondContact O-CG 3.25Å; S603-L608 PolarHBondContact O-N 3.47Å; S603-G642 PolarHBondContact OG-O 2.88Å; S603-I645 WeakPolarHBondContact OG-CB 3.46Å; S603-I645 WeakPolarHBondContact OG-CG2 3.18Å
604	F	94.2	Very high	91	Very high	16 Å²	16	34.9 Å²	34.9	7%	0.07	21%	0.205	C	C	.	.	I	π-helix	trans	-79.6	-22.2	-171.4	-77.3	-68.3	0	0	0	113.7	M600 L608 P609 V646 V675 L679 A716 F717 I720	M600-F604 HydrophobicContact CB-CD2 4.43Å; M600-F604 WeakPolarHBondContact O-CB 3.12Å; M600-F604 WeakPolarHBondContact O-CD2 3.45Å; M600-F604 PolarHBondContact O-N 3.25Å; M600-F604 HydrophobicContact SD-CD2 4.3Å; M600-F604 HydrophobicContact SD-CE2 3.91Å; F604-L608 HydrophobicContact CD1-CD1 4.07Å; F604-L608 HydrophobicContact CE1-CD1 4.16Å; F604-P609 WeakPolarHBondContact O-CG 3.08Å; F604-V646 HydrophobicContact CD2-CG2 4.31Å; F604-V646 HydrophobicContact CE2-CG1 4.27Å; F604-V646 HydrophobicContact CE2-CG2 3.75Å; F604-V646 HydrophobicContact CZ-CG1 4.32Å; F604-V646 HydrophobicContact CZ-CG2 3.99Å; F604-V675 HydrophobicContact CD1-CG1 4.42Å; F604-V675 HydrophobicContact CE1-CG1 3.61Å; F604-V675 HydrophobicContact CE2-CG1 4.5Å; F604-V675 HydrophobicContact CZ-CG1 3.66Å; F604-L679 HydrophobicContact CE1-CD2 3.88Å; F604-L679 HydrophobicContact CZ-CD2 3.8Å; F604-A716 HydrophobicContact CB-CB 4.15Å; F604-A716 HydrophobicContact CD1-CB 3.58Å; F604-A716 HydrophobicContact CE1-CB 4.19Å; F604-A716 HydrophobicContact CG-CB 4.02Å; F604-F717 WeakPolarHBondContact O-CE1 3.27Å; F604-I720 HydrophobicContact CB-CD1 3.82Å
605	A	90.3	Very high	91.2	Very high	6 Å²	6	34.2 Å²	34.2	5%	0.05	20%	0.199	C	C	.	.	I	π-helix	trans	-97.6	-28.4	176.8	0	0	0	0	0	113.9	S601 I720 F737 H740 L744	S601-A605 WeakPolarHBondContact O-CA 3.39Å; S601-A605 WeakPolarHBondContact O-CB 3.42Å; S601-A605 PolarHBondContact O-N 3.46Å; A605-I720 HydrophobicContact CB-CD1 4.17Å; A605-F737 HydrophobicContact CB-CE2 3.59Å; A605-F737 HydrophobicContact CB-CZ 4.19Å; A605-H740 PolarHBondContact O-CE1 3.24Å; A605-L744 WeakPolarHBondContact O-CD1 3.32Å
606	L	90.3	Very high	91	Very high	89 Å²	89	33.4 Å²	33.4	47%	0.466	20%	0.195	S	C	.	.	I	π-helix	trans	-117.3	-69.7	-174.1	-56.4	172	0	0	0	112.1	A602 P609 A610 H740	A602-L606 VanDerWaalsContact O-CB 3.31Å; A602-L606 WeakPolarHBondContact O-CB 3.38Å; A602-L606 PolarHBondContact O-N 2.92Å; L606-P609 WeakPolarHBondContact O-CD 3.45Å; L606-A610 WeakPolarHBondContact O-CB 3.38Å; L606-A610 PolarHBondContact O-N 3.49Å; L606-H740 WeakPolarHBondContact CD2-NE2 3.32Å
607	I	92.7	Very high	90.6	Very high	53 Å²	53	35.8 Å²	35.8	27%	0.272	20%	0.204	S	C	.	.	I	π-helix	trans	-66.6	-52.4	-163.2	-62.9	169.5	0	0	0	111.9	A602 S603 G611 A638 I645	A602-I607 PolarHBondContact O-N 2.98Å; S603-I607 PolarHBondContact O-N 2.8Å; I607-G611 PolarHBondContact O-N 3.39Å; I607-A638 VanDerWaalsContact CG2-O 3.3Å; I607-A638 WeakPolarHBondContact CG2-O 3.33Å; I607-I645 HydrophobicContact CD1-CD1 3.41Å; I607-I645 VanDerWaalsContact CD1-CD1 3.41Å
608	L	93.6	Very high	90.3	Very high	13 Å²	13	38.5 Å²	38.5	7%	0.068	21%	0.209	C	C	.	.	H	α-helix	trans	-66.4	-49.8	-177.7	-59	171.6	0	0	0	111.2	S603 F604 G611 A612 Q639 V646 L679	S603-L608 WeakPolarHBondContact O-CB 3.35Å; S603-L608 WeakPolarHBondContact O-CG 3.25Å; S603-L608 PolarHBondContact O-N 3.47Å; F604-L608 HydrophobicContact CD1-CD1 4.07Å; F604-L608 HydrophobicContact CE1-CD1 4.16Å; L608-G611 PolarHBondContact O-N 3.36Å; L608-A612 WeakPolarHBondContact O-CB 3.49Å; L608-A612 PolarHBondContact O-N 3.27Å; L608-Q639 VanDerWaalsContact CD2-OE1 3.25Å; L608-Q639 PolarHBondContact O-NE2 2.99Å; L608-V646 HydrophobicContact CD1-CG2 4.34Å; L608-L679 HydrophobicContact CD1-CD1 4.42Å; L608-L679 HydrophobicContact CD1-CD2 4.24Å
609	P	91.4	Very high	89.8	Confident	9 Å²	9	36.4 Å²	36.4	6%	0.058	20%	0.202	C	C	.	.	H	α-helix	trans	-63.4	-41.7	177.3	-22.3	34.5	0	0	0	113.5	F604 L606 G611 A612 L613 L713 L744	F604-P609 WeakPolarHBondContact O-CG 3.08Å; L606-P609 WeakPolarHBondContact O-CD 3.45Å; P609-G611 PolarHBondContact O-N 3.13Å; P609-A612 PolarHBondContact O-N 3.47Å; P609-L613 WeakPolarHBondContact O-CB 3.37Å; P609-L613 VanDerWaalsContact O-CG 3.31Å; P609-L613 WeakPolarHBondContact O-CG 3.4Å; P609-L613 PolarHBondContact O-N 3.36Å; P609-L713 HydrophobicContact CB-CD1 4.14Å; P609-L713 HydrophobicContact CG-CD1 3.8Å; P609-L744 HydrophobicContact CB-CD1 4.33Å; P609-L744 HydrophobicContact CB-CD2 4.42Å
610	A	89.9	Confident	88.8	Confident	54 Å²	54	35.5 Å²	35.5	45%	0.446	20%	0.199	S	C	.	.	H	α-helix	trans	-63	-43.2	178.9	0	0	0	0	0	111.5	L606 A612 L613 W614	L606-A610 WeakPolarHBondContact O-CB 3.38Å; L606-A610 PolarHBondContact O-N 3.49Å; A610-A612 VanDerWaalsContact C-N 3.32Å; A610-A612 PolarHBondContact O-N 2.88Å; A610-L613 PolarHBondContact O-N 3.47Å; A610-W614 VanDerWaalsContact O-CB 3.29Å; A610-W614 WeakPolarHBondContact O-CB 3.46Å; A610-W614 PolarHBondContact O-N 2.93Å
611	G	91.1	Very high	87.8	Confident	5 Å²	5	41 Å²	41	5%	0.052	22%	0.219	C	C	.	.	H	α-helix	trans	-62.8	-35.9	174.6	0	0	0	0	0	113.2	I607 L608 P609 A615 H635	I607-G611 PolarHBondContact O-N 3.39Å; L608-G611 PolarHBondContact O-N 3.36Å; P609-G611 PolarHBondContact O-N 3.13Å; G611-A615 WeakPolarHBondContact O-CB 3.42Å; G611-A615 PolarHBondContact O-N 2.94Å; G611-H635 PolarHBondContact O-ND1 3.21Å
612	A	89.9	Confident	86.8	Confident	41 Å²	41	42.3 Å²	42.3	34%	0.339	23%	0.226	S	C	.	.	H	α-helix	trans	-72.4	-44.9	175.8	0	0	0	0	0	112.4	L608 P609 A610 A615 L616	L608-A612 WeakPolarHBondContact O-CB 3.49Å; L608-A612 PolarHBondContact O-N 3.27Å; P609-A612 PolarHBondContact O-N 3.47Å; A610-A612 VanDerWaalsContact C-N 3.32Å; A610-A612 PolarHBondContact O-N 2.88Å; A612-A615 WeakPolarHBondContact O-CB 3.29Å; A612-A615 PolarHBondContact O-N 3.18Å; A612-L616 WeakPolarHBondContact O-CB 3.3Å; A612-L616 PolarHBondContact O-N 3.27Å
613	L	88.1	Confident	85.2	Confident	28 Å²	28	44.5 Å²	44.5	15%	0.147	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-41.2	177.8	-73	173.4	0	0	0	111.7	P609 A610 L616 Y617 L744 A747 L748 I751	P609-L613 WeakPolarHBondContact O-CB 3.37Å; P609-L613 VanDerWaalsContact O-CG 3.31Å; P609-L613 WeakPolarHBondContact O-CG 3.4Å; P609-L613 PolarHBondContact O-N 3.36Å; A610-L613 PolarHBondContact O-N 3.47Å; L613-L616 PolarHBondContact O-N 3.42Å; L613-Y617 VanDerWaalsContact O-CB 3.32Å; L613-Y617 WeakPolarHBondContact O-CB 3.33Å; L613-Y617 PolarHBondContact O-N 2.77Å; L613-L744 HydrophobicContact CD1-CD2 3.85Å; L613-A747 HydrophobicContact CD1-CB 4.3Å; L613-L748 HydrophobicContact CD2-CB 4.24Å; L613-L748 HydrophobicContact CD2-CD1 3.69Å; L613-I751 HydrophobicContact CB-CD1 4.43Å; L613-I751 HydrophobicContact CD2-CD1 4.06Å
614	W	87.3	Confident	83.5	Confident	111 Å²	111	53.9 Å²	53.9	42%	0.42	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-44.4	174.1	179.4	-105.1	0	0	0	111.9	A610 Y617 K618	A610-W614 VanDerWaalsContact O-CB 3.29Å; A610-W614 WeakPolarHBondContact O-CB 3.46Å; A610-W614 PolarHBondContact O-N 2.93Å; W614-Y617 PolarHBondContact O-N 3.09Å; W614-K618 HydrophobicContact CD2-CG 4.2Å; W614-K618 HydrophobicContact CZ2-CD 4.3Å; W614-K618 HydrophobicContact CZ2-CG 4.11Å; W614-K618 WeakPolarHBondContact O-CB 3.4Å; W614-K618 PolarHBondContact O-N 3.34Å
615	A	86.9	Confident	81.5	Confident	9 Å²	9	62.3 Å²	62.3	7%	0.074	32%	0.317	C	S	.	.	H	α-helix	trans	-62.2	-42.9	175.9	0	0	0	0	0	111.6	G611 A612 S619 W631 H635	G611-A615 WeakPolarHBondContact O-CB 3.42Å; G611-A615 PolarHBondContact O-N 2.94Å; A612-A615 WeakPolarHBondContact O-CB 3.29Å; A612-A615 PolarHBondContact O-N 3.18Å; A615-S619 WeakPolarHBondContact O-CB 3.49Å; A615-S619 PolarHBondContact O-N 2.88Å; A615-S619 PolarHBondContact O-OG 3.1Å; A615-W631 HydrophobicContact CB-CE3 4.04Å; A615-W631 HydrophobicContact CB-CZ3 4.3Å; A615-H635 HydrophobicContact CB-CB 3.91Å
616	L	84.9	Confident	79.8	Confident	25 Å²	25	69.9 Å²	69.9	13%	0.131	35%	0.349	C	S	.	.	H	α-helix	trans	-62.5	-47.7	176.8	-170.5	66.7	0	0	0	111.4	A612 L613 S619 A620 F706 L748 I751 L755	A612-L616 WeakPolarHBondContact O-CB 3.3Å; A612-L616 PolarHBondContact O-N 3.27Å; L613-L616 PolarHBondContact O-N 3.42Å; L616-S619 PolarHBondContact O-OG 3.15Å; L616-S619 VanDerWaalsContact O-OG 3.04Å; L616-A620 WeakPolarHBondContact O-CB 3.45Å; L616-A620 PolarHBondContact O-N 3.42Å; L616-F706 HydrophobicContact CD1-CE2 3.94Å; L616-L748 HydrophobicContact CD2-CD1 4.16Å; L616-I751 HydrophobicContact CB-CG2 4.33Å; L616-I751 HydrophobicContact CD2-CB 4.42Å; L616-I751 HydrophobicContact CD2-CG2 3.66Å; L616-I751 HydrophobicContact CG-CG2 3.68Å; L616-L755 HydrophobicContact CD1-CD1 3.57Å; L616-L755 HydrophobicContact CD2-CD1 4.26Å; L616-L755 HydrophobicContact CG-CD1 3.82Å
617	Y	83.4	Confident	78	Confident	67 Å²	67	76 Å²	76	26%	0.263	37%	0.372	S	S	.	.	H	α-helix	trans	-62.7	-46.7	178.7	173.3	-107.9	0	0	0	112.8	L613 W614 A620 R621 I751	L613-Y617 VanDerWaalsContact O-CB 3.32Å; L613-Y617 WeakPolarHBondContact O-CB 3.33Å; L613-Y617 PolarHBondContact O-N 2.77Å; W614-Y617 PolarHBondContact O-N 3.09Å; Y617-A620 WeakPolarHBondContact O-CB 3.41Å; Y617-R621 VanDerWaalsContact CZ-CZ 3.49Å; Y617-R621 PolarHBondContact O-N 3.42Å; Y617-R621 PolarHBondContact OH-NE 3.2Å; Y617-R621 PolarHBondContact OH-NH1 3.23Å; Y617-R621 PolarHBondContact OH-NH2 3.13Å; Y617-R621 VanDerWaalsContact OH-NH2 3.14Å; Y617-I751 HydrophobicContact CD2-CG1 4.46Å
618	K	83.9	Confident	76.2	Confident	81 Å²	81	76.7 Å²	76.7	35%	0.352	38%	0.381	S	S	.	.	H	α-helix	trans	-71.7	-43	179.5	-74.4	-68.7	-171.1	175.8	0	112	W614 A620 R621 V622 W631	W614-K618 HydrophobicContact CD2-CG 4.2Å; W614-K618 HydrophobicContact CZ2-CD 4.3Å; W614-K618 HydrophobicContact CZ2-CG 4.11Å; W614-K618 WeakPolarHBondContact O-CB 3.4Å; W614-K618 PolarHBondContact O-N 3.34Å; K618-A620 PolarHBondContact O-N 3.34Å; K618-R621 PolarHBondContact O-N 3.03Å; K618-V622 WeakPolarHBondContact O-CG2 3.19Å; K618-V622 PolarHBondContact O-N 2.9Å; K618-W631 HydrophobicContact CB-CB 3.63Å; K618-W631 HydrophobicContact CB-CG 4.04Å; K618-W631 HydrophobicContact CG-CB 4.16Å
619	S	78.9	Confident	75	Confident	50 Å²	50	78.1 Å²	78.1	35%	0.35	40%	0.4	S	S	.	.	H	α-helix	trans	-60.9	-32.2	177	65	0	0	0	0	112.3	A615 L616 R621	A615-S619 WeakPolarHBondContact O-CB 3.49Å; A615-S619 PolarHBondContact O-N 2.88Å; A615-S619 PolarHBondContact O-OG 3.1Å; L616-S619 PolarHBondContact O-OG 3.15Å; L616-S619 VanDerWaalsContact O-OG 3.04Å; S619-R621 VanDerWaalsContact C-N 3.28Å; S619-R621 PolarHBondContact O-N 2.86Å
620	A	73.7	Confident	74.6	Confident	15 Å²	15	79.3 Å²	79.3	12%	0.124	41%	0.413	C	S	.	.	H	α-helix	trans	-62	-33.2	170.7	0	0	0	0	0	113.5	L616 Y617 K618 L755 R758	L616-A620 WeakPolarHBondContact O-CB 3.45Å; L616-A620 PolarHBondContact O-N 3.42Å; Y617-A620 WeakPolarHBondContact O-CB 3.41Å; K618-A620 PolarHBondContact O-N 3.34Å; A620-L755 HydrophobicContact CB-CD2 3.27Å; A620-L755 HydrophobicContact CB-CG 3.86Å; A620-R758 PolarHBondContact O-NH1 2.85Å
621	R	74.7	Confident	74.3	Confident	134 Å²	134	79.6 Å²	79.6	51%	0.506	40%	0.403	S	S	.	.	H	α-helix	trans	-92.2	-24.8	-173.3	-72.4	-167.4	175.8	-160.7	2.9	114	Y617 K618 S619 T623 R758	Y617-R621 VanDerWaalsContact CZ-CZ 3.49Å; Y617-R621 PolarHBondContact O-N 3.42Å; Y617-R621 PolarHBondContact OH-NE 3.2Å; Y617-R621 PolarHBondContact OH-NH1 3.23Å; Y617-R621 PolarHBondContact OH-NH2 3.13Å; Y617-R621 VanDerWaalsContact OH-NH2 3.14Å; K618-R621 PolarHBondContact O-N 3.03Å; S619-R621 VanDerWaalsContact C-N 3.28Å; S619-R621 PolarHBondContact O-N 2.86Å; R621-T623 PolarHBondContact O-N 3.19Å; R621-T623 VanDerWaalsContact O-N 3.14Å; R621-R758 PolarHBondContact O-NH1 3.23Å; R621-R758 VanDerWaalsContact O-NH1 3.17Å
622	V	69.3	Low	74	Confident	56 Å²	56	81.9 Å²	81.9	34%	0.339	42%	0.416	S	S	.	.			trans	-59.4	114.3	178.5	173	0	0	0	0	111.2	K618	K618-V622 WeakPolarHBondContact O-CG2 3.19Å; K618-V622 PolarHBondContact O-N 2.9Å
623	T	59.9	Low	73.9	Confident	73 Å²	73	85.7 Å²	85.7	45%	0.448	43%	0.428	S	S	.	.			trans	-81.4	148.8	168.9	11.5	0	0	0	0	110.4	R621 Q625 K626	R621-T623 PolarHBondContact O-N 3.19Å; R621-T623 VanDerWaalsContact O-N 3.14Å; T623-Q625 PolarHBondContact O-N 3.49Å; T623-K626 PolarHBondContact O-N 2.98Å; T623-K626 VanDerWaalsContact O-N 3.11Å
624	K	58.3	Low	74	Confident	197 Å²	197	87.3 Å²	87.3	86%	0.857	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-24.5	-178.7	-81.4	-174.1	175.6	-178.2	0	113.9
625	Q	54.1	Low	74.2	Confident	193 Å²	193	83.8 Å²	83.8	90%	0.902	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-13.2	-177.2	-76.5	-156.2	-23.1	0	0	116.6	T623	T623-Q625 PolarHBondContact O-N 3.49Å
626	K	53.4	Low	74.4	Confident	164 Å²	164	86.7 Å²	86.7	71%	0.713	45%	0.445	S	S	*	.			trans	-114.7	102	174.9	-87.8	-176.7	175.1	177.8	0	110.2	T623 S628	T623-K626 PolarHBondContact O-N 2.98Å; T623-K626 VanDerWaalsContact O-N 3.11Å; K626-S628 PolarHBondContact O-N 3.38Å
627	K	52.1	Low	74.7	Confident	218 Å²	218	90 Å²	90	95%	0.948	46%	0.461	S	S	*	.			trans	-67.6	70.2	166.2	-85.4	-175.5	176.8	174.9	0	110	G629	K627-G629 PolarHBondContact O-N 3.27Å
628	S	55.1	Low	75.2	Confident	67 Å²	67	87.8 Å²	87.8	47%	0.469	46%	0.457	S	S	.	.			trans	-83.9	92.6	168.3	177	0	0	0	0	108.4	K626 G630 W631	K626-S628 PolarHBondContact O-N 3.38Å; S628-G630 PolarHBondContact O-N 3.45Å; S628-W631 PolarHBondContact O-NE1 3.35Å
629	G	69.1	Low	75.7	Confident	44 Å²	44	85.8 Å²	85.8	45%	0.454	45%	0.449	S	S	.	.			trans	-75.1	0.2	170.9	0	0	0	0	0	114	K627 W631 T632 M633	K627-G629 PolarHBondContact O-N 3.27Å; G629-W631 PolarHBondContact O-N 2.96Å; G629-T632 PolarHBondContact O-N 2.97Å; G629-T632 PolarHBondContact O-OG1 3.08Å; G629-M633 PolarHBondContact O-N 3.41Å
630	G	82.7	Confident	76.3	Confident	34 Å²	34	86.8 Å²	86.8	35%	0.351	45%	0.453	S	S	.	.	H	α-helix	trans	-63	-38.8	-177	0	0	0	0	0	113.2	S628 T632 M633 T634	S628-G630 PolarHBondContact O-N 3.45Å; G630-T632 PolarHBondContact O-N 3.44Å; G630-M633 WeakPolarHBondContact O-CB 3.34Å; G630-M633 PolarHBondContact O-N 3.28Å; G630-T634 PolarHBondContact O-N 3Å; G630-T634 PolarHBondContact O-OG1 3.01Å; G630-T634 VanDerWaalsContact O-OG1 3.07Å
631	W	83.3	Confident	77.4	Confident	60 Å²	60	89.1 Å²	89.1	23%	0.227	47%	0.468	C	S	.	.	H	α-helix	trans	-67.9	-34.3	-179.5	69.5	-94.6	0	0	0	112.8	A615 K618 S628 G629 M633 T634 H635	A615-W631 HydrophobicContact CB-CE3 4.04Å; A615-W631 HydrophobicContact CB-CZ3 4.3Å; K618-W631 HydrophobicContact CB-CB 3.63Å; K618-W631 HydrophobicContact CB-CG 4.04Å; K618-W631 HydrophobicContact CG-CB 4.16Å; S628-W631 PolarHBondContact O-NE1 3.35Å; G629-W631 PolarHBondContact O-N 2.96Å; W631-M633 VanDerWaalsContact C-N 3.3Å; W631-T634 PolarHBondContact O-N 3.49Å; W631-H635 VanDerWaalsContact O-CB 3.3Å; W631-H635 WeakPolarHBondContact O-CB 3.38Å; W631-H635 PolarHBondContact O-N 2.86Å
632	T	85.4	Confident	78.4	Confident	53 Å²	53	82.8 Å²	82.8	33%	0.325	44%	0.444	S	S	.	.	H	α-helix	trans	-64.8	-39.2	174.5	35.7	0	0	0	0	110.7	G629 G630 H635 T636	G629-T632 PolarHBondContact O-N 2.97Å; G629-T632 PolarHBondContact O-OG1 3.08Å; G630-T632 PolarHBondContact O-N 3.44Å; T632-H635 PolarHBondContact O-N 3.23Å; T632-T636 PolarHBondContact O-N 3.3Å; T632-T636 PolarHBondContact O-OG1 3.26Å
633	M	88.2	Confident	79.6	Confident	120 Å²	120	82.1 Å²	82.1	59%	0.591	44%	0.437	S	S	*	.	H	α-helix	trans	-65.9	-48.9	176.7	-171.7	177.3	79.8	0	0	111.3	G629 G630 W631 H635 T636 I637	G629-M633 PolarHBondContact O-N 3.41Å; G630-M633 WeakPolarHBondContact O-CB 3.34Å; G630-M633 PolarHBondContact O-N 3.28Å; W631-M633 VanDerWaalsContact C-N 3.3Å; M633-H635 VanDerWaalsContact C-N 3.29Å; M633-H635 PolarHBondContact O-N 3.42Å; M633-T636 PolarHBondContact O-N 3.39Å; M633-I637 HydrophobicContact CG-CD1 3.85Å; M633-I637 HydrophobicContact CG-CG1 4.49Å; M633-I637 VanDerWaalsContact O-CG1 3.29Å; M633-I637 WeakPolarHBondContact O-CG1 3.27Å; M633-I637 PolarHBondContact O-N 2.84Å
634	T	89.1	Confident	81.3	Confident	63 Å²	63	83.2 Å²	83.2	39%	0.387	44%	0.444	S	S	.	.	H	α-helix	trans	-59.1	-41.1	176.4	-48.7	0	0	0	0	111.8	G630 W631 A638	G630-T634 PolarHBondContact O-N 3Å; G630-T634 PolarHBondContact O-OG1 3.01Å; G630-T634 VanDerWaalsContact O-OG1 3.07Å; W631-T634 PolarHBondContact O-N 3.49Å; T634-A638 WeakPolarHBondContact O-CB 3.35Å; T634-A638 PolarHBondContact O-N 3.04Å
635	H	91.2	Very high	83.2	Confident	36 Å²	36	75.9 Å²	75.9	17%	0.167	41%	0.414	C	S	.	.	H	α-helix	trans	-59.5	-54.4	175	177.3	70.3	0	0	0	111	G611 A615 W631 T632 M633 I637 A638 Q639	G611-H635 PolarHBondContact O-ND1 3.21Å; A615-H635 HydrophobicContact CB-CB 3.91Å; W631-H635 VanDerWaalsContact O-CB 3.3Å; W631-H635 WeakPolarHBondContact O-CB 3.38Å; W631-H635 PolarHBondContact O-N 2.86Å; T632-H635 PolarHBondContact O-N 3.23Å; M633-H635 VanDerWaalsContact C-N 3.29Å; M633-H635 PolarHBondContact O-N 3.42Å; H635-I637 VanDerWaalsContact C-N 3.34Å; H635-I637 PolarHBondContact O-N 3.37Å; H635-A638 PolarHBondContact O-N 3.36Å; H635-Q639 VanDerWaalsContact O-CG 3.28Å; H635-Q639 WeakPolarHBondContact O-CG 3.41Å; H635-Q639 PolarHBondContact O-N 3.34Å
636	T	90.9	Very high	85.2	Confident	71 Å²	71	66.9 Å²	66.9	44%	0.436	37%	0.372	S	S	.	.	H	α-helix	trans	-58.4	-44.3	-179.9	-58.6	0	0	0	0	111.8	T632 M633 Q639 T640	T632-T636 PolarHBondContact O-N 3.3Å; T632-T636 PolarHBondContact O-OG1 3.26Å; M633-T636 PolarHBondContact O-N 3.39Å; T636-Q639 PolarHBondContact O-N 3.46Å; T636-T640 WeakPolarHBondContact O-CB 3.26Å; T636-T640 PolarHBondContact O-N 2.88Å; T636-T640 PolarHBondContact O-OG1 3.31Å
637	I	92.6	Very high	87.3	Confident	94 Å²	94	61.8 Å²	61.8	48%	0.482	36%	0.36	S	S	.	.	H	α-helix	trans	-60.1	-50.5	177.6	-67.9	166.7	0	0	0	110.6	M633 H635 Q639 T640 C641	M633-I637 HydrophobicContact CG-CD1 3.85Å; M633-I637 HydrophobicContact CG-CG1 4.49Å; M633-I637 VanDerWaalsContact O-CG1 3.29Å; M633-I637 WeakPolarHBondContact O-CG1 3.27Å; M633-I637 PolarHBondContact O-N 2.84Å; H635-I637 VanDerWaalsContact C-N 3.34Å; H635-I637 PolarHBondContact O-N 3.37Å; I637-Q639 VanDerWaalsContact C-N 3.32Å; I637-Q639 PolarHBondContact O-N 3.16Å; I637-T640 PolarHBondContact O-N 3.01Å; I637-C641 WeakPolarHBondContact O-CB 3.39Å; I637-C641 PolarHBondContact O-N 3.46Å; I637-C641 PolarHBondContact O-SG 3.44Å; I637-C641 VanDerWaalsContact O-SG 3.33Å
638	A	93.6	Very high	89.4	Confident	21 Å²	21	53.5 Å²	53.5	17%	0.174	33%	0.332	C	S	.	.	H	α-helix	trans	-60.4	-41.5	178.9	0	0	0	0	0	112	I607 T634 H635 G642	I607-A638 VanDerWaalsContact CG2-O 3.3Å; I607-A638 WeakPolarHBondContact CG2-O 3.33Å; T634-A638 WeakPolarHBondContact O-CB 3.35Å; T634-A638 PolarHBondContact O-N 3.04Å; H635-A638 PolarHBondContact O-N 3.36Å; A638-G642 PolarHBondContact O-N 3.28Å
639	Q	93.6	Very high	91.2	Very high	38 Å²	38	50.3 Å²	50.3	18%	0.178	31%	0.31	C	S	.	.	H	α-helix	trans	-65.4	-46.4	176.7	-62	-39.4	-65.6	0	0	111.4	L608 H635 T636 I637 C641 G642 M643	L608-Q639 VanDerWaalsContact CD2-OE1 3.25Å; L608-Q639 PolarHBondContact O-NE2 2.99Å; H635-Q639 VanDerWaalsContact O-CG 3.28Å; H635-Q639 WeakPolarHBondContact O-CG 3.41Å; H635-Q639 PolarHBondContact O-N 3.34Å; T636-Q639 PolarHBondContact O-N 3.46Å; I637-Q639 VanDerWaalsContact C-N 3.32Å; I637-Q639 PolarHBondContact O-N 3.16Å; Q639-C641 PolarHBondContact O-N 3.04Å; Q639-G642 PolarHBondContact O-N 3.36Å; Q639-M643 VanDerWaalsContact O-CG 3.27Å; Q639-M643 WeakPolarHBondContact O-CG 3.43Å; Q639-M643 PolarHBondContact O-N 3.37Å
640	T	93.1	Very high	92.4	Very high	71 Å²	71	49.5 Å²	49.5	44%	0.436	30%	0.299	S	S	.	.	H	α-helix	trans	-61.3	-46	178.6	-57.8	0	0	0	0	111.7	T636 I637 G642 M643 V644	T636-T640 WeakPolarHBondContact O-CB 3.26Å; T636-T640 PolarHBondContact O-N 2.88Å; T636-T640 PolarHBondContact O-OG1 3.31Å; I637-T640 PolarHBondContact O-N 3.01Å; T640-G642 PolarHBondContact O-N 3.11Å; T640-M643 PolarHBondContact O-N 2.94Å; T640-V644 WeakPolarHBondContact O-CG2 3.45Å; T640-V644 PolarHBondContact O-N 3.26Å
641	C	95.1	Very high	92.8	Very high	65 Å²	65	52.4 Å²	52.4	44%	0.439	31%	0.31	S	S	.	.	H	α-helix	trans	-60.1	-45.6	175.7	-68.6	0	0	0	0	111.7	I637 Q639 M643 V644 I645	I637-C641 WeakPolarHBondContact O-CB 3.39Å; I637-C641 PolarHBondContact O-N 3.46Å; I637-C641 PolarHBondContact O-SG 3.44Å; I637-C641 VanDerWaalsContact O-SG 3.33Å; Q639-C641 PolarHBondContact O-N 3.04Å; C641-M643 VanDerWaalsContact C-N 3.34Å; C641-M643 PolarHBondContact O-N 3.46Å; C641-V644 PolarHBondContact O-N 3.35Å; C641-I645 WeakPolarHBondContact O-CG1 3.42Å; C641-I645 PolarHBondContact O-N 3.38Å; C641-I645 VanDerWaalsContact O-N 3.16Å
642	G	95.8	Very high	93.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.3	-40.1	175.9	0	0	0	0	0	112.6	S603 A638 Q639 T640 V644 I645 V646	S603-G642 PolarHBondContact OG-O 2.88Å; A638-G642 PolarHBondContact O-N 3.28Å; Q639-G642 PolarHBondContact O-N 3.36Å; T640-G642 PolarHBondContact O-N 3.11Å; G642-V644 PolarHBondContact O-N 3.32Å; G642-I645 PolarHBondContact O-N 2.9Å; G642-V646 VanDerWaalsContact O-CG2 3.31Å; G642-V646 WeakPolarHBondContact O-CG2 3.39Å; G642-V646 PolarHBondContact O-N 3.26Å
643	M	95	Very high	93.1	Very high	42 Å²	42	48.9 Å²	48.9	21%	0.207	30%	0.296	C	S	.	.	H	α-helix	trans	-63.6	-40.8	176.8	-72	-52.7	-60.5	0	0	112.9	Q639 T640 C641 I645 V646 A647 L679 V683	Q639-M643 VanDerWaalsContact O-CG 3.27Å; Q639-M643 WeakPolarHBondContact O-CG 3.43Å; Q639-M643 PolarHBondContact O-N 3.37Å; T640-M643 PolarHBondContact O-N 2.94Å; C641-M643 VanDerWaalsContact C-N 3.34Å; C641-M643 PolarHBondContact O-N 3.46Å; M643-I645 VanDerWaalsContact C-N 3.31Å; M643-I645 PolarHBondContact O-N 3.37Å; M643-V646 PolarHBondContact O-N 2.75Å; M643-A647 WeakPolarHBondContact O-CB 3.38Å; M643-A647 PolarHBondContact O-N 2.93Å; M643-L679 HydrophobicContact CE-CD2 3.94Å; M643-L679 HydrophobicContact CE-CG 3.96Å; M643-L679 HydrophobicContact SD-CD1 3.84Å; M643-L679 HydrophobicContact SD-CD2 3.4Å; M643-L679 WeakPolarHBondContact SD-CD2 3.41Å; M643-L679 HydrophobicContact SD-CG 3.46Å; M643-L679 WeakPolarHBondContact SD-CG 3.15Å; M643-V683 HydrophobicContact CE-CG2 4.12Å; M643-V683 HydrophobicContact CG-CG2 3.97Å; M643-V683 HydrophobicContact SD-CG2 3.76Å
644	V	96.5	Very high	93	Very high	96 Å²	96	47.5 Å²	47.5	58%	0.582	29%	0.29	S	S	*	.	H	α-helix	trans	-62	-42.6	176.4	172	0	0	0	0	110.5	T640 C641 G642 A647 A648	T640-V644 WeakPolarHBondContact O-CG2 3.45Å; T640-V644 PolarHBondContact O-N 3.26Å; C641-V644 PolarHBondContact O-N 3.35Å; G642-V644 PolarHBondContact O-N 3.32Å; V644-A647 PolarHBondContact O-N 3.02Å; V644-A648 PolarHBondContact O-N 2.91Å
645	I	96.8	Very high	92.7	Very high	43 Å²	43	48.5 Å²	48.5	22%	0.221	29%	0.291	C	S	.	.	H	α-helix	trans	-68.2	-40.1	177.8	-62.8	166.8	0	0	0	111.1	L599 S603 I607 C641 G642 M643 A647 A648 G649	L599-I645 HydrophobicContact CB-CG2 3.82Å; L599-I645 HydrophobicContact CD2-CG2 3.87Å; L599-I645 HydrophobicContact CG-CG2 4.42Å; L599-I645 VanDerWaalsContact O-CG2 3.26Å; L599-I645 WeakPolarHBondContact O-CG2 3.49Å; S603-I645 WeakPolarHBondContact OG-CB 3.46Å; S603-I645 WeakPolarHBondContact OG-CG2 3.18Å; I607-I645 HydrophobicContact CD1-CD1 3.41Å; I607-I645 VanDerWaalsContact CD1-CD1 3.41Å; C641-I645 WeakPolarHBondContact O-CG1 3.42Å; C641-I645 PolarHBondContact O-N 3.38Å; C641-I645 VanDerWaalsContact O-N 3.16Å; G642-I645 PolarHBondContact O-N 2.9Å; M643-I645 VanDerWaalsContact C-N 3.31Å; M643-I645 PolarHBondContact O-N 3.37Å; I645-A647 VanDerWaalsContact C-N 3.34Å; I645-A647 PolarHBondContact O-N 3.04Å; I645-A648 PolarHBondContact O-N 2.87Å; I645-G649 PolarHBondContact O-N 2.86Å
646	V	97.3	Very high	92.1	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.024	28%	0.284	C	S	.	.	H	α-helix	trans	-60.1	-43.9	173.9	168.9	0	0	0	0	111	M600 F604 L608 G642 M643 G649 A650 I676 L679	M600-V646 HydrophobicContact CE-CG1 4.38Å; M600-V646 HydrophobicContact SD-CB 4.48Å; M600-V646 HydrophobicContact SD-CG1 4.23Å; M600-V646 HydrophobicContact SD-CG2 4.43Å; F604-V646 HydrophobicContact CD2-CG2 4.31Å; F604-V646 HydrophobicContact CE2-CG1 4.27Å; F604-V646 HydrophobicContact CE2-CG2 3.75Å; F604-V646 HydrophobicContact CZ-CG1 4.32Å; F604-V646 HydrophobicContact CZ-CG2 3.99Å; L608-V646 HydrophobicContact CD1-CG2 4.34Å; G642-V646 VanDerWaalsContact O-CG2 3.31Å; G642-V646 WeakPolarHBondContact O-CG2 3.39Å; G642-V646 PolarHBondContact O-N 3.26Å; M643-V646 PolarHBondContact O-N 2.75Å; V646-G649 PolarHBondContact O-N 3.27Å; V646-A650 WeakPolarHBondContact O-CB 3.47Å; V646-A650 PolarHBondContact O-N 2.93Å; V646-I676 HydrophobicContact CG1-CG1 4.28Å; V646-L679 HydrophobicContact CG1-CD2 4.25Å; V646-L679 HydrophobicContact CG2-CD2 4.3Å
647	A	96.2	Very high	91.4	Very high	57 Å²	57	44.3 Å²	44.3	47%	0.471	27%	0.267	S	S	.	.	H	α-helix	trans	-62.1	-47	176.8	0	0	0	0	0	111.5	M643 V644 I645 G649 A650 V651	M643-A647 WeakPolarHBondContact O-CB 3.38Å; M643-A647 PolarHBondContact O-N 2.93Å; V644-A647 PolarHBondContact O-N 3.02Å; I645-A647 VanDerWaalsContact C-N 3.34Å; I645-A647 PolarHBondContact O-N 3.04Å; A647-G649 VanDerWaalsContact C-N 3.33Å; A647-G649 PolarHBondContact O-N 2.69Å; A647-A650 PolarHBondContact O-N 3.2Å; A647-V651 WeakPolarHBondContact O-CG2 3.4Å; A647-V651 PolarHBondContact O-N 3.33Å
648	A	96.1	Very high	90.4	Very high	44 Å²	44	47.8 Å²	47.8	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-59.6	-43.2	175.2	0	0	0	0	0	112	L599 V644 I645 A650 V651 C652	L599-A648 HydrophobicContact CD1-CB 4.25Å; V644-A648 PolarHBondContact O-N 2.91Å; I645-A648 PolarHBondContact O-N 2.87Å; A648-A650 PolarHBondContact O-N 3.43Å; A648-V651 PolarHBondContact O-N 2.85Å; A648-C652 PolarHBondContact O-N 3.32Å; A648-C652 PolarHBondContact O-SG 3.36Å
649	G	94.3	Very high	88.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-61.9	-40.6	174.9	0	0	0	0	0	112.7	H596 I645 V646 A647 C652 S653	H596-G649 PolarHBondContact ND1-O 3.35Å; I645-G649 PolarHBondContact O-N 2.86Å; V646-G649 PolarHBondContact O-N 3.27Å; A647-G649 VanDerWaalsContact C-N 3.33Å; A647-G649 PolarHBondContact O-N 2.69Å; G649-C652 WeakPolarHBondContact O-CB 3.36Å; G649-C652 PolarHBondContact O-N 3.46Å; G649-S653 PolarHBondContact O-N 3.3Å
650	A	92.8	Very high	87.4	Confident	27 Å²	27	50.5 Å²	50.5	22%	0.223	29%	0.287	C	S	.	.	H	α-helix	trans	-64.8	-42.4	176.9	0	0	0	0	0	111.7	M600 V646 A647 A648 C652 S653 I654 I676	M600-A650 HydrophobicContact CE-CB 4.1Å; V646-A650 WeakPolarHBondContact O-CB 3.47Å; V646-A650 PolarHBondContact O-N 2.93Å; A647-A650 PolarHBondContact O-N 3.2Å; A648-A650 PolarHBondContact O-N 3.43Å; A650-C652 VanDerWaalsContact C-N 3.35Å; A650-C652 PolarHBondContact O-N 2.85Å; A650-S653 WeakPolarHBondContact O-CB 3.47Å; A650-S653 PolarHBondContact O-N 3.42Å; A650-S653 VanDerWaalsContact O-N 3.16Å; A650-I654 WeakPolarHBondContact O-CG1 3.29Å; A650-I654 PolarHBondContact O-N 3.25Å; A650-I676 HydrophobicContact CB-CD1 4.35Å
651	V	91.7	Very high	85.7	Confident	95 Å²	95	50.1 Å²	50.1	58%	0.576	30%	0.296	S	S	*	.	H	α-helix	trans	-60.3	-44.5	174.1	173	0	0	0	0	111.1	A647 A648 S653 I654 Q655	A647-V651 WeakPolarHBondContact O-CG2 3.4Å; A647-V651 PolarHBondContact O-N 3.33Å; A648-V651 PolarHBondContact O-N 2.85Å; V651-S653 VanDerWaalsContact C-N 3.29Å; V651-S653 PolarHBondContact O-N 3.05Å; V651-I654 PolarHBondContact O-N 3.28Å; V651-Q655 WeakPolarHBondContact O-CB 3.45Å; V651-Q655 PolarHBondContact O-N 2.87Å
652	C	89.1	Confident	84.1	Confident	15 Å²	15	52 Å²	52	10%	0.101	30%	0.297	C	S	.	.	H	α-helix	trans	-56.8	-43	174.5	-65.6	0	0	0	0	111.5	L592 H596 A648 G649 A650 Q655 A656	L592-C652 HydrophobicContact CD1-CB 3.65Å; L592-C652 VanDerWaalsContact CD1-SG 3.56Å; L592-C652 WeakPolarHBondContact CD2-O 3.3Å; L592-C652 HydrophobicContact CG-CB 3.88Å; L592-C652 WeakPolarHBondContact CG-O 3.4Å; H596-C652 HydrophobicContact CB-CB 3.93Å; A648-C652 PolarHBondContact O-N 3.32Å; A648-C652 PolarHBondContact O-SG 3.36Å; G649-C652 WeakPolarHBondContact O-CB 3.36Å; G649-C652 PolarHBondContact O-N 3.46Å; A650-C652 VanDerWaalsContact C-N 3.35Å; A650-C652 PolarHBondContact O-N 2.85Å; C652-Q655 PolarHBondContact O-N 3.29Å; C652-A656 WeakPolarHBondContact O-CB 3.31Å; C652-A656 PolarHBondContact O-N 3.46Å
653	S	86.6	Confident	82.3	Confident	24 Å²	24	54.7 Å²	54.7	17%	0.168	31%	0.31	C	S	.	.	H	α-helix	trans	-62.2	-46	178.4	-161.5	0	0	0	0	112.8	G649 A650 V651 A656 K657	G649-S653 PolarHBondContact O-N 3.3Å; A650-S653 WeakPolarHBondContact O-CB 3.47Å; A650-S653 PolarHBondContact O-N 3.42Å; A650-S653 VanDerWaalsContact O-N 3.16Å; V651-S653 VanDerWaalsContact C-N 3.29Å; V651-S653 PolarHBondContact O-N 3.05Å; S653-A656 PolarHBondContact O-N 2.95Å; S653-K657 PolarHBondContact O-N 3.48Å
654	I	85.7	Confident	81	Confident	91 Å²	91	57.5 Å²	57.5	47%	0.467	32%	0.321	S	S	.	.	H	α-helix	trans	-62	-48	-179.9	-67.6	166.1	0	0	0	109.7	A650 V651 K657 R658 H663	A650-I654 WeakPolarHBondContact O-CG1 3.29Å; A650-I654 PolarHBondContact O-N 3.25Å; V651-I654 PolarHBondContact O-N 3.28Å; I654-K657 PolarHBondContact O-N 3.46Å; I654-R658 PolarHBondContact O-N 3.37Å; I654-H663 PolarHBondContact O-CE1 3.2Å
655	Q	82.8	Confident	80	Confident	84 Å²	84	55.4 Å²	55.4	39%	0.393	32%	0.319	S	S	.	.	H	α-helix	trans	-69.2	-37.8	-178	-174.9	66.9	12.7	0	0	112	L592 V651 C652 K657 R658	L592-Q655 HydrophobicContact CD2-CB 3.65Å; L592-Q655 HydrophobicContact CD2-CG 3.65Å; V651-Q655 WeakPolarHBondContact O-CB 3.45Å; V651-Q655 PolarHBondContact O-N 2.87Å; C652-Q655 PolarHBondContact O-N 3.29Å; Q655-K657 PolarHBondContact O-N 2.91Å; Q655-R658 WeakPolarHBondContact O-CB 3.45Å; Q655-R658 PolarHBondContact O-N 3.47Å
656	A	79.1	Confident	79.5	Confident	3 Å²	3	53.4 Å²	53.4	3%	0.025	31%	0.309	C	S	.	.	H	α-helix	trans	-64.8	-28.3	178.5	0	0	0	0	0	113.1	Q501 L592 L593 C652 S653	Q501-A656 PolarHBondContact NE2-O 3Å; L592-A656 HydrophobicContact CB-CB 4Å; L592-A656 HydrophobicContact CD2-CB 4.15Å; L592-A656 HydrophobicContact CG-CB 4.11Å; L593-A656 HydrophobicContact CB-CB 4.42Å; C652-A656 WeakPolarHBondContact O-CB 3.31Å; C652-A656 PolarHBondContact O-N 3.46Å; S653-A656 PolarHBondContact O-N 2.95Å
657	K	75.2	Confident	79.1	Confident	17 Å²	17	57.3 Å²	57.3	7%	0.074	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	0.1	-179.1	-72.9	-168.6	176.3	-173.3	0	114.6	S653 I654 Q655 D659 N660 H663	S653-K657 PolarHBondContact O-N 3.48Å; I654-K657 PolarHBondContact O-N 3.46Å; Q655-K657 PolarHBondContact O-N 2.91Å; K657-D659 PolarHBondContact O-N 2.94Å; K657-D659 VanDerWaalsContact O-N 3.16Å; K657-N660 PolarHBondContact O-N 3.35Å; K657-N660 VanDerWaalsContact O-N 3.07Å; K657-H663 VanDerWaalsContact C-CE1 3.49Å; K657-H663 WeakPolarHBondContact CD-O 3Å; K657-H663 PolarHBondContact NZ-O 3.35Å; K657-H663 PolarHBondContact O-CE1 2.91Å
658	R	72.2	Confident	78.8	Confident	167 Å²	167	55.9 Å²	55.9	63%	0.63	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-52.4	-38.2	-179.4	-173.9	174.3	178.9	160.4	-2.6	112.4	I654 Q655	I654-R658 PolarHBondContact O-N 3.37Å; Q655-R658 WeakPolarHBondContact O-CB 3.45Å; Q655-R658 PolarHBondContact O-N 3.47Å
659	D	61	Low	78.5	Confident	75 Å²	75	54.3 Å²	54.3	40%	0.401	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-87.8	-16.4	-175.9	-55	-21.9	0	0	0	113.2	S500 K657	S500-D659 VanDerWaalsContact CB-OD2 3.31Å; S500-D659 WeakPolarHBondContact CB-OD2 3.45Å; S500-D659 PolarHBondContact OG-OD2 3.48Å; K657-D659 PolarHBondContact O-N 2.94Å; K657-D659 VanDerWaalsContact O-N 3.16Å
660	N	63.5	Low	78.4	Confident	41 Å²	41	57.8 Å²	57.8	22%	0.219	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-94.1	0.3	-174.7	-70.3	-24.3	0	0	0	114.1	C444 K657 K662	C444-N660 WeakPolarHBondContact CB-OD1 3.44Å; C444-N660 PolarHBondContact SG-OD1 3.01Å; C444-N660 VanDerWaalsContact SG-OD1 3.34Å; K657-N660 PolarHBondContact O-N 3.35Å; K657-N660 VanDerWaalsContact O-N 3.07Å; N660-K662 PolarHBondContact O-N 2.99Å
661	G	57.9	Low	78.4	Confident	62 Å²	62	57.6 Å²	57.6	64%	0.639	32%	0.32	S	S	*	.	S	Bend	trans	68	-26.2	172.3	0	0	0	0	0	117.4
662	K	60.4	Low	78.5	Confident	104 Å²	104	53.6 Å²	53.6	45%	0.452	30%	0.298	S	S	.	.			trans	-112.7	75.4	-176.1	-63.9	-178.2	-175.8	174.2	0	111.3	D385 N660 F664	D385-K662 PolarHBondContact O-NZ 2.84Å; D385-K662 VanDerWaalsContact O-NZ 3.08Å; N660-K662 PolarHBondContact O-N 2.99Å; K662-F664 PolarHBondContact O-N 3.49Å
663	H	58.4	Low	78.7	Confident	57 Å²	57	56.7 Å²	56.7	26%	0.264	31%	0.313	S	S	.	.	S	Bend	trans	-57.8	-41	-176	-72.3	-85.8	0	0	0	114.1	I654 K657	I654-H663 PolarHBondContact O-CE1 3.2Å; K657-H663 VanDerWaalsContact C-CE1 3.49Å; K657-H663 WeakPolarHBondContact CD-O 3Å; K657-H663 PolarHBondContact NZ-O 3.35Å; K657-H663 PolarHBondContact O-CE1 2.91Å
664	F	68.1	Low	79.2	Confident	101 Å²	101	59.4 Å²	59.4	44%	0.443	33%	0.325	S	S	.	.	S	Bend	trans	-132.6	17.1	-163.2	-56.6	-65	0	0	0	116.5	K662 S666 V670 I673	K662-F664 PolarHBondContact O-N 3.49Å; F664-S666 VanDerWaalsContact C-N 3.3Å; F664-S666 PolarHBondContact O-N 2.86Å; F664-V670 WeakPolarHBondContact O-CG2 3.43Å; F664-I673 HydrophobicContact CB-CD1 4.09Å; F664-I673 HydrophobicContact CD1-CD1 3.41Å; F664-I673 VanDerWaalsContact CD1-CD1 3.41Å; F664-I673 HydrophobicContact CD1-CG1 4.15Å; F664-I673 HydrophobicContact CD2-CD1 4.37Å; F664-I673 HydrophobicContact CE1-CD1 3.86Å; F664-I673 HydrophobicContact CE1-CG1 4.26Å; F664-I673 HydrophobicContact CG-CD1 3.7Å
665	G	75.9	Confident	79.7	Confident	53 Å²	53	55.2 Å²	55.2	55%	0.546	30%	0.303	S	S	.	.			trans	-75.1	-10.5	-177.8	0	0	0	0	0	115.8
666	S	84.4	Confident	80.3	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.007	30%	0.297	C	S	.	.	S	Bend	trans	-88	153.9	-180	59.6	0	0	0	0	112.8	F664 H668 G669 V670	F664-S666 VanDerWaalsContact C-N 3.3Å; F664-S666 PolarHBondContact O-N 2.86Å; S666-H668 PolarHBondContact O-N 2.77Å; S666-G669 WeakPolarHBondContact O-CA 3.4Å; S666-G669 PolarHBondContact O-N 3.09Å; S666-G669 PolarHBondContact OG-N 3.16Å; S666-G669 VanDerWaalsContact OG-N 3.12Å; S666-V670 WeakPolarHBondContact O-CG2 3.49Å; S666-V670 PolarHBondContact O-N 3.39Å
667	V	88.8	Confident	81.1	Confident	85 Å²	85	56 Å²	56	52%	0.515	32%	0.316	S	S	.	.	H	α-helix	trans	-54.4	-41.9	172	-177.4	0	0	0	0	111.1	Y411 G669 V670 L671 L722	Y411-V667 HydrophobicContact CE2-CG2 4.38Å; V667-G669 PolarHBondContact O-N 3.28Å; V667-V670 PolarHBondContact O-N 3.13Å; V667-L671 WeakPolarHBondContact O-CB 3.07Å; V667-L671 PolarHBondContact O-N 2.88Å; V667-L722 HydrophobicContact CG1-CD1 4.01Å
668	H	90.7	Very high	82.1	Confident	27 Å²	27	57.5 Å²	57.5	13%	0.125	33%	0.325	C	S	.	.	H	α-helix	trans	-60	-43	173.4	173.8	73.5	0	0	0	113	H596 S666 G672 N719 L722 G723 L726	H596-H668 AromaticContact NE2-NE2 3.83Å; S666-H668 PolarHBondContact O-N 2.77Å; H668-G672 WeakPolarHBondContact O-CA 3.27Å; H668-G672 PolarHBondContact O-N 3.48Å; H668-N719 WeakPolarHBondContact CA-OD1 3.27Å; H668-N719 PolarHBondContact CE1-ND2 3.35Å; H668-N719 PolarHBondContact CE1-O 2.89Å; H668-N719 VanDerWaalsContact CE1-O 3.27Å; H668-N719 PolarHBondContact ND1-O 3.25Å; H668-N719 PolarHBondContact ND1-OD1 2.86Å; H668-N719 PolarHBondContact O-OD1 3.29Å; H668-L722 HydrophobicContact CB-CB 3.99Å; H668-G723 PolarHBondContact ND1-N 2.86Å; H668-L726 HydrophobicContact CB-CD1 3.61Å
669	G	90.2	Very high	83.2	Confident	11 Å²	11	49.9 Å²	49.9	11%	0.113	30%	0.297	C	S	.	.	H	α-helix	trans	-65.2	-47.7	178.9	0	0	0	0	0	111.9	S666 V667 G672 I673	S666-G669 WeakPolarHBondContact O-CA 3.4Å; S666-G669 PolarHBondContact O-N 3.09Å; S666-G669 PolarHBondContact OG-N 3.16Å; S666-G669 VanDerWaalsContact OG-N 3.12Å; V667-G669 PolarHBondContact O-N 3.28Å; G669-G672 PolarHBondContact O-N 3.45Å; G669-I673 WeakPolarHBondContact O-CG1 3.42Å; G669-I673 PolarHBondContact O-N 2.84Å
670	V	91.8	Very high	84.8	Confident	74 Å²	74	49.5 Å²	49.5	45%	0.448	30%	0.3	S	S	.	.	H	α-helix	trans	-63.1	-50.2	178.2	176.9	0	0	0	0	111	F664 S666 V667 G672 I673 I674	F664-V670 WeakPolarHBondContact O-CG2 3.43Å; S666-V670 WeakPolarHBondContact O-CG2 3.49Å; S666-V670 PolarHBondContact O-N 3.39Å; V667-V670 PolarHBondContact O-N 3.13Å; V670-G672 VanDerWaalsContact C-N 3.3Å; V670-G672 PolarHBondContact O-N 3.38Å; V670-I673 PolarHBondContact O-N 3.15Å; V670-I674 HydrophobicContact CG1-CD1 4.09Å; V670-I674 WeakPolarHBondContact O-CG1 3.4Å; V670-I674 PolarHBondContact O-N 3.42Å; V670-I674 VanDerWaalsContact O-N 3.08Å
671	L	93.3	Very high	86.3	Confident	22 Å²	22	51.1 Å²	51.1	12%	0.115	31%	0.311	C	S	.	.	H	α-helix	trans	-61.9	-40	177.4	-178.4	62.3	0	0	0	111.2	V667 I673 I674 V675 L715 L718 N719 L722	V667-L671 WeakPolarHBondContact O-CB 3.07Å; V667-L671 PolarHBondContact O-N 2.88Å; L671-I673 PolarHBondContact O-N 2.84Å; L671-I674 PolarHBondContact O-N 3.3Å; L671-V675 HydrophobicContact CD1-CG2 4.33Å; L671-V675 HydrophobicContact CG-CG2 4.36Å; L671-V675 WeakPolarHBondContact O-CB 3.4Å; L671-V675 VanDerWaalsContact O-CG2 3.29Å; L671-V675 WeakPolarHBondContact O-CG2 3.3Å; L671-V675 PolarHBondContact O-N 3.32Å; L671-L715 HydrophobicContact CD1-CB 4.42Å; L671-L715 HydrophobicContact CD1-CD2 4.11Å; L671-L718 HydrophobicContact CD2-CB 4.35Å; L671-L718 HydrophobicContact CD2-CD2 4.06Å; L671-L718 HydrophobicContact CD2-CG 4.06Å; L671-N719 HydrophobicContact CD2-CB 3.81Å; L671-N719 HydrophobicContact CG-CB 4.08Å; L671-L722 HydrophobicContact CD2-CD1 4Å
672	G	94.2	Very high	87.9	Confident	11 Å²	11	49 Å²	49	11%	0.113	28%	0.284	C	S	.	.	H	α-helix	trans	-59.7	-44	175.8	0	0	0	0	0	113.1	H668 G669 V670 V675 I676 N719	H668-G672 WeakPolarHBondContact O-CA 3.27Å; H668-G672 PolarHBondContact O-N 3.48Å; G669-G672 PolarHBondContact O-N 3.45Å; V670-G672 VanDerWaalsContact C-N 3.3Å; V670-G672 PolarHBondContact O-N 3.38Å; G672-V675 PolarHBondContact O-N 3.09Å; G672-I676 VanDerWaalsContact O-CG1 3.31Å; G672-I676 WeakPolarHBondContact O-CG1 3.23Å; G672-I676 PolarHBondContact O-N 3.49Å; G672-N719 VanDerWaalsContact CA-ND2 3.3Å; G672-N719 WeakPolarHBondContact CA-ND2 3.43Å
673	I	93.3	Very high	89.5	Confident	81 Å²	81	46.2 Å²	46.2	42%	0.415	28%	0.276	S	S	.	.	H	α-helix	trans	-61.5	-45.9	174.2	-68.9	163.6	0	0	0	110.6	F664 G669 V670 L671 V675 I676 A677	F664-I673 HydrophobicContact CB-CD1 4.09Å; F664-I673 HydrophobicContact CD1-CD1 3.41Å; F664-I673 VanDerWaalsContact CD1-CD1 3.41Å; F664-I673 HydrophobicContact CD1-CG1 4.15Å; F664-I673 HydrophobicContact CD2-CD1 4.37Å; F664-I673 HydrophobicContact CE1-CD1 3.86Å; F664-I673 HydrophobicContact CE1-CG1 4.26Å; F664-I673 HydrophobicContact CG-CD1 3.7Å; G669-I673 WeakPolarHBondContact O-CG1 3.42Å; G669-I673 PolarHBondContact O-N 2.84Å; V670-I673 PolarHBondContact O-N 3.15Å; L671-I673 PolarHBondContact O-N 2.84Å; I673-V675 VanDerWaalsContact C-N 3.35Å; I673-V675 PolarHBondContact O-N 2.86Å; I673-I676 PolarHBondContact O-N 2.95Å; I673-A677 WeakPolarHBondContact O-CB 3.44Å; I673-A677 PolarHBondContact O-N 2.97Å
674	I	95.3	Very high	91.1	Very high	81 Å²	81	46 Å²	46	42%	0.415	28%	0.283	S	S	.	.	H	α-helix	trans	-59.6	-46.7	178.2	-67	167	0	0	0	110.4	V670 L671 I676 A677 L678	V670-I674 HydrophobicContact CG1-CD1 4.09Å; V670-I674 WeakPolarHBondContact O-CG1 3.4Å; V670-I674 PolarHBondContact O-N 3.42Å; V670-I674 VanDerWaalsContact O-N 3.08Å; L671-I674 PolarHBondContact O-N 3.3Å; I674-I676 PolarHBondContact O-N 3.29Å; I674-A677 PolarHBondContact O-N 2.88Å; I674-L678 HydrophobicContact CG2-CD1 3.96Å; I674-L678 HydrophobicContact CG2-CG 4.33Å; I674-L678 WeakPolarHBondContact O-CB 3.39Å; I674-L678 VanDerWaalsContact O-CG 3.3Å; I674-L678 WeakPolarHBondContact O-CG 3.39Å; I674-L678 PolarHBondContact O-N 3.38Å
675	V	96.7	Very high	92.2	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-60.7	-45	178	169.7	0	0	0	0	111	F604 L671 G672 I673 L678 L679 L712 L715 A716	F604-V675 HydrophobicContact CD1-CG1 4.42Å; F604-V675 HydrophobicContact CE1-CG1 3.61Å; F604-V675 HydrophobicContact CE2-CG1 4.5Å; F604-V675 HydrophobicContact CZ-CG1 3.66Å; L671-V675 HydrophobicContact CD1-CG2 4.33Å; L671-V675 HydrophobicContact CG-CG2 4.36Å; L671-V675 WeakPolarHBondContact O-CB 3.4Å; L671-V675 VanDerWaalsContact O-CG2 3.29Å; L671-V675 WeakPolarHBondContact O-CG2 3.3Å; L671-V675 PolarHBondContact O-N 3.32Å; G672-V675 PolarHBondContact O-N 3.09Å; I673-V675 VanDerWaalsContact C-N 3.35Å; I673-V675 PolarHBondContact O-N 2.86Å; V675-L678 PolarHBondContact O-N 3.31Å; V675-L679 VanDerWaalsContact O-CB 3.29Å; V675-L679 WeakPolarHBondContact O-CB 3.03Å; V675-L679 PolarHBondContact O-N 2.85Å; V675-L712 HydrophobicContact CG1-CD1 4.27Å; V675-L712 WeakPolarHBondContact O-CD1 3.26Å; V675-L715 HydrophobicContact CG2-CB 3.84Å; V675-A716 HydrophobicContact CG1-CB 4.12Å
676	I	95.4	Very high	92.8	Very high	50 Å²	50	41.7 Å²	41.7	26%	0.256	26%	0.261	S	S	.	.	H	α-helix	trans	-64.2	-42.1	177.5	-68.8	169	0	0	0	111	M600 V646 A650 G672 I673 I674 L679 C680	M600-I676 HydrophobicContact CE-CD1 4.04Å; V646-I676 HydrophobicContact CG1-CG1 4.28Å; A650-I676 HydrophobicContact CB-CD1 4.35Å; G672-I676 VanDerWaalsContact O-CG1 3.31Å; G672-I676 WeakPolarHBondContact O-CG1 3.23Å; G672-I676 PolarHBondContact O-N 3.49Å; I673-I676 PolarHBondContact O-N 2.95Å; I674-I676 PolarHBondContact O-N 3.29Å; I676-L679 WeakPolarHBondContact O-CB 3.31Å; I676-L679 PolarHBondContact O-N 3.22Å; I676-C680 PolarHBondContact O-N 3.47Å; I676-C680 PolarHBondContact O-SG 2.97Å; I676-C680 VanDerWaalsContact O-SG 3.37Å
677	A	95.5	Very high	92.9	Very high	53 Å²	53	48.1 Å²	48.1	44%	0.438	29%	0.289	S	S	.	.	H	α-helix	trans	-62.8	-46.3	177.8	0	0	0	0	0	112	I673 I674 L679 C680 V681	I673-A677 WeakPolarHBondContact O-CB 3.44Å; I673-A677 PolarHBondContact O-N 2.97Å; I674-A677 PolarHBondContact O-N 2.88Å; A677-L679 VanDerWaalsContact C-N 3.29Å; A677-L679 PolarHBondContact O-N 3.31Å; A677-C680 WeakPolarHBondContact O-CB 3.28Å; A677-C680 PolarHBondContact O-N 3.19Å; A677-V681 WeakPolarHBondContact O-CG2 3.36Å; A677-V681 PolarHBondContact O-N 3.05Å
678	L	96.2	Very high	92.8	Very high	50 Å²	50	46.1 Å²	46.1	26%	0.262	28%	0.279	S	S	.	.	H	α-helix	trans	-63	-35.8	175.2	-68.3	176.7	0	0	0	111.8	I674 V675 V681 Q682 L708 L712 L715	I674-L678 HydrophobicContact CG2-CD1 3.96Å; I674-L678 HydrophobicContact CG2-CG 4.33Å; I674-L678 WeakPolarHBondContact O-CB 3.39Å; I674-L678 VanDerWaalsContact O-CG 3.3Å; I674-L678 WeakPolarHBondContact O-CG 3.39Å; I674-L678 PolarHBondContact O-N 3.38Å; V675-L678 PolarHBondContact O-N 3.31Å; L678-V681 PolarHBondContact O-N 3.07Å; L678-Q682 WeakPolarHBondContact O-CB 3.01Å; L678-Q682 PolarHBondContact O-N 2.92Å; L678-L708 HydrophobicContact CB-CD1 4.34Å; L678-L708 HydrophobicContact CD2-CD1 4.06Å; L678-L712 HydrophobicContact CB-CD1 3.47Å; L678-L712 VanDerWaalsContact CB-CD1 3.47Å; L678-L712 HydrophobicContact CD1-CD1 4.44Å; L678-L715 HydrophobicContact CD1-CD1 4.1Å
679	L	95.7	Very high	92.1	Very high	6 Å²	6	48.3 Å²	48.3	3%	0.031	29%	0.288	C	S	.	.	H	α-helix	trans	-65.9	-40.5	174.3	-178.9	62.5	0	0	0	111.8	F604 L608 M643 V646 V675 I676 A677 V681 Q682 V683 L712	F604-L679 HydrophobicContact CE1-CD2 3.88Å; F604-L679 HydrophobicContact CZ-CD2 3.8Å; L608-L679 HydrophobicContact CD1-CD1 4.42Å; L608-L679 HydrophobicContact CD1-CD2 4.24Å; M643-L679 HydrophobicContact CE-CD2 3.94Å; M643-L679 HydrophobicContact CE-CG 3.96Å; M643-L679 HydrophobicContact SD-CD1 3.84Å; M643-L679 HydrophobicContact SD-CD2 3.4Å; M643-L679 WeakPolarHBondContact SD-CD2 3.41Å; M643-L679 HydrophobicContact SD-CG 3.46Å; M643-L679 WeakPolarHBondContact SD-CG 3.15Å; V646-L679 HydrophobicContact CG1-CD2 4.25Å; V646-L679 HydrophobicContact CG2-CD2 4.3Å; V675-L679 VanDerWaalsContact O-CB 3.29Å; V675-L679 WeakPolarHBondContact O-CB 3.03Å; V675-L679 PolarHBondContact O-N 2.85Å; I676-L679 WeakPolarHBondContact O-CB 3.31Å; I676-L679 PolarHBondContact O-N 3.22Å; A677-L679 VanDerWaalsContact C-N 3.29Å; A677-L679 PolarHBondContact O-N 3.31Å; L679-V681 PolarHBondContact O-N 3.33Å; L679-Q682 WeakPolarHBondContact O-CB 3.48Å; L679-Q682 PolarHBondContact O-N 3.21Å; L679-Q682 VanDerWaalsContact O-N 3.17Å; L679-V683 WeakPolarHBondContact O-CG2 2.84Å; L679-V683 PolarHBondContact O-N 3.02Å; L679-L712 HydrophobicContact CB-CD1 4.35Å; L679-L712 HydrophobicContact CB-CD2 4.35Å; L679-L712 HydrophobicContact CD1-CD2 3.94Å
680	C	94.5	Very high	91.4	Very high	68 Å²	68	53.1 Å²	53.1	46%	0.459	32%	0.32	S	S	.	.	H	α-helix	trans	-61.4	-42.8	173.3	-70.9	0	0	0	0	112	I676 A677 Q682 V683 A684	I676-C680 PolarHBondContact O-N 3.47Å; I676-C680 PolarHBondContact O-SG 2.97Å; I676-C680 VanDerWaalsContact O-SG 3.37Å; A677-C680 WeakPolarHBondContact O-CB 3.28Å; A677-C680 PolarHBondContact O-N 3.19Å; C680-Q682 VanDerWaalsContact C-N 3.29Å; C680-Q682 PolarHBondContact O-N 3.42Å; C680-V683 PolarHBondContact O-N 3.49Å; C680-A684 PolarHBondContact O-N 3.39Å
681	V	94.9	Very high	91	Very high	75 Å²	75	56.6 Å²	56.6	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-60.5	-42.1	173.2	174.3	0	0	0	0	110.7	A677 L678 L679 V683 A684 L685 L708	A677-V681 WeakPolarHBondContact O-CG2 3.36Å; A677-V681 PolarHBondContact O-N 3.05Å; L678-V681 PolarHBondContact O-N 3.07Å; L679-V681 PolarHBondContact O-N 3.33Å; V681-V683 VanDerWaalsContact C-N 3.35Å; V681-V683 PolarHBondContact O-N 3.06Å; V681-A684 PolarHBondContact O-N 3.22Å; V681-L685 HydrophobicContact CG1-CD1 4.16Å; V681-L685 HydrophobicContact CG1-CG 4.41Å; V681-L685 WeakPolarHBondContact O-CG 3.21Å; V681-L685 PolarHBondContact O-N 2.95Å; V681-L708 HydrophobicContact CB-CD2 4.27Å; V681-L708 HydrophobicContact CG1-CD2 3.89Å
682	Q	93.3	Very high	90.5	Very high	16 Å²	16	57.6 Å²	57.6	8%	0.075	34%	0.34	C	S	.	.	H	α-helix	trans	-61.8	-42.3	179	-177.8	70	-41.9	0	0	112.8	L678 L679 C680 G686 H705 L708 A709	L678-Q682 WeakPolarHBondContact O-CB 3.01Å; L678-Q682 PolarHBondContact O-N 2.92Å; L679-Q682 WeakPolarHBondContact O-CB 3.48Å; L679-Q682 PolarHBondContact O-N 3.21Å; L679-Q682 VanDerWaalsContact O-N 3.17Å; C680-Q682 VanDerWaalsContact C-N 3.29Å; C680-Q682 PolarHBondContact O-N 3.42Å; Q682-G686 PolarHBondContact O-N 3.41Å; Q682-G686 VanDerWaalsContact O-N 3.1Å; Q682-H705 VanDerWaalsContact CD-CE1 3.46Å; Q682-H705 PolarHBondContact NE2-O 3.11Å; Q682-H705 PolarHBondContact O-CE1 3.34Å; Q682-H705 PolarHBondContact O-ND1 2.86Å; Q682-H705 VanDerWaalsContact O-ND1 3.17Å; Q682-H705 VanDerWaalsContact OE1-CA 3.3Å; Q682-H705 PolarHBondContact OE1-ND1 3.24Å; Q682-H705 PolarHBondContact OE1-O 3.24Å; Q682-L708 HydrophobicContact CB-CD2 3.91Å; Q682-L708 HydrophobicContact CB-CG 4.44Å; Q682-A709 VanDerWaalsContact NE2-CB 3.3Å
683	V	92.7	Very high	89.8	Confident	47 Å²	47	68.9 Å²	68.9	29%	0.285	38%	0.379	S	S	.	.	H	α-helix	trans	-63.9	-46	174.8	172.5	0	0	0	0	110.5	M643 L679 C680 V681 L685 G686 F687	M643-V683 HydrophobicContact CE-CG2 4.12Å; M643-V683 HydrophobicContact CG-CG2 3.97Å; M643-V683 HydrophobicContact SD-CG2 3.76Å; L679-V683 WeakPolarHBondContact O-CG2 2.84Å; L679-V683 PolarHBondContact O-N 3.02Å; C680-V683 PolarHBondContact O-N 3.49Å; V681-V683 VanDerWaalsContact C-N 3.35Å; V681-V683 PolarHBondContact O-N 3.06Å; V683-L685 PolarHBondContact O-N 3.17Å; V683-G686 WeakPolarHBondContact O-CA 3.48Å; V683-G686 PolarHBondContact O-N 3.25Å; V683-F687 HydrophobicContact CG1-CD2 3.76Å; V683-F687 HydrophobicContact CG1-CE2 3.59Å; V683-F687 WeakPolarHBondContact O-CD2 3.4Å; V683-F687 PolarHBondContact O-N 3.37Å; V683-F687 VanDerWaalsContact O-N 3.09Å
684	A	91.6	Very high	89.4	Confident	51 Å²	51	68.3 Å²	68.3	42%	0.421	38%	0.379	S	S	.	.	H	α-helix	trans	-57.6	-47.7	177.3	0	0	0	0	0	111.7	C680 V681 G686 F687 S688	C680-A684 PolarHBondContact O-N 3.39Å; V681-A684 PolarHBondContact O-N 3.22Å; A684-G686 PolarHBondContact O-N 2.92Å; A684-F687 PolarHBondContact O-N 2.91Å; A684-F687 VanDerWaalsContact O-N 3.13Å; A684-S688 WeakPolarHBondContact O-CB 3.36Å; A684-S688 PolarHBondContact O-N 3.43Å; A684-S688 PolarHBondContact O-OG 2.95Å
685	L	91.6	Very high	88.9	Confident	30 Å²	30	70.6 Å²	70.6	16%	0.157	39%	0.388	C	S	.	.	H	α-helix	trans	-58.6	-36.1	175.3	-69.3	172.4	0	0	0	112.5	V681 V683 I701 V704 H705 L708	V681-L685 HydrophobicContact CG1-CD1 4.16Å; V681-L685 HydrophobicContact CG1-CG 4.41Å; V681-L685 WeakPolarHBondContact O-CG 3.21Å; V681-L685 PolarHBondContact O-N 2.95Å; V683-L685 PolarHBondContact O-N 3.17Å; L685-I701 HydrophobicContact CB-CG2 4.26Å; L685-I701 HydrophobicContact CD2-CD1 4.43Å; L685-I701 HydrophobicContact CD2-CG2 4.22Å; L685-I701 WeakPolarHBondContact O-CG2 3.47Å; L685-V704 HydrophobicContact CD1-CB 4.42Å; L685-V704 HydrophobicContact CD1-CG1 3.7Å; L685-H705 HydrophobicContact CB-CB 4.3Å; L685-L708 HydrophobicContact CD1-CD2 4.04Å
686	G	88.3	Confident	88.5	Confident	34 Å²	34	73.2 Å²	73.2	35%	0.351	41%	0.41	S	S	.	.	H	α-helix	trans	-61.3	-45.2	174.7	0	0	0	0	0	112.8	Q682 V683 A684 K689	Q682-G686 PolarHBondContact O-N 3.41Å; Q682-G686 VanDerWaalsContact O-N 3.1Å; V683-G686 WeakPolarHBondContact O-CA 3.48Å; V683-G686 PolarHBondContact O-N 3.25Å; A684-G686 PolarHBondContact O-N 2.92Å; G686-K689 VanDerWaalsContact O-CB 3.31Å; G686-K689 WeakPolarHBondContact O-CB 3.34Å
687	F	86.6	Confident	88.1	Confident	137 Å²	137	75.9 Å²	75.9	60%	0.601	42%	0.422	S	S	*	.	H	α-helix	trans	-76.3	-37.2	178.5	-76.2	-72.1	0	0	0	113.4	V683 A684 K689 S690	V683-F687 HydrophobicContact CG1-CD2 3.76Å; V683-F687 HydrophobicContact CG1-CE2 3.59Å; V683-F687 WeakPolarHBondContact O-CD2 3.4Å; V683-F687 PolarHBondContact O-N 3.37Å; V683-F687 VanDerWaalsContact O-N 3.09Å; A684-F687 PolarHBondContact O-N 2.91Å; A684-F687 VanDerWaalsContact O-N 3.13Å; F687-K689 PolarHBondContact O-N 3.2Å; F687-S690 PolarHBondContact O-N 3.2Å
688	S	86.3	Confident	87.7	Confident	43 Å²	43	79.2 Å²	79.2	30%	0.301	42%	0.423	S	S	.	.	H	α-helix	trans	-57.2	-23.3	176.9	-59.9	0	0	0	0	112.7	A684 S690 L691 I692	A684-S688 WeakPolarHBondContact O-CB 3.36Å; A684-S688 PolarHBondContact O-N 3.43Å; A684-S688 PolarHBondContact O-OG 2.95Å; S688-S690 PolarHBondContact O-N 3.18Å; S688-L691 PolarHBondContact O-N 2.72Å; S688-L691 VanDerWaalsContact O-N 3.09Å; S688-I692 WeakPolarHBondContact O-CD1 3.47Å; S688-I692 WeakPolarHBondContact O-CG1 3.46Å; S688-I692 PolarHBondContact O-N 3.48Å
689	K	77.1	Confident	87.3	Confident	72 Å²	72	83 Å²	83	31%	0.313	43%	0.434	S	S	.	.	H	α-helix	trans	-55.9	-31	174.6	-174.1	175.7	176.7	173.9	0	113.9	G686 F687	G686-K689 VanDerWaalsContact O-CB 3.31Å; G686-K689 WeakPolarHBondContact O-CB 3.34Å; F687-K689 PolarHBondContact O-N 3.2Å
690	S	76.1	Confident	86.9	Confident	113 Å²	113	86.5 Å²	86.5	79%	0.79	46%	0.455	S	S	*	.	H	α-helix	trans	-78.8	-25.8	179.6	-162.8	0	0	0	0	112.6	F687 S688	F687-S690 PolarHBondContact O-N 3.2Å; S688-S690 PolarHBondContact O-N 3.18Å
691	L	81.9	Confident	86.6	Confident	147 Å²	147	84.8 Å²	84.8	77%	0.77	44%	0.441	S	S	*	.	H	α-helix	trans	-88.2	-13.4	-173.1	-62.5	172.7	0	0	0	113.3	S688	S688-L691 PolarHBondContact O-N 2.72Å; S688-L691 VanDerWaalsContact O-N 3.09Å
692	I	83.1	Confident	86.2	Confident	42 Å²	42	84 Å²	84	22%	0.215	44%	0.435	C	S	.	.			trans	-92.9	127.8	-170.9	-71.3	165.7	0	0	0	111.8	S688 T694 Q697 R698 I701	S688-I692 WeakPolarHBondContact O-CD1 3.47Å; S688-I692 WeakPolarHBondContact O-CG1 3.46Å; S688-I692 PolarHBondContact O-N 3.48Å; I692-T694 WeakPolarHBondContact CG2-O 3.4Å; I692-Q697 HydrophobicContact CG2-CB 3.49Å; I692-Q697 VanDerWaalsContact CG2-CB 3.49Å; I692-R698 HydrophobicContact CG2-CB 4.41Å; I692-I701 HydrophobicContact CD1-CD1 3.11Å; I692-I701 HydrophobicContact CD1-CG1 3.97Å
693	R	78.8	Confident	86	Confident	249 Å²	249	91.3 Å²	91.3	94%	0.94	46%	0.461	S	S	*	.			trans	-86	-34.3	-179.8	-70.8	-179.4	168.1	170.3	-3.8	114
694	T	86.6	Confident	86	Confident	68 Å²	68	92.5 Å²	92.5	42%	0.417	47%	0.469	S	S	.	.			trans	-88.4	138.9	-173.3	75.7	0	0	0	0	112.3	I692 A696 Q697 R698	I692-T694 WeakPolarHBondContact CG2-O 3.4Å; T694-A696 VanDerWaalsContact C-N 3.3Å; T694-A696 PolarHBondContact O-N 2.92Å; T694-Q697 PolarHBondContact O-N 3.34Å; T694-Q697 VanDerWaalsContact OG1-CB 3.24Å; T694-Q697 WeakPolarHBondContact OG1-CB 3.49Å; T694-Q697 WeakPolarHBondContact OG1-CG 3.31Å; T694-Q697 PolarHBondContact OG1-N 2.89Å; T694-Q697 PolarHBondContact OG1-OE1 3.48Å; T694-R698 PolarHBondContact O-N 3.29Å; T694-R698 VanDerWaalsContact O-N 3.14Å
695	E	84.8	Confident	86	Confident	129 Å²	129	92.3 Å²	92.3	60%	0.603	46%	0.459	S	S	*	.	H	α-helix	trans	-66.2	-33.6	179.5	-166.7	-169.7	-150.4	0	0	112.2	R698 R699	E695-R698 PolarHBondContact O-N 3.16Å; E695-R699 WeakPolarHBondContact O-CG 3.4Å; E695-R699 PolarHBondContact O-N 2.99Å; E695-R699 IonicContact OE2-CZ 3.5Å; E695-R699 IonicContact OE2-NE 2.8Å; E695-R699 IonicContact OE2-NH2 3.65Å; E695-R699 PolarHBondContact OE2-NH2 3.29Å
696	A	87.8	Confident	85.8	Confident	58 Å²	58	94.4 Å²	94.4	48%	0.479	47%	0.467	S	S	.	.	H	α-helix	trans	-64.6	-46.4	178.6	0	0	0	0	0	112.2	T694 R699 T700	T694-A696 VanDerWaalsContact C-N 3.3Å; T694-A696 PolarHBondContact O-N 2.92Å; A696-R699 PolarHBondContact O-N 3.37Å; A696-T700 PolarHBondContact O-N 3.03Å; A696-T700 PolarHBondContact O-OG1 3.05Å
697	Q	87.2	Confident	85.9	Confident	105 Å²	105	100.5 Å²	100.5	49%	0.491	48%	0.48	S	S	.	.	H	α-helix	trans	-63.4	-43.6	175.1	-72.5	169.8	-36.3	0	0	110.9	I692 T694 R699 T700 I701	I692-Q697 HydrophobicContact CG2-CB 3.49Å; I692-Q697 VanDerWaalsContact CG2-CB 3.49Å; T694-Q697 PolarHBondContact O-N 3.34Å; T694-Q697 VanDerWaalsContact OG1-CB 3.24Å; T694-Q697 WeakPolarHBondContact OG1-CB 3.49Å; T694-Q697 WeakPolarHBondContact OG1-CG 3.31Å; T694-Q697 PolarHBondContact OG1-N 2.89Å; T694-Q697 PolarHBondContact OG1-OE1 3.48Å; Q697-R699 VanDerWaalsContact C-N 3.31Å; Q697-R699 PolarHBondContact O-N 3.34Å; Q697-T700 PolarHBondContact O-N 3.43Å; Q697-T700 VanDerWaalsContact O-N 3.1Å; Q697-I701 PolarHBondContact O-N 3.44Å
698	R	86.6	Confident	86.2	Confident	124 Å²	124	95.2 Å²	95.2	47%	0.468	46%	0.458	S	S	.	.	H	α-helix	trans	-59	-41	176.8	-170.8	-179.7	-177.1	-137	5	112.1	I692 T694 E695 N702	I692-R698 HydrophobicContact CG2-CB 4.41Å; T694-R698 PolarHBondContact O-N 3.29Å; T694-R698 VanDerWaalsContact O-N 3.14Å; E695-R698 PolarHBondContact O-N 3.16Å; R698-N702 WeakPolarHBondContact O-CB 3.46Å; R698-N702 PolarHBondContact O-N 3.49Å; R698-N702 PolarHBondContact O-ND2 3.47Å
699	R	86.9	Confident	86.4	Confident	130 Å²	130	94.9 Å²	94.9	49%	0.491	46%	0.457	S	S	.	.	H	α-helix	trans	-62.6	-42.4	174.5	-82	-174.8	-96.8	166.1	-13.4	111.9	E695 A696 Q697 R703	E695-R699 WeakPolarHBondContact O-CG 3.4Å; E695-R699 PolarHBondContact O-N 2.99Å; E695-R699 IonicContact OE2-CZ 3.5Å; E695-R699 IonicContact OE2-NE 2.8Å; E695-R699 IonicContact OE2-NH2 3.65Å; E695-R699 PolarHBondContact OE2-NH2 3.29Å; A696-R699 PolarHBondContact O-N 3.37Å; Q697-R699 VanDerWaalsContact C-N 3.31Å; Q697-R699 PolarHBondContact O-N 3.34Å; R699-R703 WeakPolarHBondContact O-CG 2.99Å; R699-R703 PolarHBondContact O-N 2.89Å
700	T	88	Confident	86.9	Confident	79 Å²	79	94 Å²	94	49%	0.485	46%	0.455	S	S	.	.	H	α-helix	trans	-65.6	-49.3	179.2	-56	0	0	0	0	111.4	A696 Q697 N702 R703 V704	A696-T700 PolarHBondContact O-N 3.03Å; A696-T700 PolarHBondContact O-OG1 3.05Å; Q697-T700 PolarHBondContact O-N 3.43Å; Q697-T700 VanDerWaalsContact O-N 3.1Å; T700-N702 VanDerWaalsContact C-N 3.33Å; T700-N702 PolarHBondContact O-N 3.43Å; T700-R703 WeakPolarHBondContact O-CB 3.31Å; T700-R703 PolarHBondContact O-N 2.81Å; T700-V704 HydrophobicContact CG2-CG2 4.49Å; T700-V704 WeakPolarHBondContact O-CG2 3.21Å; T700-V704 PolarHBondContact O-N 3.47Å
701	I	89	Confident	87.5	Confident	31 Å²	31	92.4 Å²	92.4	16%	0.159	44%	0.441	C	S	.	.	H	α-helix	trans	-59.6	-42.5	176.9	-67.3	-155.8	0	0	0	111.8	L685 I692 Q697 R703 V704 H705	L685-I701 HydrophobicContact CB-CG2 4.26Å; L685-I701 HydrophobicContact CD2-CD1 4.43Å; L685-I701 HydrophobicContact CD2-CG2 4.22Å; L685-I701 WeakPolarHBondContact O-CG2 3.47Å; I692-I701 HydrophobicContact CD1-CD1 3.11Å; I692-I701 HydrophobicContact CD1-CG1 3.97Å; Q697-I701 PolarHBondContact O-N 3.44Å; I701-R703 PolarHBondContact O-N 2.89Å; I701-V704 PolarHBondContact O-N 2.84Å; I701-H705 WeakPolarHBondContact O-CB 3.36Å; I701-H705 PolarHBondContact O-N 2.98Å
702	N	86.7	Confident	88.1	Confident	60 Å²	60	86.1 Å²	86.1	32%	0.321	41%	0.408	S	S	.	.	H	α-helix	trans	-60.6	-34.9	176.6	-72.6	-36.8	0	0	0	112.2	R698 T700 F706	R698-N702 WeakPolarHBondContact O-CB 3.46Å; R698-N702 PolarHBondContact O-N 3.49Å; R698-N702 PolarHBondContact O-ND2 3.47Å; T700-N702 VanDerWaalsContact C-N 3.33Å; T700-N702 PolarHBondContact O-N 3.43Å; N702-F706 VanDerWaalsContact O-CB 3.27Å; N702-F706 WeakPolarHBondContact O-CB 3.31Å; N702-F706 PolarHBondContact O-N 3.28Å
703	R	88.2	Confident	88.4	Confident	168 Å²	168	86 Å²	86	63%	0.634	41%	0.408	S	S	*	.	H	α-helix	trans	-69.7	-47	175.3	-70.1	177	-168.9	174.9	2.5	111.3	R699 T700 I701 F706 W707	R699-R703 WeakPolarHBondContact O-CG 2.99Å; R699-R703 PolarHBondContact O-N 2.89Å; T700-R703 WeakPolarHBondContact O-CB 3.31Å; T700-R703 PolarHBondContact O-N 2.81Å; I701-R703 PolarHBondContact O-N 2.89Å; R703-F706 PolarHBondContact O-N 3.21Å; R703-W707 VanDerWaalsContact O-CD1 3.26Å; R703-W707 PolarHBondContact O-N 3.36Å
704	V	91.7	Very high	88.9	Confident	73 Å²	73	77.7 Å²	77.7	44%	0.442	39%	0.385	S	S	.	.	H	α-helix	trans	-62.3	-47.9	179.2	179	0	0	0	0	110.2	L685 T700 I701 F706 W707 L708	L685-V704 HydrophobicContact CD1-CB 4.42Å; L685-V704 HydrophobicContact CD1-CG1 3.7Å; T700-V704 HydrophobicContact CG2-CG2 4.49Å; T700-V704 WeakPolarHBondContact O-CG2 3.21Å; T700-V704 PolarHBondContact O-N 3.47Å; I701-V704 PolarHBondContact O-N 2.84Å; V704-F706 VanDerWaalsContact C-N 3.34Å; V704-F706 PolarHBondContact O-N 3.03Å; V704-W707 PolarHBondContact O-N 3.24Å; V704-L708 WeakPolarHBondContact O-CB 3.38Å; V704-L708 PolarHBondContact O-N 3Å
705	H	91.8	Very high	89.2	Confident	47 Å²	47	76.7 Å²	76.7	22%	0.218	38%	0.378	C	S	.	.	H	α-helix	trans	-57.5	-45.7	176	-178	80.7	0	0	0	111.5	Q682 L685 I701 A709	Q682-H705 VanDerWaalsContact CD-CE1 3.46Å; Q682-H705 PolarHBondContact NE2-O 3.11Å; Q682-H705 PolarHBondContact O-CE1 3.34Å; Q682-H705 PolarHBondContact O-ND1 2.86Å; Q682-H705 VanDerWaalsContact O-ND1 3.17Å; Q682-H705 VanDerWaalsContact OE1-CA 3.3Å; Q682-H705 PolarHBondContact OE1-ND1 3.24Å; Q682-H705 PolarHBondContact OE1-O 3.24Å; L685-H705 HydrophobicContact CB-CB 4.3Å; I701-H705 WeakPolarHBondContact O-CB 3.36Å; I701-H705 PolarHBondContact O-N 2.98Å; H705-A709 PolarHBondContact O-N 3.23Å
706	F	89.2	Confident	89.6	Confident	73 Å²	73	70.7 Å²	70.7	32%	0.32	35%	0.35	S	S	.	.	H	α-helix	trans	-61.8	-50.9	177.1	176.3	-97.3	0	0	0	112.7	L616 N702 R703 V704 A709 I710	L616-F706 HydrophobicContact CD1-CE2 3.94Å; N702-F706 VanDerWaalsContact O-CB 3.27Å; N702-F706 WeakPolarHBondContact O-CB 3.31Å; N702-F706 PolarHBondContact O-N 3.28Å; R703-F706 PolarHBondContact O-N 3.21Å; V704-F706 VanDerWaalsContact C-N 3.34Å; V704-F706 PolarHBondContact O-N 3.03Å; F706-A709 VanDerWaalsContact O-CB 3.31Å; F706-A709 WeakPolarHBondContact O-CB 3.38Å; F706-A709 PolarHBondContact O-N 3.03Å; F706-I710 HydrophobicContact CD1-CG1 4.49Å; F706-I710 HydrophobicContact CE1-CG1 4.04Å; F706-I710 HydrophobicContact CE2-CD1 4.48Å; F706-I710 HydrophobicContact CZ-CD1 4.15Å; F706-I710 HydrophobicContact CZ-CG1 4.07Å; F706-I710 WeakPolarHBondContact O-CG1 3.29Å; F706-I710 PolarHBondContact O-N 3.24Å
707	W	89.5	Confident	89.8	Confident	163 Å²	163	68.5 Å²	68.5	62%	0.617	33%	0.329	S	S	*	.	H	α-helix	trans	-68.8	-35.6	-176.9	-80.1	110.5	0	0	0	113.1	R703 V704 A709 I710 V711	R703-W707 VanDerWaalsContact O-CD1 3.26Å; R703-W707 PolarHBondContact O-N 3.36Å; V704-W707 PolarHBondContact O-N 3.24Å; W707-A709 VanDerWaalsContact C-N 3.26Å; W707-A709 PolarHBondContact O-N 2.96Å; W707-I710 HydrophobicContact CE3-CB 4.42Å; W707-I710 HydrophobicContact CE3-CG2 4.48Å; W707-I710 PolarHBondContact O-N 2.93Å; W707-I710 VanDerWaalsContact O-N 3.16Å; W707-V711 PolarHBondContact O-N 3.1Å; W707-V711 VanDerWaalsContact O-N 3.09Å
708	L	92.4	Very high	89.9	Confident	26 Å²	26	67.6 Å²	67.6	14%	0.136	33%	0.328	C	S	.	.	H	α-helix	trans	-60.2	-38.5	173	-177.5	58.6	0	0	0	111.1	L678 V681 Q682 L685 V704 I710 V711 L712	L678-L708 HydrophobicContact CB-CD1 4.34Å; L678-L708 HydrophobicContact CD2-CD1 4.06Å; V681-L708 HydrophobicContact CB-CD2 4.27Å; V681-L708 HydrophobicContact CG1-CD2 3.89Å; Q682-L708 HydrophobicContact CB-CD2 3.91Å; Q682-L708 HydrophobicContact CB-CG 4.44Å; L685-L708 HydrophobicContact CD1-CD2 4.04Å; V704-L708 WeakPolarHBondContact O-CB 3.38Å; V704-L708 PolarHBondContact O-N 3Å; L708-I710 VanDerWaalsContact C-N 3.34Å; L708-I710 PolarHBondContact O-N 3.43Å; L708-V711 PolarHBondContact O-N 3.41Å; L708-L712 VanDerWaalsContact O-CB 3.27Å; L708-L712 WeakPolarHBondContact O-CB 3.46Å; L708-L712 PolarHBondContact O-N 3.45Å
709	A	90	Very high	90.2	Very high	35 Å²	35	62.7 Å²	62.7	29%	0.289	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-42.9	174.7	0	0	0	0	0	112.2	Q682 H705 F706 W707 V711 L712 L713	Q682-A709 VanDerWaalsContact NE2-CB 3.3Å; H705-A709 PolarHBondContact O-N 3.23Å; F706-A709 VanDerWaalsContact O-CB 3.31Å; F706-A709 WeakPolarHBondContact O-CB 3.38Å; F706-A709 PolarHBondContact O-N 3.03Å; W707-A709 VanDerWaalsContact C-N 3.26Å; W707-A709 PolarHBondContact O-N 2.96Å; A709-V711 VanDerWaalsContact C-N 3.32Å; A709-V711 PolarHBondContact O-N 3.17Å; A709-L712 PolarHBondContact O-N 2.96Å; A709-L713 PolarHBondContact O-N 3.34Å; A709-L713 VanDerWaalsContact O-N 3.13Å
710	I	87.6	Confident	90.4	Very high	53 Å²	53	57 Å²	57	27%	0.272	29%	0.29	S	S	.	.	H	α-helix	trans	-66.2	-34.9	-178.9	-62	-62.1	0	0	0	111.5	F706 W707 L708 P714	F706-I710 HydrophobicContact CD1-CG1 4.49Å; F706-I710 HydrophobicContact CE1-CG1 4.04Å; F706-I710 HydrophobicContact CE2-CD1 4.48Å; F706-I710 HydrophobicContact CZ-CD1 4.15Å; F706-I710 HydrophobicContact CZ-CG1 4.07Å; F706-I710 WeakPolarHBondContact O-CG1 3.29Å; F706-I710 PolarHBondContact O-N 3.24Å; W707-I710 HydrophobicContact CE3-CB 4.42Å; W707-I710 HydrophobicContact CE3-CG2 4.48Å; W707-I710 PolarHBondContact O-N 2.93Å; W707-I710 VanDerWaalsContact O-N 3.16Å; L708-I710 VanDerWaalsContact C-N 3.34Å; L708-I710 PolarHBondContact O-N 3.43Å; I710-P714 WeakPolarHBondContact O-CD 3.03Å
711	V	90.2	Very high	90.4	Very high	80 Å²	80	54.4 Å²	54.4	49%	0.485	27%	0.273	S	S	.	.	H	α-helix	trans	-76.6	-39.4	175.3	175.2	0	0	0	0	111.7	W707 L708 A709 L713 P714 L715	W707-V711 PolarHBondContact O-N 3.1Å; W707-V711 VanDerWaalsContact O-N 3.09Å; L708-V711 PolarHBondContact O-N 3.41Å; A709-V711 VanDerWaalsContact C-N 3.32Å; A709-V711 PolarHBondContact O-N 3.17Å; V711-L713 VanDerWaalsContact C-N 3.34Å; V711-L713 PolarHBondContact O-N 3.26Å; V711-P714 VanDerWaalsContact O-CD 3.27Å; V711-P714 WeakPolarHBondContact O-CD 3.38Å; V711-P714 WeakPolarHBondContact O-CG 3.35Å; V711-L715 HydrophobicContact CG1-CD1 4.04Å; V711-L715 WeakPolarHBondContact O-CG 3.46Å
712	L	93.1	Very high	90.3	Very high	16 Å²	16	54.1 Å²	54.1	8%	0.084	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-40.4	-178.9	-168.7	90.8	0	0	0	112.1	V675 L678 L679 L708 A709 L715 A716	V675-L712 HydrophobicContact CG1-CD1 4.27Å; V675-L712 WeakPolarHBondContact O-CD1 3.26Å; L678-L712 HydrophobicContact CB-CD1 3.47Å; L678-L712 VanDerWaalsContact CB-CD1 3.47Å; L678-L712 HydrophobicContact CD1-CD1 4.44Å; L679-L712 HydrophobicContact CB-CD1 4.35Å; L679-L712 HydrophobicContact CB-CD2 4.35Å; L679-L712 HydrophobicContact CD1-CD2 3.94Å; L708-L712 VanDerWaalsContact O-CB 3.27Å; L708-L712 WeakPolarHBondContact O-CB 3.46Å; L708-L712 PolarHBondContact O-N 3.45Å; A709-L712 PolarHBondContact O-N 2.96Å; L712-L715 PolarHBondContact O-N 3.33Å; L712-A716 WeakPolarHBondContact O-CB 3.42Å; L712-A716 PolarHBondContact O-N 3.29Å
713	L	89.3	Confident	90.4	Very high	40 Å²	40	52 Å²	52	21%	0.209	26%	0.264	C	S	.	.	H	α-helix	trans	-57.1	-54.2	-174.6	-170.7	66.8	0	0	0	114.2	P609 A709 V711 L715 A716 F717	P609-L713 HydrophobicContact CB-CD1 4.14Å; P609-L713 HydrophobicContact CG-CD1 3.8Å; A709-L713 PolarHBondContact O-N 3.34Å; A709-L713 VanDerWaalsContact O-N 3.13Å; V711-L713 VanDerWaalsContact C-N 3.34Å; V711-L713 PolarHBondContact O-N 3.26Å; L713-L715 VanDerWaalsContact C-N 3.34Å; L713-L715 PolarHBondContact O-N 3.18Å; L713-A716 PolarHBondContact O-N 3.04Å; L713-F717 HydrophobicContact CD1-CE1 3.89Å; L713-F717 HydrophobicContact CD1-CE2 3.86Å; L713-F717 HydrophobicContact CD1-CZ 3.39Å; L713-F717 HydrophobicContact CD2-CE2 4.16Å; L713-F717 HydrophobicContact CD2-CZ 4.36Å; L713-F717 HydrophobicContact CG-CD2 4.31Å; L713-F717 HydrophobicContact CG-CE2 3.66Å; L713-F717 HydrophobicContact CG-CZ 3.77Å; L713-F717 WeakPolarHBondContact O-CG 3.42Å; L713-F717 PolarHBondContact O-N 2.8Å
714	P	89.6	Confident	90.2	Very high	73 Å²	73	45.5 Å²	45.5	47%	0.474	24%	0.241	S	C	.	.	H	α-helix	trans	-65.6	-35	177.6	25.8	-35	0	0	0	112.8	I710 V711 F717 L718	I710-P714 WeakPolarHBondContact O-CD 3.03Å; V711-P714 VanDerWaalsContact O-CD 3.27Å; V711-P714 WeakPolarHBondContact O-CD 3.38Å; V711-P714 WeakPolarHBondContact O-CG 3.35Å; P714-F717 PolarHBondContact O-N 3.44Å; P714-L718 WeakPolarHBondContact O-CB 3.22Å; P714-L718 PolarHBondContact O-N 2.84Å
715	L	93.8	Very high	89.7	Confident	48 Å²	48	44.1 Å²	44.1	25%	0.251	23%	0.23	S	C	.	.	H	α-helix	trans	-63.9	-42.2	175.7	-65.7	175.6	0	0	0	111.2	L671 V675 L678 V711 L712 L713 L718 N719	L671-L715 HydrophobicContact CD1-CB 4.42Å; L671-L715 HydrophobicContact CD1-CD2 4.11Å; V675-L715 HydrophobicContact CG2-CB 3.84Å; L678-L715 HydrophobicContact CD1-CD1 4.1Å; V711-L715 HydrophobicContact CG1-CD1 4.04Å; V711-L715 WeakPolarHBondContact O-CG 3.46Å; L712-L715 PolarHBondContact O-N 3.33Å; L713-L715 VanDerWaalsContact C-N 3.34Å; L713-L715 PolarHBondContact O-N 3.18Å; L715-L718 PolarHBondContact O-N 3.45Å; L715-N719 WeakPolarHBondContact O-CB 3.39Å; L715-N719 PolarHBondContact O-N 3.47Å
716	A	93.8	Very high	89.1	Confident	3 Å²	3	42.5 Å²	42.5	3%	0.025	22%	0.223	C	C	.	.	H	α-helix	trans	-64.3	-42.4	176.1	0	0	0	0	0	111.9	F604 V675 L712 L713 N719 I720	F604-A716 HydrophobicContact CB-CB 4.15Å; F604-A716 HydrophobicContact CD1-CB 3.58Å; F604-A716 HydrophobicContact CE1-CB 4.19Å; F604-A716 HydrophobicContact CG-CB 4.02Å; V675-A716 HydrophobicContact CG1-CB 4.12Å; L712-A716 WeakPolarHBondContact O-CB 3.42Å; L712-A716 PolarHBondContact O-N 3.29Å; L713-A716 PolarHBondContact O-N 3.04Å; A716-N719 PolarHBondContact O-N 3.27Å; A716-I720 WeakPolarHBondContact O-CG1 3.34Å; A716-I720 PolarHBondContact O-N 3.27Å
717	F	91.2	Very high	88.4	Confident	11 Å²	11	41.2 Å²	41.2	5%	0.048	22%	0.219	C	C	.	.	H	α-helix	trans	-65	-44.5	175.7	-68.2	-20.1	0	0	0	113	F604 L713 P714 N719 I720 I721 F737 I741 L744	F604-F717 WeakPolarHBondContact O-CE1 3.27Å; L713-F717 HydrophobicContact CD1-CE1 3.89Å; L713-F717 HydrophobicContact CD1-CE2 3.86Å; L713-F717 HydrophobicContact CD1-CZ 3.39Å; L713-F717 HydrophobicContact CD2-CE2 4.16Å; L713-F717 HydrophobicContact CD2-CZ 4.36Å; L713-F717 HydrophobicContact CG-CD2 4.31Å; L713-F717 HydrophobicContact CG-CE2 3.66Å; L713-F717 HydrophobicContact CG-CZ 3.77Å; L713-F717 WeakPolarHBondContact O-CG 3.42Å; L713-F717 PolarHBondContact O-N 2.8Å; P714-F717 PolarHBondContact O-N 3.44Å; F717-N719 PolarHBondContact O-N 3.39Å; F717-I720 HydrophobicContact CD1-CD1 4.37Å; F717-I720 PolarHBondContact O-N 3.48Å; F717-I721 WeakPolarHBondContact O-CG1 3.28Å; F717-I721 PolarHBondContact O-N 2.84Å; F717-F737 HydrophobicContact CD1-CZ 4.25Å; F717-I741 HydrophobicContact CB-CD1 3.99Å; F717-I741 HydrophobicContact CB-CG1 4.38Å; F717-I741 HydrophobicContact CD1-CG1 4.32Å; F717-I741 HydrophobicContact CD2-CD1 4.4Å; F717-I741 HydrophobicContact CD2-CG1 3.97Å; F717-I741 HydrophobicContact CD2-CG2 3.92Å; F717-I741 HydrophobicContact CE2-CG1 4.32Å; F717-I741 HydrophobicContact CE2-CG2 4.15Å; F717-I741 HydrophobicContact CG-CD1 4.15Å; F717-I741 HydrophobicContact CG-CG1 3.98Å; F717-L744 HydrophobicContact CE1-CD1 4.05Å; F717-L744 HydrophobicContact CE2-CD1 4.32Å; F717-L744 HydrophobicContact CZ-CD1 3.43Å; F717-L744 VanDerWaalsContact CZ-CD1 3.43Å
718	L	90.3	Very high	87.4	Confident	87 Å²	87	35 Å²	35	46%	0.455	20%	0.203	S	C	.	.	H	α-helix	trans	-57	-42.2	173	180	61.9	0	0	0	110.3	L671 P714 L715 I720 I721 L722	L671-L718 HydrophobicContact CD2-CB 4.35Å; L671-L718 HydrophobicContact CD2-CD2 4.06Å; L671-L718 HydrophobicContact CD2-CG 4.06Å; P714-L718 WeakPolarHBondContact O-CB 3.22Å; P714-L718 PolarHBondContact O-N 2.84Å; L715-L718 PolarHBondContact O-N 3.45Å; L718-I720 PolarHBondContact O-N 3.24Å; L718-I721 PolarHBondContact O-N 3.05Å; L718-L722 HydrophobicContact CG-CD1 4.3Å; L718-L722 WeakPolarHBondContact O-CG 3.3Å; L718-L722 PolarHBondContact O-N 3.33Å
719	N	92.8	Very high	86.4	Confident	20 Å²	20	35.3 Å²	35.3	11%	0.107	21%	0.206	C	C	.	.	H	α-helix	trans	-66.4	-35.7	178.8	-158.2	48	0	0	0	113.3	H668 L671 G672 L715 A716 F717 G723	H668-N719 WeakPolarHBondContact CA-OD1 3.27Å; H668-N719 PolarHBondContact CE1-ND2 3.35Å; H668-N719 PolarHBondContact CE1-O 2.89Å; H668-N719 VanDerWaalsContact CE1-O 3.27Å; H668-N719 PolarHBondContact ND1-O 3.25Å; H668-N719 PolarHBondContact ND1-OD1 2.86Å; H668-N719 PolarHBondContact O-OD1 3.29Å; L671-N719 HydrophobicContact CD2-CB 3.81Å; L671-N719 HydrophobicContact CG-CB 4.08Å; G672-N719 VanDerWaalsContact CA-ND2 3.3Å; G672-N719 WeakPolarHBondContact CA-ND2 3.43Å; L715-N719 WeakPolarHBondContact O-CB 3.39Å; L715-N719 PolarHBondContact O-N 3.47Å; A716-N719 PolarHBondContact O-N 3.27Å; F717-N719 PolarHBondContact O-N 3.39Å; N719-G723 PolarHBondContact O-N 3.04Å
720	I	91.3	Very high	85.5	Confident	11 Å²	11	37.5 Å²	37.5	6%	0.056	22%	0.217	C	C	.	.	H	α-helix	trans	-64.3	-44.2	173.3	-66.8	163.2	0	0	0	110.5	F604 A605 A716 F717 L718 L722 G723 L724 F737	F604-I720 HydrophobicContact CB-CD1 3.82Å; A605-I720 HydrophobicContact CB-CD1 4.17Å; A716-I720 WeakPolarHBondContact O-CG1 3.34Å; A716-I720 PolarHBondContact O-N 3.27Å; F717-I720 HydrophobicContact CD1-CD1 4.37Å; F717-I720 PolarHBondContact O-N 3.48Å; L718-I720 PolarHBondContact O-N 3.24Å; I720-L722 PolarHBondContact O-N 3.33Å; I720-G723 PolarHBondContact O-N 2.75Å; I720-G723 VanDerWaalsContact O-N 3.13Å; I720-L724 HydrophobicContact CG2-CD1 4Å; I720-L724 HydrophobicContact CG2-CG 4.24Å; I720-L724 WeakPolarHBondContact O-CG 3.41Å; I720-L724 PolarHBondContact O-N 3.39Å; I720-F737 HydrophobicContact CB-CE1 3.78Å; I720-F737 HydrophobicContact CB-CE2 4.44Å; I720-F737 HydrophobicContact CB-CZ 3.64Å; I720-F737 HydrophobicContact CD1-CE1 4.43Å; I720-F737 HydrophobicContact CD1-CE2 4.05Å; I720-F737 HydrophobicContact CD1-CZ 3.49Å; I720-F737 VanDerWaalsContact CD1-CZ 3.49Å; I720-F737 HydrophobicContact CG1-CZ 4.17Å; I720-F737 HydrophobicContact CG2-CD1 4.1Å; I720-F737 HydrophobicContact CG2-CD2 4.25Å; I720-F737 HydrophobicContact CG2-CE1 3.5Å; I720-F737 VanDerWaalsContact CG2-CE1 3.5Å; I720-F737 HydrophobicContact CG2-CE2 3.71Å; I720-F737 HydrophobicContact CG2-CG 4.45Å; I720-F737 HydrophobicContact CG2-CZ 3.33Å
721	I	87.6	Confident	84.8	Confident	25 Å²	25	38.9 Å²	38.9	13%	0.128	23%	0.228	C	C	.	.	H	α-helix	trans	-59.4	-48.6	177.5	-67.6	165.4	0	0	0	110.6	F717 L718 G723 L724 Q725 L734 F737 F738 I741	F717-I721 WeakPolarHBondContact O-CG1 3.28Å; F717-I721 PolarHBondContact O-N 2.84Å; L718-I721 PolarHBondContact O-N 3.05Å; I721-G723 VanDerWaalsContact C-N 3.26Å; I721-G723 PolarHBondContact O-N 2.89Å; I721-L724 PolarHBondContact O-N 3.33Å; I721-Q725 WeakPolarHBondContact O-CG 3.48Å; I721-Q725 PolarHBondContact O-N 2.98Å; I721-L734 HydrophobicContact CG2-CD1 4.28Å; I721-F737 HydrophobicContact CG1-CD1 4.05Å; I721-F737 HydrophobicContact CG1-CE1 4.06Å; I721-F738 HydrophobicContact CD1-CD1 4.48Å; I721-F738 HydrophobicContact CD1-CE1 3.67Å; I721-F738 HydrophobicContact CD1-CZ 4.07Å; I721-F738 HydrophobicContact CG1-CE1 4.48Å; I721-I741 HydrophobicContact CD1-CD1 4.17Å
722	L	86.9	Confident	84	Confident	25 Å²	25	37.6 Å²	37.6	13%	0.131	23%	0.23	C	C	.	.	H	α-helix	trans	-60.3	-37.4	176.1	-67.4	172.6	0	0	0	111.9	V667 H668 L671 L718 I720 Q725 L726	V667-L722 HydrophobicContact CG1-CD1 4.01Å; H668-L722 HydrophobicContact CB-CB 3.99Å; L671-L722 HydrophobicContact CD2-CD1 4Å; L718-L722 HydrophobicContact CG-CD1 4.3Å; L718-L722 WeakPolarHBondContact O-CG 3.3Å; L718-L722 PolarHBondContact O-N 3.33Å; I720-L722 PolarHBondContact O-N 3.33Å; L722-Q725 PolarHBondContact O-N 2.93Å; L722-L726 WeakPolarHBondContact O-CG 3.43Å; L722-L726 PolarHBondContact O-N 3.01Å
723	G	88.1	Confident	83.2	Confident	16 Å²	16	42.2 Å²	42.2	17%	0.165	26%	0.255	C	S	.	.	H	α-helix	trans	-65.6	-45.1	176.2	0	0	0	0	0	112.8	H668 N719 I720 I721 Q725 L726 I727	H668-G723 PolarHBondContact ND1-N 2.86Å; N719-G723 PolarHBondContact O-N 3.04Å; I720-G723 PolarHBondContact O-N 2.75Å; I720-G723 VanDerWaalsContact O-N 3.13Å; I721-G723 VanDerWaalsContact C-N 3.26Å; I721-G723 PolarHBondContact O-N 2.89Å; G723-Q725 VanDerWaalsContact C-N 3.3Å; G723-Q725 PolarHBondContact O-N 3.3Å; G723-L726 PolarHBondContact O-N 3.09Å; G723-I727 PolarHBondContact O-N 3.17Å
724	L	84.6	Confident	82.6	Confident	30 Å²	30	41.6 Å²	41.6	16%	0.157	25%	0.251	C	S	.	.	H	α-helix	trans	-63.2	-35.8	176.7	-69.9	172.8	0	0	0	112	I720 I721 A728 V729 L734 F737	I720-L724 HydrophobicContact CG2-CD1 4Å; I720-L724 HydrophobicContact CG2-CG 4.24Å; I720-L724 WeakPolarHBondContact O-CG 3.41Å; I720-L724 PolarHBondContact O-N 3.39Å; I721-L724 PolarHBondContact O-N 3.33Å; L724-A728 PolarHBondContact O-N 2.86Å; L724-V729 HydrophobicContact CB-CG2 4.34Å; L724-V729 HydrophobicContact CD2-CB 4.48Å; L724-V729 HydrophobicContact CD2-CG2 3.75Å; L724-V729 PolarHBondContact O-N 3.3Å; L724-L734 HydrophobicContact CD1-CD1 4.24Å; L724-F737 HydrophobicContact CD1-CB 4.29Å; L724-F737 HydrophobicContact CD1-CD1 4.37Å; L724-F737 HydrophobicContact CD1-CG 4.26Å
725	Q	80	Confident	82.2	Confident	44 Å²	44	43 Å²	43	21%	0.206	26%	0.255	C	S	.	.	H	α-helix	trans	-65.7	-37.2	175.2	-72.9	176.4	-24.6	0	0	112.5	I721 L722 G723 I727 A728	I721-Q725 WeakPolarHBondContact O-CG 3.48Å; I721-Q725 PolarHBondContact O-N 2.98Å; L722-Q725 PolarHBondContact O-N 2.93Å; G723-Q725 VanDerWaalsContact C-N 3.3Å; G723-Q725 PolarHBondContact O-N 3.3Å; Q725-I727 VanDerWaalsContact C-N 3.32Å; Q725-I727 PolarHBondContact O-N 3.21Å; Q725-A728 PolarHBondContact O-N 3.01Å; Q725-A728 VanDerWaalsContact O-N 3.17Å
726	L	79.5	Confident	81.6	Confident	14 Å²	14	42.8 Å²	42.8	7%	0.073	26%	0.264	C	S	.	.	H	α-helix	trans	-68	-26.6	-179.3	-78.4	171.4	0	0	0	114.5	Y411 H441 H668 L722 G723	Y411-L726 HydrophobicContact CE1-CD2 3.8Å; Y411-L726 HydrophobicContact CE1-CG 4.48Å; H441-L726 HydrophobicContact CB-CD2 4.43Å; H668-L726 HydrophobicContact CB-CD1 3.61Å; L722-L726 WeakPolarHBondContact O-CG 3.43Å; L722-L726 PolarHBondContact O-N 3.01Å; G723-L726 PolarHBondContact O-N 3.09Å
727	I	74.8	Confident	81	Confident	45 Å²	45	43.7 Å²	43.7	23%	0.231	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.7	9.5	175.2	58.2	163.5	0	0	0	112.6	L593 G723 Q725 V729	L593-I727 HydrophobicContact CD2-CG2 3.67Å; L593-I727 HydrophobicContact CG-CG2 3.87Å; G723-I727 PolarHBondContact O-N 3.17Å; Q725-I727 VanDerWaalsContact C-N 3.32Å; Q725-I727 PolarHBondContact O-N 3.21Å; I727-V729 VanDerWaalsContact C-N 3.28Å; I727-V729 HydrophobicContact CD1-CG2 3.23Å; I727-V729 HydrophobicContact CG1-CG2 3.34Å; I727-V729 PolarHBondContact O-N 3.08Å
728	A	68.7	Low	80.7	Confident	34 Å²	34	47.7 Å²	47.7	28%	0.281	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.2	44.2	178	0	0	0	0	0	113.8	L724 Q725	L724-A728 PolarHBondContact O-N 2.86Å; Q725-A728 PolarHBondContact O-N 3.01Å; Q725-A728 VanDerWaalsContact O-N 3.17Å
729	V	70.4	Confident	80.4	Confident	32 Å²	32	47.9 Å²	47.9	19%	0.194	29%	0.289	C	S	.	.			trans	-60.3	146.1	179.8	-173.6	0	0	0	0	110.9	L724 I727 V731 L733	L724-V729 HydrophobicContact CB-CG2 4.34Å; L724-V729 HydrophobicContact CD2-CB 4.48Å; L724-V729 HydrophobicContact CD2-CG2 3.75Å; L724-V729 PolarHBondContact O-N 3.3Å; I727-V729 VanDerWaalsContact C-N 3.28Å; I727-V729 HydrophobicContact CD1-CG2 3.23Å; I727-V729 HydrophobicContact CG1-CG2 3.34Å; I727-V729 PolarHBondContact O-N 3.08Å; V729-V731 PolarHBondContact O-N 3.27Å; V729-L733 HydrophobicContact CG1-CB 3.49Å; V729-L733 VanDerWaalsContact CG1-CB 3.49Å; V729-L733 HydrophobicContact CG1-CD1 3.25Å; V729-L733 HydrophobicContact CG1-CG 3.96Å
730	P	71.3	Confident	80	Confident	81 Å²	81	49.8 Å²	49.8	53%	0.526	30%	0.297	S	S	.	.			trans	-46.4	136.2	168.9	-29.9	34.2	0	0	0	113.3	G732 L733	P730-G732 PolarHBondContact O-N 3.48Å; P730-L733 PolarHBondContact O-N 3.23Å
731	V	73	Confident	79.6	Confident	82 Å²	82	50.2 Å²	50.2	50%	0.497	30%	0.3	S	S	.	.	H	α-helix	trans	-52.4	-33.4	-179.1	179.1	0	0	0	0	112.3	V729 L733 L734 L735	V729-V731 PolarHBondContact O-N 3.27Å; V731-L733 VanDerWaalsContact C-N 3.34Å; V731-L733 PolarHBondContact O-N 3.43Å; V731-L734 WeakPolarHBondContact O-CB 3.5Å; V731-L734 PolarHBondContact O-N 3.41Å; V731-L735 HydrophobicContact CG1-CD1 4.11Å; V731-L735 HydrophobicContact CG1-CG 4.22Å; V731-L735 WeakPolarHBondContact O-CG 3.11Å; V731-L735 PolarHBondContact O-N 3.14Å
732	G	74.2	Confident	79.4	Confident	52 Å²	52	56.1 Å²	56.1	54%	0.536	33%	0.325	S	S	.	.	H	α-helix	trans	-59.1	-38.5	177.5	0	0	0	0	0	114.2	P730 L735 G736	P730-G732 PolarHBondContact O-N 3.48Å; G732-L735 PolarHBondContact O-N 3.05Å; G732-G736 PolarHBondContact O-N 3.25Å
733	L	75.7	Confident	79.3	Confident	114 Å²	114	58.4 Å²	58.4	60%	0.597	34%	0.342	S	S	*	.	H	α-helix	trans	-71.9	-35.7	176.8	-74.7	169.1	0	0	0	111.5	V729 P730 V731 G736 F737	V729-L733 HydrophobicContact CG1-CB 3.49Å; V729-L733 VanDerWaalsContact CG1-CB 3.49Å; V729-L733 HydrophobicContact CG1-CD1 3.25Å; V729-L733 HydrophobicContact CG1-CG 3.96Å; P730-L733 PolarHBondContact O-N 3.23Å; V731-L733 VanDerWaalsContact C-N 3.34Å; V731-L733 PolarHBondContact O-N 3.43Å; L733-G736 PolarHBondContact O-N 2.9Å; L733-F737 PolarHBondContact O-N 3.46Å
734	L	76.9	Confident	79	Confident	27 Å²	27	58.9 Å²	58.9	14%	0.141	34%	0.34	C	S	.	.	H	α-helix	trans	-63.1	-44.5	173.2	-177	68.5	0	0	0	111.1	I721 L724 V731 F737 F738	I721-L734 HydrophobicContact CG2-CD1 4.28Å; L724-L734 HydrophobicContact CD1-CD1 4.24Å; V731-L734 WeakPolarHBondContact O-CB 3.5Å; V731-L734 PolarHBondContact O-N 3.41Å; L734-F737 WeakPolarHBondContact O-CB 3.38Å; L734-F737 PolarHBondContact O-N 2.85Å; L734-F738 HydrophobicContact CD1-CE2 3.94Å; L734-F738 HydrophobicContact CD1-CZ 4.47Å; L734-F738 HydrophobicContact CD2-CE2 4.01Å; L734-F738 HydrophobicContact CG-CD2 4.07Å; L734-F738 HydrophobicContact CG-CE2 3.61Å; L734-F738 WeakPolarHBondContact O-CD2 3.4Å; L734-F738 PolarHBondContact O-N 3.06Å
735	L	81.1	Confident	78.7	Confident	103 Å²	103	61.7 Å²	61.7	54%	0.539	36%	0.355	S	S	.	.	H	α-helix	trans	-61.6	-44.4	174.5	-71	173.1	0	0	0	111.9	V731 G732 F737 F738 V739	V731-L735 HydrophobicContact CG1-CD1 4.11Å; V731-L735 HydrophobicContact CG1-CG 4.22Å; V731-L735 WeakPolarHBondContact O-CG 3.11Å; V731-L735 PolarHBondContact O-N 3.14Å; G732-L735 PolarHBondContact O-N 3.05Å; L735-F737 PolarHBondContact O-N 3.44Å; L735-F738 PolarHBondContact O-N 3.06Å; L735-F738 VanDerWaalsContact O-N 3.13Å; L735-V739 WeakPolarHBondContact O-CG2 3.37Å; L735-V739 PolarHBondContact O-N 2.95Å
736	G	82.4	Confident	78.8	Confident	43 Å²	43	61.7 Å²	61.7	44%	0.443	36%	0.363	S	S	.	.	H	α-helix	trans	-57.2	-38.6	174.4	0	0	0	0	0	112.4	G732 L733 V739 H740	G732-G736 PolarHBondContact O-N 3.25Å; L733-G736 PolarHBondContact O-N 2.9Å; G736-V739 PolarHBondContact O-N 3.35Å; G736-H740 PolarHBondContact O-N 3.28Å
737	F	81.1	Confident	78.7	Confident	21 Å²	21	62.6 Å²	62.6	9%	0.092	37%	0.372	C	S	.	.	H	α-helix	trans	-67.9	-39.9	175.4	-167.8	-108.8	0	0	0	113	A605 F717 I720 I721 L724 L733 L734 L735 V739 H740 I741	A605-F737 HydrophobicContact CB-CE2 3.59Å; A605-F737 HydrophobicContact CB-CZ 4.19Å; F717-F737 HydrophobicContact CD1-CZ 4.25Å; I720-F737 HydrophobicContact CB-CE1 3.78Å; I720-F737 HydrophobicContact CB-CE2 4.44Å; I720-F737 HydrophobicContact CB-CZ 3.64Å; I720-F737 HydrophobicContact CD1-CE1 4.43Å; I720-F737 HydrophobicContact CD1-CE2 4.05Å; I720-F737 HydrophobicContact CD1-CZ 3.49Å; I720-F737 VanDerWaalsContact CD1-CZ 3.49Å; I720-F737 HydrophobicContact CG1-CZ 4.17Å; I720-F737 HydrophobicContact CG2-CD1 4.1Å; I720-F737 HydrophobicContact CG2-CD2 4.25Å; I720-F737 HydrophobicContact CG2-CE1 3.5Å; I720-F737 VanDerWaalsContact CG2-CE1 3.5Å; I720-F737 HydrophobicContact CG2-CE2 3.71Å; I720-F737 HydrophobicContact CG2-CG 4.45Å; I720-F737 HydrophobicContact CG2-CZ 3.33Å; I721-F737 HydrophobicContact CG1-CD1 4.05Å; I721-F737 HydrophobicContact CG1-CE1 4.06Å; L724-F737 HydrophobicContact CD1-CB 4.29Å; L724-F737 HydrophobicContact CD1-CD1 4.37Å; L724-F737 HydrophobicContact CD1-CG 4.26Å; L733-F737 PolarHBondContact O-N 3.46Å; L734-F737 WeakPolarHBondContact O-CB 3.38Å; L734-F737 PolarHBondContact O-N 2.85Å; L735-F737 PolarHBondContact O-N 3.44Å; F737-V739 PolarHBondContact O-N 2.9Å; F737-H740 WeakPolarHBondContact O-CB 3.31Å; F737-H740 PolarHBondContact O-N 3.03Å; F737-I741 HydrophobicContact CD1-CD1 3.6Å; F737-I741 HydrophobicContact CD1-CG1 4.22Å; F737-I741 HydrophobicContact CE1-CD1 3.31Å; F737-I741 HydrophobicContact CE1-CG1 3.88Å; F737-I741 HydrophobicContact CZ-CD1 4.04Å; F737-I741 HydrophobicContact CZ-CG1 4.13Å; F737-I741 WeakPolarHBondContact O-CG1 3.41Å; F737-I741 PolarHBondContact O-N 3.1Å
738	F	83.1	Confident	78.9	Confident	95 Å²	95	62 Å²	62	42%	0.417	37%	0.369	S	S	.	.	H	α-helix	trans	-61.2	-42.8	173.4	-77.7	-62.8	0	0	0	112.5	I721 L734 L735 H740 I741 F742	I721-F738 HydrophobicContact CD1-CD1 4.48Å; I721-F738 HydrophobicContact CD1-CE1 3.67Å; I721-F738 HydrophobicContact CD1-CZ 4.07Å; I721-F738 HydrophobicContact CG1-CE1 4.48Å; L734-F738 HydrophobicContact CD1-CE2 3.94Å; L734-F738 HydrophobicContact CD1-CZ 4.47Å; L734-F738 HydrophobicContact CD2-CE2 4.01Å; L734-F738 HydrophobicContact CG-CD2 4.07Å; L734-F738 HydrophobicContact CG-CE2 3.61Å; L734-F738 WeakPolarHBondContact O-CD2 3.4Å; L734-F738 PolarHBondContact O-N 3.06Å; L735-F738 PolarHBondContact O-N 3.06Å; L735-F738 VanDerWaalsContact O-N 3.13Å; F738-H740 VanDerWaalsContact C-N 3.29Å; F738-H740 PolarHBondContact O-N 3.06Å; F738-I741 PolarHBondContact O-N 3.13Å; F738-F742 WeakPolarHBondContact O-CB 3.43Å; F738-F742 PolarHBondContact O-N 3.06Å
739	V	84.6	Confident	79.3	Confident	92 Å²	92	62.3 Å²	62.3	56%	0.558	38%	0.376	S	S	*	.	H	α-helix	trans	-60.3	-42.6	174	174.8	0	0	0	0	110.5	L735 G736 F737 F742 C743	L735-V739 WeakPolarHBondContact O-CG2 3.37Å; L735-V739 PolarHBondContact O-N 2.95Å; G736-V739 PolarHBondContact O-N 3.35Å; F737-V739 PolarHBondContact O-N 2.9Å; V739-F742 WeakPolarHBondContact O-CB 3.45Å; V739-F742 PolarHBondContact O-N 3Å; V739-C743 PolarHBondContact O-N 3.33Å; V739-C743 PolarHBondContact O-SG 2.85Å; V739-C743 VanDerWaalsContact O-SG 3.35Å
740	H	84.2	Confident	79.7	Confident	60 Å²	60	66.9 Å²	66.9	28%	0.278	40%	0.399	S	S	.	.	H	α-helix	trans	-61.1	-47.4	176.5	-168.9	-67.8	0	0	0	112.7	A605 L606 G736 F737 F738 F742 C743 L744	A605-H740 PolarHBondContact O-CE1 3.24Å; L606-H740 WeakPolarHBondContact CD2-NE2 3.32Å; G736-H740 PolarHBondContact O-N 3.28Å; F737-H740 WeakPolarHBondContact O-CB 3.31Å; F737-H740 PolarHBondContact O-N 3.03Å; F738-H740 VanDerWaalsContact C-N 3.29Å; F738-H740 PolarHBondContact O-N 3.06Å; H740-F742 VanDerWaalsContact C-N 3.28Å; H740-F742 PolarHBondContact O-N 2.97Å; H740-C743 PolarHBondContact O-N 3.25Å; H740-L744 PolarHBondContact O-N 2.96Å
741	I	83.3	Confident	79.8	Confident	20 Å²	20	64 Å²	64	10%	0.103	38%	0.379	C	S	.	.	H	α-helix	trans	-57.1	-45.7	175.5	-70.3	166.7	0	0	0	110.1	F717 I721 F737 F738 C743 L744 L745	F717-I741 HydrophobicContact CB-CD1 3.99Å; F717-I741 HydrophobicContact CB-CG1 4.38Å; F717-I741 HydrophobicContact CD1-CG1 4.32Å; F717-I741 HydrophobicContact CD2-CD1 4.4Å; F717-I741 HydrophobicContact CD2-CG1 3.97Å; F717-I741 HydrophobicContact CD2-CG2 3.92Å; F717-I741 HydrophobicContact CE2-CG1 4.32Å; F717-I741 HydrophobicContact CE2-CG2 4.15Å; F717-I741 HydrophobicContact CG-CD1 4.15Å; F717-I741 HydrophobicContact CG-CG1 3.98Å; I721-I741 HydrophobicContact CD1-CD1 4.17Å; F737-I741 HydrophobicContact CD1-CD1 3.6Å; F737-I741 HydrophobicContact CD1-CG1 4.22Å; F737-I741 HydrophobicContact CE1-CD1 3.31Å; F737-I741 HydrophobicContact CE1-CG1 3.88Å; F737-I741 HydrophobicContact CZ-CD1 4.04Å; F737-I741 HydrophobicContact CZ-CG1 4.13Å; F737-I741 WeakPolarHBondContact O-CG1 3.41Å; F737-I741 PolarHBondContact O-N 3.1Å; F738-I741 PolarHBondContact O-N 3.13Å; I741-C743 VanDerWaalsContact C-N 3.35Å; I741-C743 PolarHBondContact O-N 3.09Å; I741-L744 PolarHBondContact O-N 2.92Å; I741-L745 HydrophobicContact CG2-CD1 3.8Å; I741-L745 HydrophobicContact CG2-CG 4.2Å; I741-L745 WeakPolarHBondContact O-CG 3.43Å; I741-L745 PolarHBondContact O-N 3Å
742	F	83.4	Confident	79.8	Confident	149 Å²	149	63 Å²	63	65%	0.654	37%	0.37	S	S	*	.	H	α-helix	trans	-58.6	-45.5	178.6	-179.2	-96	0	0	0	111.8	F738 V739 H740 L744 L745 A746	F738-F742 WeakPolarHBondContact O-CB 3.43Å; F738-F742 PolarHBondContact O-N 3.06Å; V739-F742 WeakPolarHBondContact O-CB 3.45Å; V739-F742 PolarHBondContact O-N 3Å; H740-F742 VanDerWaalsContact C-N 3.28Å; H740-F742 PolarHBondContact O-N 2.97Å; F742-L744 PolarHBondContact O-N 2.9Å; F742-L745 PolarHBondContact O-N 3.36Å; F742-A746 WeakPolarHBondContact O-CB 3.45Å; F742-A746 PolarHBondContact O-N 2.92Å
743	C	84.6	Confident	79.3	Confident	73 Å²	73	63 Å²	63	49%	0.493	36%	0.361	S	S	.	.	H	α-helix	trans	-60.3	-41.1	175.9	-70.8	0	0	0	0	112.8	V739 H740 I741 A746 A747	V739-C743 PolarHBondContact O-N 3.33Å; V739-C743 PolarHBondContact O-SG 2.85Å; V739-C743 VanDerWaalsContact O-SG 3.35Å; H740-C743 PolarHBondContact O-N 3.25Å; I741-C743 VanDerWaalsContact C-N 3.35Å; I741-C743 PolarHBondContact O-N 3.09Å; C743-A746 PolarHBondContact O-N 3.5Å; C743-A747 WeakPolarHBondContact O-CB 3.5Å; C743-A747 PolarHBondContact O-N 3.47Å
744	L	81.3	Confident	78.8	Confident	25 Å²	25	61.2 Å²	61.2	13%	0.131	35%	0.351	C	S	.	.	H	α-helix	trans	-66.3	-42.6	176.3	-72.4	176.7	0	0	0	112.5	A605 P609 L613 F717 H740 I741 F742 A747 L748	A605-L744 WeakPolarHBondContact O-CD1 3.32Å; P609-L744 HydrophobicContact CB-CD1 4.33Å; P609-L744 HydrophobicContact CB-CD2 4.42Å; L613-L744 HydrophobicContact CD1-CD2 3.85Å; F717-L744 HydrophobicContact CE1-CD1 4.05Å; F717-L744 HydrophobicContact CE2-CD1 4.32Å; F717-L744 HydrophobicContact CZ-CD1 3.43Å; F717-L744 VanDerWaalsContact CZ-CD1 3.43Å; H740-L744 PolarHBondContact O-N 2.96Å; I741-L744 PolarHBondContact O-N 2.92Å; F742-L744 PolarHBondContact O-N 2.9Å; L744-A747 PolarHBondContact O-N 2.96Å; L744-L748 PolarHBondContact O-N 2.97Å
745	L	80.2	Confident	78.2	Confident	90 Å²	90	62.4 Å²	62.4	47%	0.471	36%	0.357	S	S	.	.	H	α-helix	trans	-65.3	-39.9	176.4	-69.7	175.8	0	0	0	111.3	I741 F742 L748 G749	I741-L745 HydrophobicContact CG2-CD1 3.8Å; I741-L745 HydrophobicContact CG2-CG 4.2Å; I741-L745 WeakPolarHBondContact O-CG 3.43Å; I741-L745 PolarHBondContact O-N 3Å; F742-L745 PolarHBondContact O-N 3.36Å; L745-L748 PolarHBondContact O-N 3.44Å; L745-G749 PolarHBondContact O-N 3.36Å
746	A	80.5	Confident	77.2	Confident	44 Å²	44	67 Å²	67	36%	0.364	37%	0.368	S	S	.	.	H	α-helix	trans	-62	-43.6	173.5	0	0	0	0	0	111.5	F742 C743 L748 G749 L750	F742-A746 WeakPolarHBondContact O-CB 3.45Å; F742-A746 PolarHBondContact O-N 2.92Å; C743-A746 PolarHBondContact O-N 3.5Å; A746-L748 PolarHBondContact O-N 3.03Å; A746-G749 CarbonylContact O-C 3.6Å; A746-G749 PolarHBondContact O-N 3.29Å; A746-L750 WeakPolarHBondContact O-CG 3.46Å; A746-L750 PolarHBondContact O-N 3.17Å
747	A	78.4	Confident	76	Confident	33 Å²	33	72.1 Å²	72.1	27%	0.273	38%	0.378	S	S	.	.	H	α-helix	trans	-60.6	-43.7	174.9	0	0	0	0	0	112.1	L613 C743 L744 L750 I751	L613-A747 HydrophobicContact CD1-CB 4.3Å; C743-A747 WeakPolarHBondContact O-CB 3.5Å; C743-A747 PolarHBondContact O-N 3.47Å; L744-A747 PolarHBondContact O-N 2.96Å; A747-L750 PolarHBondContact O-N 2.74Å; A747-I751 WeakPolarHBondContact O-CD1 3.45Å; A747-I751 VanDerWaalsContact O-CG1 3.28Å; A747-I751 WeakPolarHBondContact O-CG1 3.31Å; A747-I751 PolarHBondContact O-N 2.79Å; A747-I751 VanDerWaalsContact O-N 3.07Å
748	L	79.1	Confident	74.6	Confident	31 Å²	31	76.6 Å²	76.6	16%	0.162	39%	0.394	C	S	.	.	H	α-helix	trans	-61.1	-44.8	174.2	-168.6	82.3	0	0	0	111.3	L613 L616 L744 L745 A746 L750 I751 L752	L613-L748 HydrophobicContact CD2-CB 4.24Å; L613-L748 HydrophobicContact CD2-CD1 3.69Å; L616-L748 HydrophobicContact CD2-CD1 4.16Å; L744-L748 PolarHBondContact O-N 2.97Å; L745-L748 PolarHBondContact O-N 3.44Å; A746-L748 PolarHBondContact O-N 3.03Å; L748-L750 VanDerWaalsContact C-N 3.28Å; L748-L750 PolarHBondContact O-N 3.41Å; L748-I751 PolarHBondContact O-N 3.41Å; L748-L752 HydrophobicContact CD2-CD1 4.18Å; L748-L752 HydrophobicContact CG-CD1 3.95Å; L748-L752 HydrophobicContact CG-CG 4.36Å; L748-L752 WeakPolarHBondContact O-CG 3.43Å; L748-L752 PolarHBondContact O-N 2.92Å
749	G	76.8	Confident	73.3	Confident	42 Å²	42	80 Å²	80	43%	0.433	41%	0.409	S	S	.	.	H	α-helix	trans	-62.8	-28.8	177.4	0	0	0	0	0	113.9	L745 A746 P753	L745-G749 PolarHBondContact O-N 3.36Å; A746-G749 CarbonylContact O-C 3.6Å; A746-G749 PolarHBondContact O-N 3.29Å; G749-P753 WeakPolarHBondContact O-CD 3.24Å; G749-P753 WeakPolarHBondContact O-CG 3.14Å
750	L	78.3	Confident	71.8	Confident	127 Å²	127	77.8 Å²	77.8	67%	0.665	40%	0.4	S	S	*	.	H	α-helix	trans	-79.7	-35.4	172.9	-70.8	170.5	0	0	0	112.7	A746 A747 L748 I754	A746-L750 WeakPolarHBondContact O-CG 3.46Å; A746-L750 PolarHBondContact O-N 3.17Å; A747-L750 PolarHBondContact O-N 2.74Å; L748-L750 VanDerWaalsContact C-N 3.28Å; L748-L750 PolarHBondContact O-N 3.41Å; L750-I754 WeakPolarHBondContact O-CD1 3.29Å; L750-I754 WeakPolarHBondContact O-CG1 3.3Å
751	I	74.2	Confident	70.1	Confident	20 Å²	20	80.8 Å²	80.8	10%	0.103	42%	0.418	C	S	.	.	H	α-helix	trans	-76.9	-38.5	-177.1	-66.9	161.4	0	0	0	112.2	L613 L616 Y617 A747 L748 I754 L755	L613-I751 HydrophobicContact CB-CD1 4.43Å; L613-I751 HydrophobicContact CD2-CD1 4.06Å; L616-I751 HydrophobicContact CB-CG2 4.33Å; L616-I751 HydrophobicContact CD2-CB 4.42Å; L616-I751 HydrophobicContact CD2-CG2 3.66Å; L616-I751 HydrophobicContact CG-CG2 3.68Å; Y617-I751 HydrophobicContact CD2-CG1 4.46Å; A747-I751 WeakPolarHBondContact O-CD1 3.45Å; A747-I751 VanDerWaalsContact O-CG1 3.28Å; A747-I751 WeakPolarHBondContact O-CG1 3.31Å; A747-I751 PolarHBondContact O-N 2.79Å; A747-I751 VanDerWaalsContact O-N 3.07Å; L748-I751 PolarHBondContact O-N 3.41Å; I751-I754 WeakPolarHBondContact O-CB 3.48Å; I751-I754 PolarHBondContact O-N 3.41Å; I751-L755 HydrophobicContact CG2-CD1 4.28Å; I751-L755 PolarHBondContact O-N 3.35Å
752	L	72.3	Confident	68.5	Low	62 Å²	62	87.6 Å²	87.6	33%	0.325	44%	0.442	S	S	.	.	H	α-helix	trans	-63.1	-41.8	-176.5	-73.4	171.3	0	0	0	114.6	L748 I754 L755 R756	L748-L752 HydrophobicContact CD2-CD1 4.18Å; L748-L752 HydrophobicContact CG-CD1 3.95Å; L748-L752 HydrophobicContact CG-CG 4.36Å; L748-L752 WeakPolarHBondContact O-CG 3.43Å; L748-L752 PolarHBondContact O-N 2.92Å; L752-I754 VanDerWaalsContact C-N 3.35Å; L752-L755 HydrophobicContact CD2-CD1 4.27Å; L752-L755 WeakPolarHBondContact O-CB 3.43Å; L752-L755 PolarHBondContact O-N 3.49Å; L752-R756 PolarHBondContact O-N 3.47Å; L752-R756 VanDerWaalsContact O-N 3.11Å
753	P	64.6	Low	66.9	Low	53 Å²	53	85.1 Å²	85.1	34%	0.344	44%	0.444	S	S	.	.	H	α-helix	trans	-62.3	-40	173.4	-25	34.9	0	0	0	112.5	G749 L755 R756 F757	G749-P753 WeakPolarHBondContact O-CD 3.24Å; G749-P753 WeakPolarHBondContact O-CG 3.14Å; P753-L755 PolarHBondContact O-N 3.14Å; P753-R756 PolarHBondContact O-N 3.09Å; P753-F757 HydrophobicContact CB-CD2 4.3Å; P753-F757 HydrophobicContact CB-CE2 4.45Å; P753-F757 WeakPolarHBondContact O-CD2 3.24Å; P753-F757 PolarHBondContact O-N 2.8Å
754	I	64.8	Low	65.2	Low	75 Å²	75	85.6 Å²	85.6	39%	0.385	44%	0.444	S	S	.	.	H	α-helix	trans	-58.1	-36.8	176.5	-62.9	170.1	0	0	0	110.5	L750 I751 L752	L750-I754 WeakPolarHBondContact O-CD1 3.29Å; L750-I754 WeakPolarHBondContact O-CG1 3.3Å; I751-I754 WeakPolarHBondContact O-CB 3.48Å; I751-I754 PolarHBondContact O-N 3.41Å; L752-I754 VanDerWaalsContact C-N 3.35Å
755	L	63.4	Low	63.5	Low	52 Å²	52	88 Å²	88	27%	0.272	47%	0.468	S	S	.	.	H	α-helix	trans	-67.9	-40.2	173.2	-72.7	163.8	0	0	0	113	L616 A620 I751 L752 P753 K759	L616-L755 HydrophobicContact CD1-CD1 3.57Å; L616-L755 HydrophobicContact CD2-CD1 4.26Å; L616-L755 HydrophobicContact CG-CD1 3.82Å; A620-L755 HydrophobicContact CB-CD2 3.27Å; A620-L755 HydrophobicContact CB-CG 3.86Å; I751-L755 HydrophobicContact CG2-CD1 4.28Å; I751-L755 PolarHBondContact O-N 3.35Å; L752-L755 HydrophobicContact CD2-CD1 4.27Å; L752-L755 WeakPolarHBondContact O-CB 3.43Å; L752-L755 PolarHBondContact O-N 3.49Å; P753-L755 PolarHBondContact O-N 3.14Å; L755-K759 PolarHBondContact O-N 3.41Å
756	R	61.3	Low	62.1	Low	201 Å²	201	91.9 Å²	91.9	76%	0.758	48%	0.481	S	S	*	.	H	α-helix	trans	-72.2	-48.9	-179.5	-74.5	-172.4	177.4	-172.6	0.4	112.8	L752 P753 R758 K759 A760	L752-R756 PolarHBondContact O-N 3.47Å; L752-R756 VanDerWaalsContact O-N 3.11Å; P753-R756 PolarHBondContact O-N 3.09Å; R756-R758 PolarHBondContact O-N 3.2Å; R756-K759 PolarHBondContact O-N 3.04Å; R756-A760 PolarHBondContact O-N 3.02Å
757	F	55.6	Low	60.7	Low	150 Å²	150	94.9 Å²	94.9	66%	0.658	50%	0.497	S	S	*	.	H	α-helix	trans	-57	-37	179.9	-88.1	-77.7	0	0	0	112.1	P753 A760 N761	P753-F757 HydrophobicContact CB-CD2 4.3Å; P753-F757 HydrophobicContact CB-CE2 4.45Å; P753-F757 WeakPolarHBondContact O-CD2 3.24Å; P753-F757 PolarHBondContact O-N 2.8Å; F757-A760 PolarHBondContact O-N 3.07Å; F757-N761 PolarHBondContact O-N 3.4Å
758	R	53	Low	59.5	Low	115 Å²	115	98.4 Å²	98.4	43%	0.434	52%	0.517	S	S	.	.	H	α-helix	trans	-74.3	-29.5	177.5	-130.4	-179.2	177.5	-175.5	1.3	113.7	A620 R621 R756 R762	A620-R758 PolarHBondContact O-NH1 2.85Å; R621-R758 PolarHBondContact O-NH1 3.23Å; R621-R758 VanDerWaalsContact O-NH1 3.17Å; R756-R758 PolarHBondContact O-N 3.2Å; R758-R762 PolarHBondContact O-N 2.68Å
759	K	54.9	Low	58.2	Low	167 Å²	167	102.1 Å²	102.1	73%	0.726	54%	0.543	S	S	*	.	H	α-helix	trans	-71.5	-38.8	174.6	-145.9	-179.7	-175.5	-172.3	0	110.5	L755 R756 R762 S763	L755-K759 PolarHBondContact O-N 3.41Å; R756-K759 PolarHBondContact O-N 3.04Å; K759-R762 PolarHBondContact O-N 3.33Å; K759-S763 PolarHBondContact O-N 3.22Å
760	A	52.6	Low	57.2	Low	44 Å²	44	107.1 Å²	107.1	36%	0.364	56%	0.56	S	S	.	*	H	α-helix	trans	-63.3	-45.8	172.5	0	0	0	0	0	112	R756 F757 R762 S763 V764	R756-A760 PolarHBondContact O-N 3.02Å; F757-A760 PolarHBondContact O-N 3.07Å; A760-R762 PolarHBondContact O-N 3.11Å; A760-S763 PolarHBondContact O-N 2.9Å; A760-S763 VanDerWaalsContact O-N 3.09Å; A760-S763 PolarHBondContact O-OG 3.2Å; A760-V764 VanDerWaalsContact O-CG2 3.31Å; A760-V764 WeakPolarHBondContact O-CG2 3.4Å; A760-V764 PolarHBondContact O-N 3.14Å; A760-V764 VanDerWaalsContact O-N 3.08Å
761	N	50.5	Low	56.3	Low	124 Å²	124	108.5 Å²	108.5	66%	0.663	57%	0.568	S	S	*	*	H	α-helix	trans	-66.1	-18.5	176	-76.2	9.5	0	0	0	113.8	F757	F757-N761 PolarHBondContact O-N 3.4Å
762	R	48.8	Very low	55.1	Low	162 Å²	162	118.3 Å²	118.3	61%	0.611	62%	0.621	S	S	*	*	H	α-helix	trans	-80.6	-32	171.1	-86.1	-173.2	177.6	170.9	4.4	113.4	R758 K759 A760 V764	R758-R762 PolarHBondContact O-N 2.68Å; K759-R762 PolarHBondContact O-N 3.33Å; A760-R762 PolarHBondContact O-N 3.11Å; R762-V764 VanDerWaalsContact C-N 3.3Å
763	S	49.5	Very low	54.3	Low	98 Å²	98	121.2 Å²	121.2	69%	0.685	64%	0.635	S	S	*	*	H	α-helix	trans	-77.9	-19.1	174.2	49.8	0	0	0	0	112.7	K759 A760	K759-S763 PolarHBondContact O-N 3.22Å; A760-S763 PolarHBondContact O-N 2.9Å; A760-S763 VanDerWaalsContact O-N 3.09Å; A760-S763 PolarHBondContact O-OG 3.2Å
764	V	49.5	Very low	53.7	Low	83 Å²	83	124.7 Å²	124.7	50%	0.503	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.7	9.8	175.8	-173	0	0	0	0	111.8	A760 R762 F766	A760-V764 VanDerWaalsContact O-CG2 3.31Å; A760-V764 WeakPolarHBondContact O-CG2 3.4Å; A760-V764 PolarHBondContact O-N 3.14Å; A760-V764 VanDerWaalsContact O-N 3.08Å; R762-V764 VanDerWaalsContact C-N 3.3Å; V764-F766 HydrophobicContact CG1-CD2 4.16Å; V764-F766 HydrophobicContact CG1-CE2 3.59Å; V764-F766 HydrophobicContact CG1-CZ 4.31Å; V764-F766 VanDerWaalsContact O-CD2 3.24Å; V764-F766 WeakPolarHBondContact O-CD2 3.47Å; V764-F766 PolarHBondContact O-N 3.25Å
765	A	45.5	Very low	53.1	Low	76 Å²	76	127.5 Å²	127.5	63%	0.628	67%	0.666	S	S	*	*			trans	-68.2	88.6	161.6	0	0	0	0	0	107.2
766	F	50.6	Low	52.5	Low	171 Å²	171	131.9 Å²	131.9	75%	0.75	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-49.8	137.3	168.1	-69.8	-86.7	0	0	0	107.9	V764	V764-F766 HydrophobicContact CG1-CD2 4.16Å; V764-F766 HydrophobicContact CG1-CE2 3.59Å; V764-F766 HydrophobicContact CG1-CZ 4.31Å; V764-F766 VanDerWaalsContact O-CD2 3.24Å; V764-F766 WeakPolarHBondContact O-CD2 3.47Å; V764-F766 PolarHBondContact O-N 3.25Å
767	P	51.3	Low	51.9	Low	107 Å²	107	127.6 Å²	127.6	70%	0.695	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-53.4	145.4	167.5	24.7	-30.5	0	0	0	107.9
768	P	52.6	Low	51.7	Low	107 Å²	107	126.1 Å²	126.1	70%	0.695	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-53.8	149	176.6	26.1	-32.9	0	0	0	108.9	N770	P768-N770 PolarHBondContact O-N 2.81Å
769	P	53.1	Low	51.6	Low	109 Å²	109	126.9 Å²	126.9	71%	0.708	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-53.1	131.5	177.2	23.9	-31	0	0	0	107.8	D771	P769-D771 VanDerWaalsContact C-N 3.33Å; P769-D771 PolarHBondContact O-N 3.12Å
770	N	54.5	Low	51.4	Low	147 Å²	147	123.8 Å²	123.8	79%	0.786	70%	0.702	S	S	*	*			trans	-58.1	107.7	162.7	-83.3	-6	0	0	0	105	P768 D772	P768-N770 PolarHBondContact O-N 2.81Å; N770-D772 VanDerWaalsContact C-N 3.3Å; N770-D772 PolarHBondContact O-N 2.95Å; N770-D772 VanDerWaalsContact O-N 3.12Å
771	D	58.7	Low	51.3	Low	156 Å²	156	130.5 Å²	130.5	83%	0.834	73%	0.731	S	S	*	*			trans	-66	103.7	155.6	-74.6	-26.5	0	0	0	104.6	P769	P769-D771 VanDerWaalsContact C-N 3.33Å; P769-D771 PolarHBondContact O-N 3.12Å
772	D	50.4	Low	51.3	Low	226 Å²	226	131.1 Å²	131.1	100%	1.209	74%	0.737	S	S	*	*			trans	-56.8	0	163.7	-79.9	-29.6	0	0	0	111	N770	N770-D772 VanDerWaalsContact C-N 3.3Å; N770-D772 PolarHBondContact O-N 2.95Å; N770-D772 VanDerWaalsContact O-N 3.12Å

Retrieved 772 of 772 residues in 247.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).