A0A060WYY3_ONCMY Loading...

Phospholipid transfer protein

AlphaFold DB , UniProt , Accession A0A060WYY3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110529039, Length 486 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	43	Very low	43.3	Very low	252 Å²	252	142.5 Å²	142.5	100%	1.241	83%	0.827	S	S	*	*				0	94.3	0	-78.3	-179.8	-86.9	0	0	108.2
2	A	35.7	Very low	43.2	Very low	105 Å²	105	142.8 Å²	142.8	87%	0.868	82%	0.821	S	S	*	*			trans	-152.5	114.3	164.8	0	0	0	0	0	105.8
3	S	39.9	Very low	43.5	Very low	118 Å²	118	143.4 Å²	143.4	83%	0.825	82%	0.818	S	S	*	*			trans	-73.4	135	-166.5	-170.1	0	0	0	0	111.6
4	C	45.4	Very low	43.6	Very low	111 Å²	111	141.2 Å²	141.2	75%	0.75	81%	0.808	S	S	*	*			trans	-53.8	134.4	163.4	-68	0	0	0	0	111.5
5	T	41.8	Very low	43.4	Very low	136 Å²	136	137.7 Å²	137.7	83%	0.834	80%	0.803	S	S	*	*			trans	-117.3	101.6	155.5	42.8	0	0	0	0	107.9	S7	T5-S7 PolarHBondContact O-N 3.27Å
6	V	44.8	Very low	43.2	Very low	118 Å²	118	139.8 Å²	139.8	72%	0.715	81%	0.806	S	S	*	*			trans	-77.3	111.6	172.5	176	0	0	0	0	107.3	I8	V6-I8 HydrophobicContact CG1-CG1 3.99Å; V6-I8 PolarHBondContact O-N 3.45Å
7	S	44.4	Very low	43.4	Very low	123 Å²	123	138.1 Å²	138.1	86%	0.86	80%	0.803	S	S	*	*			trans	-73.4	105.2	166.1	-73.4	0	0	0	0	109.3	T5	T5-S7 PolarHBondContact O-N 3.27Å
8	I	47.2	Very low	44.4	Very low	134 Å²	134	135.7 Å²	135.7	69%	0.687	80%	0.802	S	S	*	*			trans	-85.9	109.2	168.4	-64	173.9	0	0	0	107.5	V6 F10	V6-I8 HydrophobicContact CG1-CG1 3.99Å; V6-I8 PolarHBondContact O-N 3.45Å; I8-F10 HydrophobicContact CG2-CD2 4.35Å; I8-F10 PolarHBondContact O-N 3.32Å
9	L	45.7	Very low	46	Very low	152 Å²	152	133.5 Å²	133.5	80%	0.796	80%	0.801	S	S	*	*			trans	-76.4	103.3	171.7	-167.2	78.9	0	0	0	108.4	L11	L9-L11 HydrophobicContact CD2-CD1 4.46Å; L9-L11 PolarHBondContact O-N 3.23Å
10	F	44.3	Very low	48.1	Very low	178 Å²	178	130.4 Å²	130.4	78%	0.781	78%	0.778	S	S	*	*			trans	-77.7	99.9	173.8	-127.1	-92.3	0	0	0	109.1	I8 L12	I8-F10 HydrophobicContact CG2-CD2 4.35Å; I8-F10 PolarHBondContact O-N 3.32Å; F10-L12 PolarHBondContact O-N 2.72Å; F10-L12 VanDerWaalsContact O-N 3.16Å
11	L	44.2	Very low	50.2	Low	141 Å²	141	125.4 Å²	125.4	74%	0.738	75%	0.749	S	S	*	*			trans	-73.9	96.6	166.2	-105.9	132.1	0	0	0	108.2	L9 I13	L9-L11 HydrophobicContact CD2-CD1 4.46Å; L9-L11 PolarHBondContact O-N 3.23Å; L11-I13 PolarHBondContact O-N 3.16Å
12	L	42.7	Very low	52.7	Low	145 Å²	145	113.9 Å²	113.9	76%	0.759	69%	0.693	S	S	*	*			trans	-66	96.7	164.9	-95.9	139.7	0	0	0	108.4	F10 V14	F10-L12 PolarHBondContact O-N 2.72Å; F10-L12 VanDerWaalsContact O-N 3.16Å; L12-V14 VanDerWaalsContact C-N 3.28Å; L12-V14 PolarHBondContact O-N 3.03Å
13	I	46.1	Very low	55.6	Low	151 Å²	151	108.9 Å²	108.9	77%	0.774	65%	0.651	S	S	*	*			trans	-68.9	94.3	162.5	-62.1	168.3	0	0	0	105.7	L11 A15	L11-I13 PolarHBondContact O-N 3.16Å; I13-A15 VanDerWaalsContact C-N 3.33Å; I13-A15 PolarHBondContact O-N 3.45Å
14	V	44.9	Very low	58.3	Low	113 Å²	113	103.3 Å²	103.3	69%	0.685	61%	0.612	S	S	*	*			trans	-65.6	102.1	163.1	179.6	0	0	0	0	105.3	L12 M16	L12-V14 VanDerWaalsContact C-N 3.28Å; L12-V14 PolarHBondContact O-N 3.03Å; V14-M16 PolarHBondContact O-N 2.93Å
15	A	40.5	Very low	60.8	Low	88 Å²	88	99.3 Å²	99.3	73%	0.727	58%	0.582	S	S	*	*			trans	-62.2	94.6	163.9	0	0	0	0	0	106.3	I13 S17	I13-A15 VanDerWaalsContact C-N 3.33Å; I13-A15 PolarHBondContact O-N 3.45Å; A15-S17 VanDerWaalsContact C-N 3.26Å; A15-S17 PolarHBondContact O-N 3.2Å
16	M	40.5	Very low	63.4	Low	172 Å²	172	93 Å²	93	85%	0.847	54%	0.543	S	S	*	.			trans	-61.1	99.7	163.2	-73	-178.7	72.2	0	0	105.5	V14 A18	V14-M16 PolarHBondContact O-N 2.93Å; M16-A18 PolarHBondContact O-N 3.01Å
17	S	47.7	Very low	65.9	Low	110 Å²	110	88.1 Å²	88.1	77%	0.769	51%	0.512	S	S	*	.			trans	-56.3	108.4	165.1	54.9	0	0	0	0	106	A15 A19	A15-S17 VanDerWaalsContact C-N 3.26Å; A15-S17 PolarHBondContact O-N 3.2Å; S17-A19 PolarHBondContact O-N 3.45Å
18	A	60.1	Low	68.4	Low	95 Å²	95	83.8 Å²	83.8	79%	0.785	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-53.1	129.3	174.3	0	0	0	0	0	107.8	M16 E20	M16-A18 PolarHBondContact O-N 3.01Å; A18-E20 PolarHBondContact O-N 3.14Å
19	A	74.6	Confident	70.7	Confident	94 Å²	94	77.5 Å²	77.5	78%	0.777	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-57.5	131	179	0	0	0	0	0	109.1	S17	S17-A19 PolarHBondContact O-N 3.45Å
20	E	87.9	Confident	73.1	Confident	72 Å²	72	73.4 Å²	73.4	34%	0.336	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-59.4	125.8	179	-173.4	176.4	173.5	0	0	109.4	A18 L222 R237	A18-E20 PolarHBondContact O-N 3.14Å; E20-L222 HydrophobicContact CG-CD2 4.44Å; E20-R237 VanDerWaalsContact CD-NH1 3.26Å; E20-R237 IonicContact OE1-CZ 3.01Å; E20-R237 IonicContact OE1-NH1 3.81Å; E20-R237 PolarHBondContact OE1-NH1 3.11Å; E20-R237 IonicContact OE2-CZ 3.75Å; E20-R237 VanDerWaalsContact OE2-CZ 3.26Å; E20-R237 IonicContact OE2-NH1 3.91Å; E20-R237 PolarHBondContact OE2-NH1 2.65Å; E20-R237 IonicContact OE2-NH2 3.75Å; E20-R237 PolarHBondContact OE2-NH2 3.2Å
21	P	93.6	Very high	75.5	Confident	26 Å²	26	70.7 Å²	70.7	17%	0.169	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-68.6	140.8	178.1	24.3	-29.6	0	0	0	110.9	N252 N256	P21-N252 HydrophobicContact CG-CB 4.1Å; P21-N252 PolarHBondContact O-ND2 2.95Å; P21-N256 WeakPolarHBondContact CA-OD1 3.3Å; P21-N256 WeakPolarHBondContact CB-OD1 3.38Å
22	P	95.9	Very high	77.8	Confident	10 Å²	10	64 Å²	64	7%	0.065	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-72	131.4	179.5	25.1	-31.1	0	0	0	112.5	C24 L222 D235	P22-C24 VanDerWaalsContact C-N 3.34Å; P22-L222 HydrophobicContact CB-CD1 3.98Å; P22-D235 HydrophobicContact CB-CB 3.96Å; P22-D235 HydrophobicContact CG-CB 4.23Å
23	G	96.5	Very high	80.2	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	34%	0.341	C	S	.	.	S	Bend	trans	-69.1	-37.3	167.6	0	0	0	0	0	111.6	F236 R237 S271	G23-F236 PolarHBondContact N-O 3.3Å; G23-R237 WeakPolarHBondContact CA-O 3.1Å; G23-R237 PolarHBondContact N-O 3.31Å; G23-S271 WeakPolarHBondContact CA-OG 3.45Å; G23-S271 PolarHBondContact O-N 2.73Å; G23-S271 PolarHBondContact O-OG 3.07Å; G23-S271 VanDerWaalsContact O-OG 3.08Å
24	C	96.7	Very high	82.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	130.8	-176.7	171.9	0	0	0	0	109.9	P22 Y219 F236 L268 G269 L270 F274	P22-C24 VanDerWaalsContact C-N 3.34Å; C24-Y219 HydrophobicContact CB-CE1 4.39Å; C24-F236 HydrophobicContact CB-CB 4.06Å; C24-F236 PolarHBondContact N-O 3.45Å; C24-F236 CarbonylContact O-C 3.57Å; C24-F236 WeakPolarHBondContact O-CA 3.4Å; C24-F236 WeakPolarHBondContact O-CB 3.22Å; C24-F236 PolarHBondContact O-N 2.83Å; C24-L268 WeakPolarHBondContact SG-CD1 3.17Å; C24-G269 CarbonylContact C-O 3.45Å; C24-G269 WeakPolarHBondContact CA-O 3.36Å; C24-L270 HydrophobicContact CB-CD2 4.04Å; C24-F274 HydrophobicContact CB-CD2 4.36Å
25	K	96.8	Very high	84.4	Confident	27 Å²	27	53 Å²	53	12%	0.117	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	130.8	174	-177.7	176.6	-166.4	90.5	0	109.1	M234 D235 P257 V259 L268 G269	K25-M234 WeakPolarHBondContact CA-O 3.22Å; K25-D235 WeakPolarHBondContact CD-OD1 3.23Å; K25-D235 VanDerWaalsContact CG-OD1 3.28Å; K25-D235 WeakPolarHBondContact CG-OD1 3.39Å; K25-D235 IonicContact NZ-OD1 2.75Å; K25-D235 PolarHBondContact NZ-OD1 3.46Å; K25-D235 IonicContact NZ-OD2 3.57Å; K25-D235 PolarHBondContact NZ-OD2 2.9Å; K25-P257 HydrophobicContact CB-CB 4.43Å; K25-P257 WeakPolarHBondContact CD-O 3.33Å; K25-V259 HydrophobicContact CD-CG2 4.41Å; K25-L268 CarbonylContact O-C 3.53Å; K25-L268 WeakPolarHBondContact O-CA 3.36Å; K25-G269 PolarHBondContact N-O 3.46Å; K25-G269 PolarHBondContact O-N 2.77Å
26	I	96.4	Very high	86.8	Confident	3 Å²	3	51.1 Å²	51.1	2%	0.015	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	128.4	172.9	-57.1	-177	0	0	0	108.8	M234 F236 V266 Y267 L268 I438 P439	I26-M234 HydrophobicContact CB-CE 4.23Å; I26-M234 HydrophobicContact CG2-CE 4.04Å; I26-M234 PolarHBondContact N-O 3.42Å; I26-M234 PolarHBondContact O-N 3Å; I26-F236 HydrophobicContact CB-CD2 4.39Å; I26-F236 HydrophobicContact CB-CE2 3.88Å; I26-F236 HydrophobicContact CD1-CD2 4.08Å; I26-F236 HydrophobicContact CD1-CE2 3.61Å; I26-F236 HydrophobicContact CD1-CZ 4.36Å; I26-F236 HydrophobicContact CG1-CD2 3.92Å; I26-F236 HydrophobicContact CG1-CE2 3.69Å; I26-V266 HydrophobicContact CG2-CG2 3.81Å; I26-Y267 CarbonylContact C-O 3.56Å; I26-Y267 WeakPolarHBondContact CA-O 3.41Å; I26-L268 HydrophobicContact CD1-CD1 4.23Å; I26-L268 HydrophobicContact CG1-CD1 3.73Å; I26-I438 HydrophobicContact CD1-CG2 4.09Å; I26-P439 HydrophobicContact CD1-CG 3.93Å
27	R	97.1	Very high	89.2	Confident	16 Å²	16	45.8 Å²	45.8	6%	0.06	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	128	171.7	164.6	173.1	-65.8	169	6.8	109.4	T29 L232 D233 V259 V266 Y267	R27-T29 HydrophobicContact CG-CG2 4.13Å; R27-L232 CarbonylContact C-O 3.32Å; R27-L232 WeakPolarHBondContact CA-O 3.45Å; R27-D233 WeakPolarHBondContact CB-OD1 3.44Å; R27-D233 VanDerWaalsContact CG-OD1 3.3Å; R27-D233 WeakPolarHBondContact CG-OD1 3.39Å; R27-D233 IonicContact CZ-OD1 3.24Å; R27-D233 IonicContact CZ-OD2 3.55Å; R27-D233 IonicContact NE-OD1 3.45Å; R27-D233 PolarHBondContact NE-OD1 2.93Å; R27-D233 IonicContact NE-OD2 3.91Å; R27-D233 PolarHBondContact NE-OD2 2.83Å; R27-D233 IonicContact NH2-OD1 2.77Å; R27-D233 IonicContact NH2-OD2 2.83Å; R27-D233 PolarHBondContact NH2-OD2 2.77Å; R27-V259 HydrophobicContact CB-CG1 4.48Å; R27-V259 VanDerWaalsContact CZ-O 3.24Å; R27-V259 VanDerWaalsContact NH1-C 3.26Å; R27-V259 PolarHBondContact NH1-O 3.26Å; R27-V259 PolarHBondContact NH2-O 3.02Å; R27-V259 VanDerWaalsContact NH2-O 3.13Å; R27-V266 CarbonylContact O-C 3.49Å; R27-V266 VanDerWaalsContact O-CA 3.26Å; R27-V266 WeakPolarHBondContact O-CA 3.36Å; R27-V266 WeakPolarHBondContact O-CG2 3.48Å; R27-Y267 HydrophobicContact CG-CD2 4.49Å; R27-Y267 PolarHBondContact N-O 3.01Å; R27-Y267 PolarHBondContact O-N 3.21Å
28	I	96.4	Very high	91.1	Very high	33 Å²	33	48.2 Å²	48.2	17%	0.169	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	134.6	166.7	-59.1	176.2	0	0	0	107.8	L33 F84 S231 L232 M234	I28-L33 HydrophobicContact CG2-CD1 3.97Å; I28-F84 WeakPolarHBondContact O-CZ 3.49Å; I28-S231 CarbonylContact O-C 3.58Å; I28-S231 WeakPolarHBondContact O-CA 3.38Å; I28-S231 WeakPolarHBondContact O-CB 3.35Å; I28-L232 HydrophobicContact CB-CB 4.46Å; I28-L232 HydrophobicContact CD1-CD2 4.36Å; I28-L232 PolarHBondContact N-O 2.86Å; I28-L232 PolarHBondContact O-N 2.97Å; I28-M234 HydrophobicContact CD1-CE 4Å; I28-M234 HydrophobicContact CG1-CE 4.33Å
29	T	97	Very high	92.5	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	174.3	-177.6	74.3	0	0	0	0	112.1	R27 R31 G32 L33 R230 Y262 R264 M265 Y267	R27-T29 HydrophobicContact CG-CG2 4.13Å; T29-R31 PolarHBondContact O-N 3.37Å; T29-R31 PolarHBondContact OG1-N 2.98Å; T29-G32 WeakPolarHBondContact O-CA 3.49Å; T29-G32 PolarHBondContact O-N 3.32Å; T29-L33 VanDerWaalsContact O-CD1 3.27Å; T29-L33 WeakPolarHBondContact O-CD1 3.41Å; T29-L33 PolarHBondContact O-N 3.4Å; T29-L33 VanDerWaalsContact O-N 3.09Å; T29-R230 WeakPolarHBondContact CA-O 3.49Å; T29-Y262 HydrophobicContact CG2-CD1 4.22Å; T29-R264 VanDerWaalsContact CG2-O 3.3Å; T29-R264 WeakPolarHBondContact CG2-O 3.28Å; T29-R264 PolarHBondContact OG1-O 2.62Å; T29-M265 PolarHBondContact N-O 2.75Å; T29-M265 PolarHBondContact OG1-O 3.3Å; T29-Y267 HydrophobicContact CG2-CD2 3.91Å; T29-Y267 HydrophobicContact CG2-CE2 3.73Å
30	N	94.8	Very high	93.3	Very high	66 Å²	66	42 Å²	42	35%	0.353	19%	0.194	S	C	.	.	H	α-helix	trans	-53.6	-35.4	172.4	-70.5	-5.2	0	0	0	113.1	G32 L33 E34 F84 R230	N30-G32 VanDerWaalsContact C-N 3.26Å; N30-G32 PolarHBondContact O-N 3Å; N30-L33 WeakPolarHBondContact O-CA 3.17Å; N30-L33 WeakPolarHBondContact O-CB 3.43Å; N30-L33 PolarHBondContact O-N 3.43Å; N30-E34 WeakPolarHBondContact O-CG 3.45Å; N30-E34 PolarHBondContact O-N 3.45Å; N30-F84 WeakPolarHBondContact OD1-CD2 2.71Å; N30-F84 WeakPolarHBondContact OD1-CE2 3.27Å; N30-R230 PolarHBondContact N-O 3.34Å; N30-R230 WeakPolarHBondContact OD1-CA 3.26Å; N30-R230 PolarHBondContact OD1-O 3.41Å
31	R	94.2	Very high	93.4	Very high	122 Å²	122	41.2 Å²	41.2	46%	0.46	19%	0.19	S	C	.	.	H	α-helix	trans	-64.7	-34.6	176.3	-57.2	-164.5	86.2	-172.2	3.9	111.6	T29 L33 M35 D263 M265	T29-R31 PolarHBondContact O-N 3.37Å; T29-R31 PolarHBondContact OG1-N 2.98Å; R31-L33 VanDerWaalsContact C-N 3.35Å; R31-M35 PolarHBondContact O-N 3.04Å; R31-D263 WeakPolarHBondContact CD-O 3.38Å; R31-D263 PolarHBondContact NH1-O 2.89Å; R31-M265 HydrophobicContact CB-CG 4.14Å
32	G	93.5	Very high	93.3	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-65.4	-39.2	171.2	0	0	0	0	0	111.7	T29 N30 M35 L36	T29-G32 WeakPolarHBondContact O-CA 3.49Å; T29-G32 PolarHBondContact O-N 3.32Å; N30-G32 VanDerWaalsContact C-N 3.26Å; N30-G32 PolarHBondContact O-N 3Å; G32-M35 WeakPolarHBondContact O-CB 3.19Å; G32-M35 PolarHBondContact O-N 3.05Å; G32-L36 WeakPolarHBondContact O-CG 3.35Å; G32-L36 PolarHBondContact O-N 3.43Å; G32-L36 VanDerWaalsContact O-N 3.08Å
33	L	93	Very high	93.1	Very high	5 Å²	5	44.9 Å²	44.9	3%	0.026	20%	0.202	C	C	.	.	H	α-helix	trans	-67.3	-37	176.7	-86.8	72.9	0	0	0	112.4	I28 T29 N30 R31 M35 L36 K37 L82 F84 L90	I28-L33 HydrophobicContact CG2-CD1 3.97Å; T29-L33 VanDerWaalsContact O-CD1 3.27Å; T29-L33 WeakPolarHBondContact O-CD1 3.41Å; T29-L33 PolarHBondContact O-N 3.4Å; T29-L33 VanDerWaalsContact O-N 3.09Å; N30-L33 WeakPolarHBondContact O-CA 3.17Å; N30-L33 WeakPolarHBondContact O-CB 3.43Å; N30-L33 PolarHBondContact O-N 3.43Å; R31-L33 VanDerWaalsContact C-N 3.35Å; L33-M35 PolarHBondContact O-N 3.11Å; L33-L36 CarbonylContact O-C 3.53Å; L33-L36 PolarHBondContact O-N 2.98Å; L33-L36 VanDerWaalsContact O-N 3.1Å; L33-K37 WeakPolarHBondContact O-CB 3.39Å; L33-K37 PolarHBondContact O-N 3.47Å; L33-L82 HydrophobicContact CB-CD2 4.46Å; L33-L82 HydrophobicContact CD2-CG 4.21Å; L33-L82 HydrophobicContact CG-CD2 4.25Å; L33-L82 HydrophobicContact CG-CG 4.43Å; L33-F84 HydrophobicContact CD1-CD1 4.28Å; L33-F84 HydrophobicContact CD1-CD2 4.35Å; L33-F84 HydrophobicContact CD1-CE1 3.4Å; L33-F84 HydrophobicContact CD1-CE2 3.51Å; L33-F84 HydrophobicContact CD1-CZ 2.98Å; L33-F84 HydrophobicContact CD2-CD1 3.95Å; L33-F84 HydrophobicContact CD2-CD2 4.15Å; L33-F84 HydrophobicContact CD2-CE1 3.88Å; L33-F84 HydrophobicContact CD2-CE2 4.11Å; L33-F84 HydrophobicContact CD2-CG 4.09Å; L33-F84 HydrophobicContact CD2-CZ 4.02Å; L33-F84 HydrophobicContact CG-CE1 4.25Å; L33-F84 HydrophobicContact CG-CE2 4.43Å; L33-F84 HydrophobicContact CG-CZ 4.13Å; L33-L90 HydrophobicContact CD2-CD2 3.98Å
34	E	90.9	Very high	92.9	Very high	133 Å²	133	45 Å²	45	62%	0.621	20%	0.203	S	C	*	.	H	α-helix	trans	-57.5	-38.9	175.1	-74	174.1	179	0	0	111.6	N30 K37	N30-E34 WeakPolarHBondContact O-CG 3.45Å; N30-E34 PolarHBondContact O-N 3.45Å; E34-K37 WeakPolarHBondContact O-CB 3.42Å
35	M	88.9	Confident	92.7	Very high	38 Å²	38	47 Å²	47	19%	0.187	22%	0.215	C	C	.	.	H	α-helix	trans	-67.2	-46.7	173.2	-173.5	-147.8	-173.1	0	0	111.6	R31 G32 L33 K37 M265 L464 H465 F466	R31-M35 PolarHBondContact O-N 3.04Å; G32-M35 WeakPolarHBondContact O-CB 3.19Å; G32-M35 PolarHBondContact O-N 3.05Å; L33-M35 PolarHBondContact O-N 3.11Å; M35-K37 VanDerWaalsContact C-N 3.25Å; M35-K37 PolarHBondContact O-N 2.86Å; M35-M265 HydrophobicContact CB-CE 3.91Å; M35-M265 HydrophobicContact CB-SD 4.02Å; M35-M265 HydrophobicContact CG-CE 4.29Å; M35-M265 HydrophobicContact CG-SD 4.29Å; M35-M265 HydrophobicContact SD-SD 3.95Å; M35-L464 VanDerWaalsContact CE-C 3.48Å; M35-L464 HydrophobicContact CE-CB 4.2Å; M35-L464 WeakPolarHBondContact CE-O 3.27Å; M35-L464 HydrophobicContact SD-CB 3.65Å; M35-H465 VanDerWaalsContact CE-CA 3.47Å; M35-F466 HydrophobicContact CE-CB 4.24Å; M35-F466 HydrophobicContact CE-CD2 3.21Å; M35-F466 HydrophobicContact CE-CE2 3.75Å; M35-F466 HydrophobicContact CE-CG 3.96Å; M35-F466 VanDerWaalsContact CE-N 3.28Å; M35-F466 HydrophobicContact CG-CD2 4.41Å; M35-F466 HydrophobicContact CG-CE2 4.34Å; M35-F466 HydrophobicContact SD-CD2 4.01Å; M35-F466 HydrophobicContact SD-CE2 3.91Å
36	L	90.5	Very high	92.5	Very high	49 Å²	49	48.3 Å²	48.3	26%	0.257	22%	0.222	S	C	.	.	H	α-helix	trans	-64.9	-29	179.1	-67.6	178.8	0	0	0	113	G32 L33 Y38 E39 T40 L82 F466	G32-L36 WeakPolarHBondContact O-CG 3.35Å; G32-L36 PolarHBondContact O-N 3.43Å; G32-L36 VanDerWaalsContact O-N 3.08Å; L33-L36 CarbonylContact O-C 3.53Å; L33-L36 PolarHBondContact O-N 2.98Å; L33-L36 VanDerWaalsContact O-N 3.1Å; L36-Y38 VanDerWaalsContact C-N 3.31Å; L36-Y38 PolarHBondContact O-N 3.02Å; L36-E39 PolarHBondContact O-N 2.99Å; L36-T40 VanDerWaalsContact O-CB 3.27Å; L36-T40 WeakPolarHBondContact O-CB 3.5Å; L36-T40 PolarHBondContact O-N 3.12Å; L36-T40 PolarHBondContact O-OG1 2.9Å; L36-L82 HydrophobicContact CB-CD2 3.83Å; L36-F466 HydrophobicContact CD2-CE2 3.8Å; L36-F466 HydrophobicContact CD2-CZ 3.47Å; L36-F466 VanDerWaalsContact CD2-CZ 3.47Å
37	K	91.6	Very high	92.3	Very high	61 Å²	61	49.1 Å²	49.1	27%	0.265	23%	0.225	S	C	.	.	H	α-helix	trans	-55.4	-45.3	-177.5	175.6	178.3	173.5	157.8	0	111.8	L33 E34 M35 T40 Q41 A80 D81 L82	L33-K37 WeakPolarHBondContact O-CB 3.39Å; L33-K37 PolarHBondContact O-N 3.47Å; E34-K37 WeakPolarHBondContact O-CB 3.42Å; M35-K37 VanDerWaalsContact C-N 3.25Å; M35-K37 PolarHBondContact O-N 2.86Å; K37-T40 PolarHBondContact O-N 3.12Å; K37-Q41 WeakPolarHBondContact O-CB 3.48Å; K37-Q41 PolarHBondContact O-N 2.86Å; K37-A80 WeakPolarHBondContact CE-O 3.42Å; K37-A80 PolarHBondContact NZ-O 3.01Å; K37-D81 IonicContact NZ-OD1 2.79Å; K37-D81 PolarHBondContact NZ-OD1 2.73Å; K37-L82 HydrophobicContact CB-CB 4.16Å; K37-L82 HydrophobicContact CG-CB 4.43Å
38	Y	87.6	Confident	92.1	Very high	160 Å²	160	48.4 Å²	48.4	63%	0.627	22%	0.223	S	C	*	.	H	α-helix	trans	-65.1	-49	-179.5	178.6	-99.3	0	0	0	112.1	L36 T40 Q41 K42	L36-Y38 VanDerWaalsContact C-N 3.31Å; L36-Y38 PolarHBondContact O-N 3.02Å; Y38-T40 VanDerWaalsContact C-N 3.31Å; Y38-T40 PolarHBondContact O-N 2.7Å; Y38-Q41 PolarHBondContact O-N 2.82Å; Y38-K42 PolarHBondContact O-N 3.16Å
39	E	87.6	Confident	91.8	Very high	31 Å²	31	48.8 Å²	48.8	15%	0.145	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-38	177.3	-71	-62.2	138.3	0	0	111.9	L36 K42 F43 F466 L470	L36-E39 PolarHBondContact O-N 2.99Å; E39-K42 PolarHBondContact O-N 2.75Å; E39-F43 WeakPolarHBondContact O-CB 3.45Å; E39-F43 PolarHBondContact O-N 2.85Å; E39-F466 HydrophobicContact CB-CE2 4.32Å; E39-F466 HydrophobicContact CB-CZ 4.49Å; E39-F466 HydrophobicContact CG-CD2 3.71Å; E39-F466 HydrophobicContact CG-CE2 3.69Å; E39-F466 HydrophobicContact CG-CG 4.3Å; E39-F466 HydrophobicContact CG-CZ 4.17Å; E39-L470 HydrophobicContact CB-CB 4.38Å; E39-L470 PolarHBondContact OE2-N 3.33Å
40	T	91.4	Very high	91.5	Very high	29 Å²	29	54 Å²	54	18%	0.178	26%	0.256	C	S	.	.	H	α-helix	trans	-65	-45.3	176.7	-56.5	0	0	0	0	111	L36 K37 Y38 K42 F43 V44 F92	L36-T40 VanDerWaalsContact O-CB 3.27Å; L36-T40 WeakPolarHBondContact O-CB 3.5Å; L36-T40 PolarHBondContact O-N 3.12Å; L36-T40 PolarHBondContact O-OG1 2.9Å; K37-T40 PolarHBondContact O-N 3.12Å; Y38-T40 VanDerWaalsContact C-N 3.31Å; Y38-T40 PolarHBondContact O-N 2.7Å; T40-K42 VanDerWaalsContact C-N 3.34Å; T40-K42 PolarHBondContact O-N 3.11Å; T40-F43 PolarHBondContact O-N 2.94Å; T40-V44 HydrophobicContact CG2-CG2 4.39Å; T40-V44 WeakPolarHBondContact O-CG2 3.42Å; T40-V44 PolarHBondContact O-N 2.84Å; T40-F92 HydrophobicContact CG2-CD2 3.81Å; T40-F92 HydrophobicContact CG2-CE2 3.97Å
41	Q	91.8	Very high	91.2	Very high	55 Å²	55	51.7 Å²	51.7	26%	0.257	24%	0.244	S	C	.	.	H	α-helix	trans	-60.1	-45.9	178	-176.5	179.9	-3.3	0	0	111	K37 Y38 V44 V45 L77 A80	K37-Q41 WeakPolarHBondContact O-CB 3.48Å; K37-Q41 PolarHBondContact O-N 2.86Å; Y38-Q41 PolarHBondContact O-N 2.82Å; Q41-V44 PolarHBondContact O-N 3.31Å; Q41-V45 WeakPolarHBondContact O-CG2 3.39Å; Q41-V45 PolarHBondContact O-N 3.1Å; Q41-L77 HydrophobicContact CG-CB 4.29Å; Q41-L77 HydrophobicContact CG-CD1 3.93Å; Q41-L77 PolarHBondContact NE2-O 2.93Å; Q41-A80 HydrophobicContact CG-CB 4.24Å
42	K	90.4	Very high	90.8	Very high	103 Å²	103	51.5 Å²	51.5	45%	0.448	26%	0.256	S	S	.	.	H	α-helix	trans	-60.6	-48.2	177.1	-176.7	-177.9	173	-170.3	0	111.6	Y38 E39 T40 V44 V45 E46	Y38-K42 PolarHBondContact O-N 3.16Å; E39-K42 PolarHBondContact O-N 2.75Å; T40-K42 VanDerWaalsContact C-N 3.34Å; T40-K42 PolarHBondContact O-N 3.11Å; K42-V44 PolarHBondContact O-N 3.02Å; K42-V45 PolarHBondContact O-N 3.38Å; K42-E46 VanDerWaalsContact CE-OE1 3.28Å; K42-E46 WeakPolarHBondContact CE-OE1 3.49Å; K42-E46 WeakPolarHBondContact O-CG 3.29Å; K42-E46 PolarHBondContact O-N 3.09Å; K42-E46 VanDerWaalsContact O-N 3.09Å
43	F	91.8	Very high	90.5	Very high	9 Å²	9	52.8 Å²	52.8	4%	0.039	26%	0.262	C	S	.	.	H	α-helix	trans	-59.1	-44.2	177.6	172.9	-109.8	0	0	0	112.5	E39 T40 V45 E46 E47 A193 L197 I198 L470 I474	E39-F43 WeakPolarHBondContact O-CB 3.45Å; E39-F43 PolarHBondContact O-N 2.85Å; T40-F43 PolarHBondContact O-N 2.94Å; F43-V45 PolarHBondContact O-N 3.32Å; F43-E46 WeakPolarHBondContact O-CB 3.41Å; F43-E46 PolarHBondContact O-N 3.15Å; F43-E47 HydrophobicContact CD2-CG 4.36Å; F43-E47 HydrophobicContact CE1-CG 4.25Å; F43-E47 HydrophobicContact CE2-CG 3.94Å; F43-E47 HydrophobicContact CZ-CG 3.88Å; F43-E47 WeakPolarHBondContact O-CG 3.46Å; F43-E47 PolarHBondContact O-N 3.01Å; F43-A193 HydrophobicContact CE1-CB 3.84Å; F43-A193 HydrophobicContact CZ-CB 3.97Å; F43-L197 HydrophobicContact CE2-CD1 4.08Å; F43-L197 HydrophobicContact CZ-CB 4.03Å; F43-L197 HydrophobicContact CZ-CD1 3.9Å; F43-I198 HydrophobicContact CD1-CD1 4.41Å; F43-I198 HydrophobicContact CE1-CD1 3.86Å; F43-I198 HydrophobicContact CE1-CG1 4.2Å; F43-I198 HydrophobicContact CZ-CD1 4.2Å; F43-L470 HydrophobicContact CB-CD2 3.81Å; F43-L470 HydrophobicContact CD1-CD2 4.03Å; F43-L470 HydrophobicContact CD2-CD2 4.38Å; F43-L470 HydrophobicContact CG-CD2 3.82Å; F43-I474 HydrophobicContact CD2-CD1 4.27Å; F43-I474 HydrophobicContact CE2-CD1 3.64Å; F43-I474 HydrophobicContact CZ-CD1 4.03Å
44	V	93.3	Very high	90.1	Very high	4 Å²	4	55.7 Å²	55.7	2%	0.024	28%	0.281	C	S	.	.	H	α-helix	trans	-64.9	-38.7	177.4	170.2	0	0	0	0	111.9	T40 Q41 K42 E46 E47 L48 L77 F92 M190	T40-V44 HydrophobicContact CG2-CG2 4.39Å; T40-V44 WeakPolarHBondContact O-CG2 3.42Å; T40-V44 PolarHBondContact O-N 2.84Å; Q41-V44 PolarHBondContact O-N 3.31Å; K42-V44 PolarHBondContact O-N 3.02Å; V44-E46 VanDerWaalsContact C-N 3.31Å; V44-E46 PolarHBondContact O-N 2.88Å; V44-E47 PolarHBondContact O-N 3.42Å; V44-L48 HydrophobicContact CG1-CD1 3.7Å; V44-L48 HydrophobicContact CG1-CG 4.05Å; V44-L48 WeakPolarHBondContact O-CB 3.2Å; V44-L48 VanDerWaalsContact O-CG 3.31Å; V44-L48 WeakPolarHBondContact O-CG 3.08Å; V44-L48 PolarHBondContact O-N 3.08Å; V44-L77 HydrophobicContact CG1-CD1 4.32Å; V44-F92 HydrophobicContact CB-CE1 4.29Å; V44-F92 HydrophobicContact CB-CZ 4.16Å; V44-F92 HydrophobicContact CG1-CE1 3.92Å; V44-F92 HydrophobicContact CG1-CZ 4.13Å; V44-F92 HydrophobicContact CG2-CD1 4.46Å; V44-F92 HydrophobicContact CG2-CE1 3.89Å; V44-F92 HydrophobicContact CG2-CZ 3.93Å; V44-M190 HydrophobicContact CG1-CE 4.23Å; V44-M190 HydrophobicContact CG1-SD 3.85Å; V44-M190 HydrophobicContact CG2-CE 3.91Å; V44-M190 HydrophobicContact CG2-SD 4.3Å
45	V	92.6	Very high	90	Very high	41 Å²	41	54 Å²	54	25%	0.248	27%	0.273	C	S	.	.	H	α-helix	trans	-60.1	-43.8	174.7	168.4	0	0	0	0	110.9	Q41 K42 F43 S49 L75 L77	Q41-V45 WeakPolarHBondContact O-CG2 3.39Å; Q41-V45 PolarHBondContact O-N 3.1Å; K42-V45 PolarHBondContact O-N 3.38Å; F43-V45 PolarHBondContact O-N 3.32Å; V45-S49 VanDerWaalsContact O-CB 3.26Å; V45-S49 WeakPolarHBondContact O-CB 3.37Å; V45-S49 PolarHBondContact O-N 2.88Å; V45-S49 PolarHBondContact O-OG 2.8Å; V45-L75 HydrophobicContact CG1-CB 4.26Å; V45-L75 HydrophobicContact CG2-CD2 4.19Å; V45-L77 HydrophobicContact CG2-CD1 3.62Å; V45-L77 HydrophobicContact CG2-CG 4.01Å
46	E	91.3	Very high	89.8	Confident	55 Å²	55	53.2 Å²	53.2	26%	0.257	27%	0.27	S	S	.	.	H	α-helix	trans	-62.3	-46.1	177.4	-69.3	170.7	-172.1	0	0	111.6	K42 F43 V44 S49 N50 R471	K42-E46 VanDerWaalsContact CE-OE1 3.28Å; K42-E46 WeakPolarHBondContact CE-OE1 3.49Å; K42-E46 WeakPolarHBondContact O-CG 3.29Å; K42-E46 PolarHBondContact O-N 3.09Å; K42-E46 VanDerWaalsContact O-N 3.09Å; F43-E46 WeakPolarHBondContact O-CB 3.41Å; F43-E46 PolarHBondContact O-N 3.15Å; V44-E46 VanDerWaalsContact C-N 3.31Å; V44-E46 PolarHBondContact O-N 2.88Å; E46-S49 PolarHBondContact O-N 3.01Å; E46-N50 PolarHBondContact O-N 3.13Å; E46-N50 PolarHBondContact O-ND2 2.97Å; E46-R471 WeakPolarHBondContact OE2-CB 3.07Å; E46-R471 WeakPolarHBondContact OE2-CG 3.46Å
47	E	92.4	Very high	89.7	Confident	19 Å²	19	57 Å²	57	9%	0.089	28%	0.284	C	S	.	.	H	α-helix	trans	-65.3	-45.3	179.7	-70.8	-59.1	116	0	0	112.6	F43 V44 S49 N50 A193 L197 R471	F43-E47 HydrophobicContact CD2-CG 4.36Å; F43-E47 HydrophobicContact CE1-CG 4.25Å; F43-E47 HydrophobicContact CE2-CG 3.94Å; F43-E47 HydrophobicContact CZ-CG 3.88Å; F43-E47 WeakPolarHBondContact O-CG 3.46Å; F43-E47 PolarHBondContact O-N 3.01Å; V44-E47 PolarHBondContact O-N 3.42Å; E47-S49 VanDerWaalsContact C-N 3.32Å; E47-S49 PolarHBondContact O-N 2.06Å; E47-N50 PolarHBondContact O-N 2.76Å; E47-A193 HydrophobicContact CB-CB 4.46Å; E47-A193 HydrophobicContact CG-CB 3.93Å; E47-L197 VanDerWaalsContact CD-CD1 3.48Å; E47-L197 HydrophobicContact CG-CD1 4.44Å; E47-L197 WeakPolarHBondContact OE2-CD1 3.34Å; E47-R471 IonicContact OE1-CZ 3.3Å; E47-R471 IonicContact OE1-NH1 3.86Å; E47-R471 PolarHBondContact OE1-NH1 3.06Å
48	L	92.3	Very high	89.5	Confident	2 Å²	2	55 Å²	55	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-68.8	-33	179	-65.6	-180	0	0	0	111.9	V44 N50 I51 I72 L75 I127 I186 A189 M190	V44-L48 HydrophobicContact CG1-CD1 3.7Å; V44-L48 HydrophobicContact CG1-CG 4.05Å; V44-L48 WeakPolarHBondContact O-CB 3.2Å; V44-L48 VanDerWaalsContact O-CG 3.31Å; V44-L48 WeakPolarHBondContact O-CG 3.08Å; V44-L48 PolarHBondContact O-N 3.08Å; L48-N50 PolarHBondContact O-N 3.01Å; L48-I51 HydrophobicContact CB-CD1 4.31Å; L48-I51 HydrophobicContact CD2-CD1 3.69Å; L48-I51 WeakPolarHBondContact O-CB 3.44Å; L48-I51 WeakPolarHBondContact O-CD1 3.4Å; L48-I51 VanDerWaalsContact O-CG1 3.28Å; L48-I51 WeakPolarHBondContact O-CG1 3.08Å; L48-I51 PolarHBondContact O-N 3.44Å; L48-I72 VanDerWaalsContact O-CD1 3.28Å; L48-I72 WeakPolarHBondContact O-CD1 3.49Å; L48-L75 HydrophobicContact CB-CD1 3.72Å; L48-L75 HydrophobicContact CB-CD2 4.38Å; L48-L75 HydrophobicContact CD1-CD1 4.34Å; L48-L75 HydrophobicContact CD1-CD2 3.87Å; L48-I127 HydrophobicContact CD1-CD1 3.8Å; L48-I186 HydrophobicContact CD2-CG2 4.15Å; L48-A189 HydrophobicContact CD2-CB 4.17Å; L48-M190 HydrophobicContact CD2-CG 4.49Å; L48-M190 HydrophobicContact CD2-SD 4.21Å
49	S	91.6	Very high	89.3	Confident	41 Å²	41	53 Å²	53	29%	0.287	28%	0.282	S	S	.	.	H	α-helix	trans	-66.1	-25.6	177.9	-60.1	0	0	0	0	112.9	V45 E46 E47 I51	V45-S49 VanDerWaalsContact O-CB 3.26Å; V45-S49 WeakPolarHBondContact O-CB 3.37Å; V45-S49 PolarHBondContact O-N 2.88Å; V45-S49 PolarHBondContact O-OG 2.8Å; E46-S49 PolarHBondContact O-N 3.01Å; E47-S49 VanDerWaalsContact C-N 3.32Å; E47-S49 PolarHBondContact O-N 2.06Å; S49-I51 VanDerWaalsContact C-N 3.35Å
50	N	90	Very high	88.9	Confident	109 Å²	109	54.8 Å²	54.8	58%	0.583	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	7.1	179.3	-70.7	-30.3	0	0	0	113.9	E46 E47 L48 T52	E46-N50 PolarHBondContact O-N 3.13Å; E46-N50 PolarHBondContact O-ND2 2.97Å; E47-N50 PolarHBondContact O-N 2.76Å; L48-N50 PolarHBondContact O-N 3.01Å; N50-T52 PolarHBondContact O-N 3.4Å
51	I	89.4	Confident	88.4	Confident	19 Å²	19	56.8 Å²	56.8	10%	0.097	32%	0.316	C	S	.	.			trans	-59.2	128.1	175.5	-72.6	171.4	0	0	0	110.2	L48 S49 M53 I72 Q185 A189	L48-I51 HydrophobicContact CB-CD1 4.31Å; L48-I51 HydrophobicContact CD2-CD1 3.69Å; L48-I51 WeakPolarHBondContact O-CB 3.44Å; L48-I51 WeakPolarHBondContact O-CD1 3.4Å; L48-I51 VanDerWaalsContact O-CG1 3.28Å; L48-I51 WeakPolarHBondContact O-CG1 3.08Å; L48-I51 PolarHBondContact O-N 3.44Å; S49-I51 VanDerWaalsContact C-N 3.35Å; I51-M53 HydrophobicContact CG2-CE 3.6Å; I51-M53 HydrophobicContact CG2-SD 4.22Å; I51-I72 HydrophobicContact CB-CD1 4.44Å; I51-Q185 HydrophobicContact CD1-CB 4.49Å; I51-Q185 HydrophobicContact CG2-CB 3.6Å; I51-Q185 HydrophobicContact CG2-CG 4.13Å; I51-A189 HydrophobicContact CD1-CB 3.95Å; I51-A189 HydrophobicContact CG1-CB 3.81Å
52	T	85.8	Confident	88	Confident	117 Å²	117	63.8 Å²	63.8	72%	0.718	34%	0.34	S	S	*	.			trans	-91.6	128.6	172	55.5	0	0	0	0	109.8	N50	N50-T52 PolarHBondContact O-N 3.4Å
53	M	85.8	Confident	87.6	Confident	29 Å²	29	60.2 Å²	60.2	14%	0.143	33%	0.325	C	S	.	.			trans	-104.4	138.3	177	-66.3	-69.1	177.4	0	0	110.3	I51 V70 L182 Q185	I51-M53 HydrophobicContact CG2-CE 3.6Å; I51-M53 HydrophobicContact CG2-SD 4.22Å; M53-V70 HydrophobicContact CB-CB 3.76Å; M53-V70 HydrophobicContact CB-CG1 4.26Å; M53-V70 HydrophobicContact CB-CG2 3.92Å; M53-V70 HydrophobicContact CG-CB 3.94Å; M53-V70 HydrophobicContact CG-CG1 3.89Å; M53-V70 HydrophobicContact CG-CG2 4.42Å; M53-L182 HydrophobicContact CE-CB 3.93Å; M53-L182 HydrophobicContact CE-CD1 3.21Å; M53-L182 HydrophobicContact CE-CG 4.13Å; M53-Q185 HydrophobicContact CE-CB 4.12Å; M53-Q185 HydrophobicContact CE-CG 4.22Å; M53-Q185 HydrophobicContact SD-CB 4.34Å; M53-Q185 HydrophobicContact SD-CG 3.79Å
54	P	86.2	Confident	87.5	Confident	65 Å²	65	64.5 Å²	64.5	42%	0.422	35%	0.345	S	S	.	.			trans	-67	151.1	174.3	29.4	-34.2	0	0	0	111	M56 L181	P54-M56 PolarHBondContact O-N 3Å; P54-L181 HydrophobicContact CG-CD1 4.5Å; P54-L181 HydrophobicContact CG-CD2 4.46Å
55	E	87.7	Confident	87.2	Confident	98 Å²	98	65.3 Å²	65.3	46%	0.458	35%	0.348	S	S	.	.			trans	-63.5	133.4	169.7	-170.3	179.4	-168.3	0	0	109.8	K57 T66 I67 N68	E55-K57 HydrophobicContact CG-CG 4.38Å; E55-K57 WeakPolarHBondContact OE1-CE 3.3Å; E55-K57 IonicContact OE1-NZ 2.76Å; E55-K57 PolarHBondContact OE1-NZ 3.35Å; E55-K57 VanDerWaalsContact OE2-CE 3.32Å; E55-K57 WeakPolarHBondContact OE2-CE 3.09Å; E55-K57 IonicContact OE2-NZ 3.53Å; E55-K57 PolarHBondContact OE2-NZ 3.15Å; E55-T66 HydrophobicContact CG-CG2 4.27Å; E55-T66 WeakPolarHBondContact OE1-CG2 3.49Å; E55-I67 WeakPolarHBondContact CA-O 3.25Å; E55-I67 VanDerWaalsContact CG-O 3.32Å; E55-I67 WeakPolarHBondContact CG-O 3.44Å; E55-N68 HydrophobicContact CG-CB 4.1Å
56	M	85.6	Confident	87.1	Confident	22 Å²	22	64.3 Å²	64.3	11%	0.108	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	125.8	175.3	-59.1	174.5	-74.2	0	0	109.8	P54 Y65 T66 I67 M178 L181	P54-M56 PolarHBondContact O-N 3Å; M56-Y65 HydrophobicContact CB-CE2 4.4Å; M56-T66 CarbonylContact O-C 3.55Å; M56-T66 WeakPolarHBondContact O-CA 3.46Å; M56-I67 HydrophobicContact CB-CB 4.36Å; M56-I67 HydrophobicContact CE-CB 3.66Å; M56-I67 HydrophobicContact CE-CD1 3.64Å; M56-I67 HydrophobicContact CE-CG1 4.27Å; M56-I67 HydrophobicContact CE-CG2 3.42Å; M56-I67 VanDerWaalsContact CE-CG2 3.42Å; M56-I67 PolarHBondContact N-O 3.24Å; M56-I67 PolarHBondContact O-N 3.44Å; M56-M178 HydrophobicContact CE-CG 3.5Å; M56-M178 HydrophobicContact CE-SD 3.02Å; M56-M178 WeakPolarHBondContact CE-SD 3.48Å; M56-M178 HydrophobicContact SD-CG 3.96Å; M56-M178 HydrophobicContact SD-SD 3.53Å; M56-L181 HydrophobicContact CG-CD1 3.62Å; M56-L181 HydrophobicContact SD-CD1 3.46Å; M56-L181 WeakPolarHBondContact SD-CD1 2.88Å
57	K	88.5	Confident	86.9	Confident	127 Å²	127	61.8 Å²	61.8	55%	0.552	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.2	173.9	-64.8	-179.1	175.4	146	0	109.7	E55 Y65 T66	E55-K57 HydrophobicContact CG-CG 4.38Å; E55-K57 WeakPolarHBondContact OE1-CE 3.3Å; E55-K57 IonicContact OE1-NZ 2.76Å; E55-K57 PolarHBondContact OE1-NZ 3.35Å; E55-K57 VanDerWaalsContact OE2-CE 3.32Å; E55-K57 WeakPolarHBondContact OE2-CE 3.09Å; E55-K57 IonicContact OE2-NZ 3.53Å; E55-K57 PolarHBondContact OE2-NZ 3.15Å; K57-Y65 WeakPolarHBondContact CA-O 3.29Å; K57-T66 HydrophobicContact CD-CG2 4.42Å; K57-T66 HydrophobicContact CG-CG2 3.97Å
58	G	86.1	Confident	86.8	Confident	21 Å²	21	63.3 Å²	63.3	22%	0.216	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.1	170.7	175.4	0	0	0	0	0	112.9	Y65	G58-Y65 VanDerWaalsContact C-CE1 3.48Å; G58-Y65 PolarHBondContact N-O 2.95Å; G58-Y65 VanDerWaalsContact N-O 3.1Å; G58-Y65 VanDerWaalsContact O-CD1 3.25Å; G58-Y65 WeakPolarHBondContact O-CD1 3.45Å; G58-Y65 WeakPolarHBondContact O-CE1 3.26Å; G58-Y65 PolarHBondContact O-N 3.41Å
59	N	84.9	Confident	86.6	Confident	118 Å²	118	68.8 Å²	68.8	63%	0.631	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.2	175.6	-65.3	-32.7	0	0	0	108.1	F63 E64	N59-F63 CarbonylContact C-O 3.53Å; N59-F63 WeakPolarHBondContact CA-O 3.48Å; N59-E64 WeakPolarHBondContact OD1-CA 3.45Å; N59-E64 VanDerWaalsContact OD1-CB 3.25Å; N59-E64 WeakPolarHBondContact OD1-CB 3.37Å; N59-E64 VanDerWaalsContact OD1-CG 3.3Å; N59-E64 WeakPolarHBondContact OD1-CG 3.09Å
60	E	79.1	Confident	86.5	Confident	67 Å²	67	67.9 Å²	67.9	31%	0.313	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	108.6	175.9	-169.3	60.6	-133.9	0	0	108.8	R62 F63 F169	E60-R62 PolarHBondContact O-N 3.03Å; E60-R62 VanDerWaalsContact O-N 3.11Å; E60-F63 PolarHBondContact N-O 3.39Å; E60-F63 WeakPolarHBondContact O-CD2 3.45Å; E60-F63 PolarHBondContact O-N 3.49Å; E60-F169 HydrophobicContact CB-CE1 4.37Å; E60-F169 HydrophobicContact CG-CE1 3.53Å; E60-F169 HydrophobicContact CG-CZ 3.67Å
61	G	80.4	Confident	86.5	Confident	72 Å²	72	68.4 Å²	68.4	74%	0.742	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	-111.3	-172.8	0	0	0	0	0	112.8
62	R	82.4	Confident	86.6	Confident	201 Å²	201	68.5 Å²	68.5	76%	0.758	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	9.3	178.9	-64.2	-175.4	-178.8	179.2	0.2	113.2	E60 Y109	E60-R62 PolarHBondContact O-N 3.03Å; E60-R62 VanDerWaalsContact O-N 3.11Å; R62-Y109 HydrophobicContact CB-CD2 4.26Å; R62-Y109 HydrophobicContact CB-CE2 3.97Å
63	F	83.3	Confident	86.8	Confident	29 Å²	29	67.1 Å²	67.1	13%	0.127	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.5	-175.8	-53.9	-81.8	0	0	0	109.4	N59 E60 I107 L108 Y109 V166 F169	N59-F63 CarbonylContact C-O 3.53Å; N59-F63 WeakPolarHBondContact CA-O 3.48Å; E60-F63 PolarHBondContact N-O 3.39Å; E60-F63 WeakPolarHBondContact O-CD2 3.45Å; E60-F63 PolarHBondContact O-N 3.49Å; F63-I107 HydrophobicContact CB-CG2 4.34Å; F63-I107 HydrophobicContact CD1-CG2 4.16Å; F63-L108 WeakPolarHBondContact CA-O 3.35Å; F63-Y109 AromaticContact CD1-CD2 3.4Å; F63-Y109 HydrophobicContact CD1-CD2 3.4Å; F63-Y109 HydrophobicContact CD1-CE2 4.26Å; F63-Y109 AromaticContact CD1-CG 3.9Å; F63-Y109 HydrophobicContact CD1-CG 3.9Å; F63-Y109 HydrophobicContact CE1-CD1 4.44Å; F63-Y109 AromaticContact CE1-CD2 3.03Å; F63-Y109 HydrophobicContact CE1-CD2 3.03Å; F63-Y109 AromaticContact CE1-CE2 3.56Å; F63-Y109 HydrophobicContact CE1-CE2 3.56Å; F63-Y109 AromaticContact CE1-CG 3.53Å; F63-Y109 HydrophobicContact CE1-CG 3.53Å; F63-Y109 HydrophobicContact CE2-CD2 4.49Å; F63-Y109 HydrophobicContact CE2-CE2 4.49Å; F63-Y109 HydrophobicContact CG-CD2 4.27Å; F63-Y109 AromaticContact CZ-CD2 3.66Å; F63-Y109 HydrophobicContact CZ-CD2 3.66Å; F63-Y109 AromaticContact CZ-CE2 3.69Å; F63-Y109 HydrophobicContact CZ-CE2 3.69Å; F63-Y109 HydrophobicContact CZ-CG 4.46Å; F63-V166 HydrophobicContact CD1-CG1 3.89Å; F63-V166 HydrophobicContact CE1-CB 4.31Å; F63-V166 HydrophobicContact CE1-CG1 3.48Å; F63-V166 VanDerWaalsContact CE1-CG1 3.48Å; F63-V166 HydrophobicContact CE1-CG2 3.84Å; F63-V166 HydrophobicContact CZ-CB 4.46Å; F63-V166 HydrophobicContact CZ-CG1 3.91Å; F63-V166 HydrophobicContact CZ-CG2 3.89Å; F63-F169 HydrophobicContact CD2-CD1 4.45Å; F63-F169 HydrophobicContact CD2-CE1 4.41Å; F63-F169 HydrophobicContact CE2-CD1 4.45Å
64	E	88.5	Confident	87.1	Confident	98 Å²	98	72.5 Å²	72.5	46%	0.458	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	124.8	163.6	174.8	175.8	-171.6	0	0	107.2	N59 I107 L108	N59-E64 WeakPolarHBondContact OD1-CA 3.45Å; N59-E64 VanDerWaalsContact OD1-CB 3.25Å; N59-E64 WeakPolarHBondContact OD1-CB 3.37Å; N59-E64 VanDerWaalsContact OD1-CG 3.3Å; N59-E64 WeakPolarHBondContact OD1-CG 3.09Å; E64-I107 CarbonylContact O-C 3.59Å; E64-I107 WeakPolarHBondContact O-CA 3.31Å; E64-L108 HydrophobicContact CB-CB 4.2Å; E64-L108 PolarHBondContact N-O 3.1Å; E64-L108 VanDerWaalsContact N-O 3.07Å; E64-L108 PolarHBondContact O-N 2.86Å
65	Y	87.6	Confident	87.3	Confident	21 Å²	21	70.4 Å²	70.4	8%	0.082	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	144.8	179.9	72.5	-91.6	0	0	0	110.7	M56 K57 G58 I67 R106 F173 L174	M56-Y65 HydrophobicContact CB-CE2 4.4Å; K57-Y65 WeakPolarHBondContact CA-O 3.29Å; G58-Y65 VanDerWaalsContact C-CE1 3.48Å; G58-Y65 PolarHBondContact N-O 2.95Å; G58-Y65 VanDerWaalsContact N-O 3.1Å; G58-Y65 VanDerWaalsContact O-CD1 3.25Å; G58-Y65 WeakPolarHBondContact O-CD1 3.45Å; G58-Y65 WeakPolarHBondContact O-CE1 3.26Å; G58-Y65 PolarHBondContact O-N 3.41Å; Y65-I67 HydrophobicContact CD2-CD1 4.41Å; Y65-I67 HydrophobicContact CD2-CG1 4.45Å; Y65-R106 CarbonylContact C-O 3.49Å; Y65-R106 WeakPolarHBondContact CA-O 3.32Å; Y65-F173 HydrophobicContact CE1-CD1 4.39Å; Y65-F173 AromaticContact CE1-CE1 3.94Å; Y65-F173 HydrophobicContact CE1-CE1 3.94Å; Y65-F173 HydrophobicContact CE2-CE1 4.49Å; Y65-F173 AromaticContact CZ-CE1 3.62Å; Y65-F173 WeakPolarHBondContact OH-CE1 3.43Å; Y65-L174 HydrophobicContact CD2-CD2 3.94Å; Y65-L174 HydrophobicContact CE2-CD2 3.84Å
66	T	90.3	Very high	87.3	Confident	21 Å²	21	70 Å²	70	13%	0.129	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	130	169.4	-63	0	0	0	0	108	E55 M56 K57 R106	E55-T66 HydrophobicContact CG-CG2 4.27Å; E55-T66 WeakPolarHBondContact OE1-CG2 3.49Å; M56-T66 CarbonylContact O-C 3.55Å; M56-T66 WeakPolarHBondContact O-CA 3.46Å; K57-T66 HydrophobicContact CD-CG2 4.42Å; K57-T66 HydrophobicContact CG-CG2 3.97Å; T66-R106 PolarHBondContact N-O 2.89Å; T66-R106 PolarHBondContact O-N 2.81Å
67	I	88.3	Confident	87.4	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.01	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	124	174.1	-66.1	169.5	0	0	0	108.5	E55 M56 Y65 V70 F103 Q104 L174	E55-I67 WeakPolarHBondContact CA-O 3.25Å; E55-I67 VanDerWaalsContact CG-O 3.32Å; E55-I67 WeakPolarHBondContact CG-O 3.44Å; M56-I67 HydrophobicContact CB-CB 4.36Å; M56-I67 HydrophobicContact CE-CB 3.66Å; M56-I67 HydrophobicContact CE-CD1 3.64Å; M56-I67 HydrophobicContact CE-CG1 4.27Å; M56-I67 HydrophobicContact CE-CG2 3.42Å; M56-I67 VanDerWaalsContact CE-CG2 3.42Å; M56-I67 PolarHBondContact N-O 3.24Å; M56-I67 PolarHBondContact O-N 3.44Å; Y65-I67 HydrophobicContact CD2-CD1 4.41Å; Y65-I67 HydrophobicContact CD2-CG1 4.45Å; I67-V70 HydrophobicContact CG2-CG2 4.3Å; I67-F103 HydrophobicContact CB-CD2 4.48Å; I67-F103 HydrophobicContact CD1-CD2 4.37Å; I67-F103 HydrophobicContact CD1-CE2 4.07Å; I67-F103 HydrophobicContact CG1-CD2 4.36Å; I67-F103 HydrophobicContact CG2-CB 3.95Å; I67-F103 HydrophobicContact CG2-CD2 3.38Å; I67-F103 HydrophobicContact CG2-CE2 4.07Å; I67-F103 HydrophobicContact CG2-CG 3.89Å; I67-Q104 WeakPolarHBondContact CA-O 3.49Å; I67-L174 HydrophobicContact CD1-CD1 3.7Å; I67-L174 HydrophobicContact CD1-CD2 3.28Å; I67-L174 HydrophobicContact CD1-CG 4Å
68	N	89.4	Confident	87	Confident	51 Å²	51	66.9 Å²	66.9	27%	0.273	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	173.1	-178	61.4	-21.2	0	0	0	110.6	E55 V70 Q104	E55-N68 HydrophobicContact CG-CB 4.1Å; N68-V70 VanDerWaalsContact C-N 3.34Å; N68-V70 PolarHBondContact O-N 2.86Å; N68-Q104 PolarHBondContact N-O 3.19Å; N68-Q104 VanDerWaalsContact N-O 3.15Å; N68-Q104 PolarHBondContact O-N 3.5Å; N68-Q104 VanDerWaalsContact OD1-CB 3.23Å; N68-Q104 WeakPolarHBondContact OD1-CB 3.47Å; N68-Q104 PolarHBondContact OD1-O 2.72Å
69	E	88	Confident	87.1	Confident	117 Å²	117	72.7 Å²	72.7	55%	0.547	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	54	45.5	175.9	-59.3	-178.8	-150.1	0	0	113.7	K71 Q104	E69-K71 PolarHBondContact O-N 2.89Å; E69-Q104 HydrophobicContact CB-CG 4.23Å
70	V	89.7	Confident	87.5	Confident	21 Å²	21	67.5 Å²	67.5	13%	0.127	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	121.6	173.5	-170.6	0	0	0	0	109.2	M53 I67 N68 S102 F103 M178	M53-V70 HydrophobicContact CB-CB 3.76Å; M53-V70 HydrophobicContact CB-CG1 4.26Å; M53-V70 HydrophobicContact CB-CG2 3.92Å; M53-V70 HydrophobicContact CG-CB 3.94Å; M53-V70 HydrophobicContact CG-CG1 3.89Å; M53-V70 HydrophobicContact CG-CG2 4.42Å; I67-V70 HydrophobicContact CG2-CG2 4.3Å; N68-V70 VanDerWaalsContact C-N 3.34Å; N68-V70 PolarHBondContact O-N 2.86Å; V70-S102 WeakPolarHBondContact CA-O 3.44Å; V70-F103 HydrophobicContact CB-CB 4.26Å; V70-F103 HydrophobicContact CG1-CB 4.49Å; V70-F103 HydrophobicContact CG1-CD1 4.37Å; V70-F103 HydrophobicContact CG2-CB 3.89Å; V70-F103 HydrophobicContact CG2-CG 4.46Å; V70-M178 HydrophobicContact CG1-CE 3.77Å; V70-M178 HydrophobicContact CG2-CE 4.2Å
71	K	90.3	Very high	88.2	Confident	121 Å²	121	68 Å²	68	53%	0.526	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	134.6	178.1	-66.1	-179.4	-176.1	177.1	0	109.9	E69 L101 S102	E69-K71 PolarHBondContact O-N 2.89Å; K71-L101 CarbonylContact O-C 3.54Å; K71-L101 VanDerWaalsContact O-CA 3.27Å; K71-L101 WeakPolarHBondContact O-CA 3.33Å; K71-S102 PolarHBondContact N-O 2.83Å; K71-S102 PolarHBondContact O-N 2.79Å
72	I	91.6	Very high	88.9	Confident	21 Å²	21	65.4 Å²	65.4	11%	0.108	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	117.2	167.7	-49.6	-144	0	0	0	107.3	L48 I51 L75 I99 L101 L182	L48-I72 VanDerWaalsContact O-CD1 3.28Å; L48-I72 WeakPolarHBondContact O-CD1 3.49Å; I51-I72 HydrophobicContact CB-CD1 4.44Å; I72-L75 HydrophobicContact CG2-CD1 3.94Å; I72-I99 HydrophobicContact CD1-CG2 4.25Å; I72-I99 HydrophobicContact CG2-CG2 3.81Å; I72-L101 HydrophobicContact CB-CD2 3.88Å; I72-L101 HydrophobicContact CD1-CD2 3.74Å; I72-L101 HydrophobicContact CG1-CD2 3.46Å; I72-L101 VanDerWaalsContact CG1-CD2 3.46Å; I72-L101 HydrophobicContact CG2-CD2 4.06Å; I72-L182 HydrophobicContact CD1-CD1 4.3Å
73	N	89.6	Confident	89.5	Confident	87 Å²	87	57.4 Å²	57.4	47%	0.465	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	-42.7	-175.8	-62.6	-19.6	0	0	0	110.9	A100 S102	N73-A100 PolarHBondContact N-O 2.85Å; N73-S102 VanDerWaalsContact ND2-CB 3.3Å; N73-S102 WeakPolarHBondContact ND2-CB 3.38Å; N73-S102 PolarHBondContact ND2-OG 2.97Å; N73-S102 PolarHBondContact OD1-OG 3.07Å
74	E	90.8	Very high	90.1	Very high	143 Å²	143	56.6 Å²	56.6	67%	0.668	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.4	142	-177.6	-60.2	178.4	175.9	0	0	110.5	A100	E74-A100 HydrophobicContact CB-CB 4.06Å; E74-A100 PolarHBondContact N-O 2.87Å; E74-A100 PolarHBondContact O-N 2.78Å
75	L	90.6	Very high	90.4	Very high	21 Å²	21	55 Å²	55	11%	0.11	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	106.7	177.7	-144.5	124.1	0	0	0	108.5	V45 L48 I72 L77 I99	V45-L75 HydrophobicContact CG1-CB 4.26Å; V45-L75 HydrophobicContact CG2-CD2 4.19Å; L48-L75 HydrophobicContact CB-CD1 3.72Å; L48-L75 HydrophobicContact CB-CD2 4.38Å; L48-L75 HydrophobicContact CD1-CD1 4.34Å; L48-L75 HydrophobicContact CD1-CD2 3.87Å; I72-L75 HydrophobicContact CG2-CD1 3.94Å; L75-L77 HydrophobicContact CD2-CD1 4.15Å; L75-L77 HydrophobicContact CD2-CD2 3.46Å; L75-L77 VanDerWaalsContact CD2-CD2 3.46Å; L75-L77 HydrophobicContact CD2-CG 3.72Å; L75-I99 HydrophobicContact CD1-CD1 4.22Å; L75-I99 HydrophobicContact CD1-CG1 3.86Å; L75-I99 HydrophobicContact CD1-CG2 4.07Å; L75-I99 HydrophobicContact CG-CG1 3.97Å
76	N	89.5	Confident	90.8	Very high	90 Å²	90	57.4 Å²	57.4	48%	0.481	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	97	-178.5	-172	-16.8	0	0	0	109.6	T78 S97 S98	N76-T78 PolarHBondContact O-N 2.97Å; N76-T78 PolarHBondContact OD1-OG1 2.85Å; N76-S97 VanDerWaalsContact O-CB 3.24Å; N76-S97 WeakPolarHBondContact O-CB 3.43Å; N76-S98 PolarHBondContact N-O 2.84Å; N76-S98 PolarHBondContact O-N 2.94Å; N76-S98 VanDerWaalsContact O-N 3.16Å
77	L	87.3	Confident	90.7	Very high	8 Å²	8	59.8 Å²	59.8	4%	0.042	32%	0.323	C	S	.	.			trans	-85.9	76.8	174.9	-59	-175.8	0	0	0	109.8	Q41 V44 V45 L75 A80 V94 S97	Q41-L77 HydrophobicContact CG-CB 4.29Å; Q41-L77 HydrophobicContact CG-CD1 3.93Å; Q41-L77 PolarHBondContact NE2-O 2.93Å; V44-L77 HydrophobicContact CG1-CD1 4.32Å; V45-L77 HydrophobicContact CG2-CD1 3.62Å; V45-L77 HydrophobicContact CG2-CG 4.01Å; L75-L77 HydrophobicContact CD2-CD1 4.15Å; L75-L77 HydrophobicContact CD2-CD2 3.46Å; L75-L77 VanDerWaalsContact CD2-CD2 3.46Å; L75-L77 HydrophobicContact CD2-CG 3.72Å; L77-A80 HydrophobicContact CB-CB 4.32Å; L77-V94 HydrophobicContact CD1-CG2 4.47Å; L77-V94 HydrophobicContact CD2-CG1 3.65Å; L77-V94 HydrophobicContact CD2-CG2 4.1Å; L77-S97 WeakPolarHBondContact CA-OG 3.49Å
78	T	78.9	Confident	90.6	Very high	75 Å²	75	63.7 Å²	63.7	46%	0.46	34%	0.343	S	S	.	.	S	Bend	trans	-68.7	-37.3	-172.2	-44.6	0	0	0	0	112.4	N76 S97	N76-T78 PolarHBondContact O-N 2.97Å; N76-T78 PolarHBondContact OD1-OG1 2.85Å; T78-S97 PolarHBondContact N-OG 2.99Å
79	Y	88.9	Confident	90.8	Very high	142 Å²	142	61.3 Å²	61.3	56%	0.557	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.2	80.5	177.3	-56	-79.7	0	0	0	109.3	V94 Q95 N96	Y79-V94 CarbonylContact O-C 3.58Å; Y79-V94 WeakPolarHBondContact O-CA 3.3Å; Y79-Q95 PolarHBondContact O-N 3.25Å; Y79-N96 HydrophobicContact CD2-CB 4.48Å
80	A	92.5	Very high	91.1	Very high	10 Å²	10	57.1 Å²	57.1	8%	0.083	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	143.2	169.4	0	0	0	0	0	109.8	K37 Q41 L77 F92 E93 V94	K37-A80 WeakPolarHBondContact CE-O 3.42Å; K37-A80 PolarHBondContact NZ-O 3.01Å; Q41-A80 HydrophobicContact CG-CB 4.24Å; L77-A80 HydrophobicContact CB-CB 4.32Å; A80-F92 HydrophobicContact CB-CE2 4.41Å; A80-F92 HydrophobicContact CB-CZ 4.5Å; A80-E93 CarbonylContact C-O 3.57Å; A80-E93 VanDerWaalsContact CA-O 3.31Å; A80-E93 WeakPolarHBondContact CA-O 3.25Å; A80-V94 HydrophobicContact CB-CG2 4.26Å
81	D	93.9	Very high	91.4	Very high	77 Å²	77	57 Å²	57	41%	0.412	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	156.1	172.7	-152.8	21.7	0	0	0	112.9	K37 F92 E93	K37-D81 IonicContact NZ-OD1 2.79Å; K37-D81 PolarHBondContact NZ-OD1 2.73Å; D81-F92 WeakPolarHBondContact O-CA 3.5Å; D81-F92 WeakPolarHBondContact O-CD2 3.15Å; D81-E93 PolarHBondContact N-O 3.43Å; D81-E93 PolarHBondContact O-N 3Å
82	L	95.1	Very high	91.7	Very high	17 Å²	17	51.4 Å²	51.4	9%	0.089	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	116	176.1	-173	72.5	0	0	0	108.7	L33 L36 K37 L91 F92	L33-L82 HydrophobicContact CB-CD2 4.46Å; L33-L82 HydrophobicContact CD2-CG 4.21Å; L33-L82 HydrophobicContact CG-CD2 4.25Å; L33-L82 HydrophobicContact CG-CG 4.43Å; L36-L82 HydrophobicContact CB-CD2 3.83Å; K37-L82 HydrophobicContact CB-CB 4.16Å; K37-L82 HydrophobicContact CG-CB 4.43Å; L82-L91 CarbonylContact C-O 3.54Å; L82-L91 WeakPolarHBondContact CA-O 3.08Å; L82-F92 HydrophobicContact CD1-CB 4.11Å; L82-F92 HydrophobicContact CD1-CD2 4.31Å
83	A	95.8	Very high	91.9	Very high	34 Å²	34	53.4 Å²	53.4	28%	0.281	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	162.2	-173.3	0	0	0	0	0	112	L91	A83-L91 PolarHBondContact N-O 2.82Å; A83-L91 PolarHBondContact O-N 2.79Å
84	F	96.3	Very high	92.2	Very high	12 Å²	12	49.3 Å²	49.3	5%	0.053	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	132.8	167.4	-64.2	-61.5	0	0	0	110.8	I28 N30 L33 P86 L90 V227 T228 R230 S231 L232	I28-F84 WeakPolarHBondContact O-CZ 3.49Å; N30-F84 WeakPolarHBondContact OD1-CD2 2.71Å; N30-F84 WeakPolarHBondContact OD1-CE2 3.27Å; L33-F84 HydrophobicContact CD1-CD1 4.28Å; L33-F84 HydrophobicContact CD1-CD2 4.35Å; L33-F84 HydrophobicContact CD1-CE1 3.4Å; L33-F84 HydrophobicContact CD1-CE2 3.51Å; L33-F84 HydrophobicContact CD1-CZ 2.98Å; L33-F84 HydrophobicContact CD2-CD1 3.95Å; L33-F84 HydrophobicContact CD2-CD2 4.15Å; L33-F84 HydrophobicContact CD2-CE1 3.88Å; L33-F84 HydrophobicContact CD2-CE2 4.11Å; L33-F84 HydrophobicContact CD2-CG 4.09Å; L33-F84 HydrophobicContact CD2-CZ 4.02Å; L33-F84 HydrophobicContact CG-CE1 4.25Å; L33-F84 HydrophobicContact CG-CE2 4.43Å; L33-F84 HydrophobicContact CG-CZ 4.13Å; F84-P86 WeakPolarHBondContact O-CD 3.31Å; F84-L90 HydrophobicContact CD1-CD2 3.55Å; F84-L90 HydrophobicContact CE1-CD2 3.67Å; F84-V227 HydrophobicContact CB-CG1 3.78Å; F84-V227 HydrophobicContact CD1-CG1 3.96Å; F84-V227 HydrophobicContact CG-CG1 4.21Å; F84-T228 WeakPolarHBondContact CB-O 3.45Å; F84-R230 VanDerWaalsContact CD2-C 3.46Å; F84-R230 WeakPolarHBondContact CE2-O 3.47Å; F84-S231 VanDerWaalsContact CE2-N 3.31Å; F84-S231 VanDerWaalsContact CZ-C 3.49Å; F84-L232 HydrophobicContact CD1-CB 4.22Å; F84-L232 HydrophobicContact CE1-CB 3.4Å; F84-L232 VanDerWaalsContact CE1-CB 3.4Å; F84-L232 HydrophobicContact CZ-CB 3.92Å; F84-L232 VanDerWaalsContact CZ-N 3.31Å
85	Q	95.1	Very high	92.4	Very high	65 Å²	65	47 Å²	47	30%	0.304	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	104.1	170.3	-173.5	69.4	-4.7	0	0	109	G87 L88 G89 L91 V130 V227	Q85-G87 PolarHBondContact O-N 3.4Å; Q85-L88 HydrophobicContact CB-CB 4.25Å; Q85-L88 HydrophobicContact CG-CB 3.76Å; Q85-L88 HydrophobicContact CG-CD1 3.63Å; Q85-L88 HydrophobicContact CG-CG 4.12Å; Q85-L88 PolarHBondContact O-N 2.95Å; Q85-G89 PolarHBondContact N-O 2.86Å; Q85-G89 PolarHBondContact O-N 3.1Å; Q85-L91 HydrophobicContact CB-CB 4.25Å; Q85-V130 HydrophobicContact CB-CG1 4.46Å; Q85-V227 WeakPolarHBondContact O-CG1 3.03Å
86	P	94.3	Very high	92.5	Very high	71 Å²	71	51 Å²	51	46%	0.461	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	130.1	-173.8	-26.6	34.1	0	0	0	112.9	F84 L88	F84-P86 WeakPolarHBondContact O-CD 3.31Å; P86-L88 PolarHBondContact O-N 2.95Å; P86-L88 VanDerWaalsContact O-N 3.15Å
87	G	88.3	Confident	92.7	Very high	71 Å²	71	46.9 Å²	46.9	73%	0.732	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	-1.3	-180	0	0	0	0	0	116	Q85 V227	Q85-G87 PolarHBondContact O-N 3.4Å; G87-V227 PolarHBondContact N-O 2.98Å; G87-V227 VanDerWaalsContact N-O 3.09Å
88	L	86.9	Confident	93	Very high	83 Å²	83	48.5 Å²	48.5	44%	0.435	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-53.7	179.7	-63	176	0	0	0	112.8	Q85 P86 V130 H132	Q85-L88 HydrophobicContact CB-CB 4.25Å; Q85-L88 HydrophobicContact CG-CB 3.76Å; Q85-L88 HydrophobicContact CG-CD1 3.63Å; Q85-L88 HydrophobicContact CG-CG 4.12Å; Q85-L88 PolarHBondContact O-N 2.95Å; P86-L88 PolarHBondContact O-N 2.95Å; P86-L88 VanDerWaalsContact O-N 3.15Å; L88-V130 HydrophobicContact CB-CG1 4.24Å; L88-H132 PolarHBondContact O-ND1 2.8Å; L88-H132 VanDerWaalsContact O-ND1 3.08Å
89	G	92.9	Very high	93.8	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.7	-150.6	-169	0	0	0	0	0	116.2	Q85 L131 V227	Q85-G89 PolarHBondContact N-O 2.86Å; Q85-G89 PolarHBondContact O-N 3.1Å; G89-L131 WeakPolarHBondContact CA-O 3.33Å; G89-V227 WeakPolarHBondContact O-CG1 3.39Å
90	L	95.7	Very high	94	Very high	30 Å²	30	39.7 Å²	39.7	16%	0.157	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129	173.5	-63.6	172.9	0	0	0	109.9	L33 F84 V130 L131 M133	L33-L90 HydrophobicContact CD2-CD2 3.98Å; F84-L90 HydrophobicContact CD1-CD2 3.55Å; F84-L90 HydrophobicContact CE1-CD2 3.67Å; L90-V130 CarbonylContact O-C 3.53Å; L90-V130 VanDerWaalsContact O-CA 3.31Å; L90-V130 WeakPolarHBondContact O-CA 3.46Å; L90-L131 HydrophobicContact CB-CB 4.47Å; L90-L131 PolarHBondContact N-O 3.16Å; L90-L131 PolarHBondContact O-N 3.32Å; L90-M133 HydrophobicContact CD1-CE 4.27Å; L90-M133 HydrophobicContact CD1-SD 4.07Å; L90-M133 HydrophobicContact CD2-CE 4.41Å; L90-M133 HydrophobicContact CG-CE 3.75Å; L90-M133 HydrophobicContact CG-SD 4.22Å
91	L	96	Very high	94.1	Very high	18 Å²	18	39.3 Å²	39.3	9%	0.094	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	119.4	174.8	170.4	61	0	0	0	109.3	L82 A83 Q85 E93 H128 V130	L82-L91 CarbonylContact C-O 3.54Å; L82-L91 WeakPolarHBondContact CA-O 3.08Å; A83-L91 PolarHBondContact N-O 2.82Å; A83-L91 PolarHBondContact O-N 2.79Å; Q85-L91 HydrophobicContact CB-CB 4.25Å; L91-E93 HydrophobicContact CD1-CB 4.46Å; L91-E93 HydrophobicContact CG-CB 4.43Å; L91-H128 VanDerWaalsContact CD1-CD2 3.49Å; L91-H128 WeakPolarHBondContact CD1-CD2 3.36Å; L91-H128 VanDerWaalsContact CD1-NE2 3.29Å; L91-H128 WeakPolarHBondContact CD1-NE2 3.38Å; L91-V130 HydrophobicContact CD1-CG2 3.88Å
92	F	96.3	Very high	94	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.018	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.2	164.5	179	-104.5	0	0	0	108.9	T40 V44 A80 D81 L82 V94 T129 M190	T40-F92 HydrophobicContact CG2-CD2 3.81Å; T40-F92 HydrophobicContact CG2-CE2 3.97Å; V44-F92 HydrophobicContact CB-CE1 4.29Å; V44-F92 HydrophobicContact CB-CZ 4.16Å; V44-F92 HydrophobicContact CG1-CE1 3.92Å; V44-F92 HydrophobicContact CG1-CZ 4.13Å; V44-F92 HydrophobicContact CG2-CD1 4.46Å; V44-F92 HydrophobicContact CG2-CE1 3.89Å; V44-F92 HydrophobicContact CG2-CZ 3.93Å; A80-F92 HydrophobicContact CB-CE2 4.41Å; A80-F92 HydrophobicContact CB-CZ 4.5Å; D81-F92 WeakPolarHBondContact O-CA 3.5Å; D81-F92 WeakPolarHBondContact O-CD2 3.15Å; L82-F92 HydrophobicContact CD1-CB 4.11Å; L82-F92 HydrophobicContact CD1-CD2 4.31Å; F92-V94 HydrophobicContact CD1-CG2 4.4Å; F92-V94 HydrophobicContact CE1-CG2 3.5Å; F92-V94 HydrophobicContact CZ-CG2 3.62Å; F92-T129 PolarHBondContact N-O 2.97Å; F92-T129 PolarHBondContact O-N 3.41Å; F92-M190 HydrophobicContact CD1-CE 3.87Å; F92-M190 HydrophobicContact CE1-CE 4.13Å
93	E	95.4	Very high	93.8	Very high	63 Å²	63	36 Å²	36	29%	0.294	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.2	-177.3	-169.8	178.5	-165.5	0	0	110.7	A80 D81 L91 Q95 I127	A80-E93 CarbonylContact C-O 3.57Å; A80-E93 VanDerWaalsContact CA-O 3.31Å; A80-E93 WeakPolarHBondContact CA-O 3.25Å; D81-E93 PolarHBondContact N-O 3.43Å; D81-E93 PolarHBondContact O-N 3Å; L91-E93 HydrophobicContact CD1-CB 4.46Å; L91-E93 HydrophobicContact CG-CB 4.43Å; E93-Q95 VanDerWaalsContact CD-NE2 3.31Å; E93-Q95 HydrophobicContact CG-CG 4.14Å; E93-Q95 PolarHBondContact OE1-NE2 3.1Å; E93-I127 CarbonylContact C-O 3.48Å; E93-I127 WeakPolarHBondContact CA-O 3.05Å
94	V	95.3	Very high	93.6	Very high	1 Å²	1	38 Å²	38	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.2	172.6	173.7	0	0	0	0	107.6	L77 Y79 A80 F92 S97 N126 I127	L77-V94 HydrophobicContact CD1-CG2 4.47Å; L77-V94 HydrophobicContact CD2-CG1 3.65Å; L77-V94 HydrophobicContact CD2-CG2 4.1Å; Y79-V94 CarbonylContact O-C 3.58Å; Y79-V94 WeakPolarHBondContact O-CA 3.3Å; A80-V94 HydrophobicContact CB-CG2 4.26Å; F92-V94 HydrophobicContact CD1-CG2 4.4Å; F92-V94 HydrophobicContact CE1-CG2 3.5Å; F92-V94 HydrophobicContact CZ-CG2 3.62Å; V94-S97 WeakPolarHBondContact CG1-OG 3.49Å; V94-N126 CarbonylContact O-C 3.58Å; V94-N126 WeakPolarHBondContact O-CA 3.37Å; V94-I127 HydrophobicContact CB-CB 4.03Å; V94-I127 HydrophobicContact CB-CG1 4.38Å; V94-I127 HydrophobicContact CG2-CB 4.4Å; V94-I127 PolarHBondContact N-O 3.48Å; V94-I127 PolarHBondContact O-N 2.89Å
95	Q	94.7	Very high	93.3	Very high	94 Å²	94	37.8 Å²	37.8	44%	0.439	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	145.3	177.4	-62.9	-175.7	-5.3	0	0	111.8	Y79 E93 S97 N126	Y79-Q95 PolarHBondContact O-N 3.25Å; E93-Q95 VanDerWaalsContact CD-NE2 3.31Å; E93-Q95 HydrophobicContact CG-CG 4.14Å; E93-Q95 PolarHBondContact OE1-NE2 3.1Å; Q95-S97 PolarHBondContact O-N 2.87Å; Q95-S97 PolarHBondContact O-OG 2.79Å; Q95-S97 VanDerWaalsContact O-OG 3.1Å; Q95-N126 WeakPolarHBondContact CA-OD1 3.37Å
96	N	93.6	Very high	93.1	Very high	106 Å²	106	40.6 Å²	40.6	57%	0.567	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	44.2	41.4	170.1	-165.8	33.6	0	0	0	114.4	Y79 V125 N126	Y79-N96 HydrophobicContact CD2-CB 4.48Å; N96-V125 PolarHBondContact N-O 2.98Å; N96-N126 PolarHBondContact N-OD1 2.83Å
97	S	94.1	Very high	92.8	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.021	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	174.4	-177.1	-69.7	0	0	0	0	111.4	N76 L77 T78 V94 Q95 G124 V125	N76-S97 VanDerWaalsContact O-CB 3.24Å; N76-S97 WeakPolarHBondContact O-CB 3.43Å; L77-S97 WeakPolarHBondContact CA-OG 3.49Å; T78-S97 PolarHBondContact N-OG 2.99Å; V94-S97 WeakPolarHBondContact CG1-OG 3.49Å; Q95-S97 PolarHBondContact O-N 2.87Å; Q95-S97 PolarHBondContact O-OG 2.79Å; Q95-S97 VanDerWaalsContact O-OG 3.1Å; S97-G124 PolarHBondContact O-N 3.23Å; S97-G124 VanDerWaalsContact O-N 3.12Å; S97-V125 PolarHBondContact N-O 2.81Å; S97-V125 PolarHBondContact O-N 2.78Å
98	S	94.1	Very high	92.7	Very high	41 Å²	41	36 Å²	36	29%	0.287	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	142.7	179.8	65.6	0	0	0	0	113.1	N76 A122	N76-S98 PolarHBondContact N-O 2.84Å; N76-S98 PolarHBondContact O-N 2.94Å; N76-S98 VanDerWaalsContact O-N 3.16Å; S98-A122 CarbonylContact C-O 3.56Å; S98-A122 WeakPolarHBondContact CA-O 3.4Å; S98-A122 WeakPolarHBondContact CB-O 3.21Å
99	I	94.3	Very high	92.5	Very high	4 Å²	4	36.5 Å²	36.5	2%	0.021	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.8	176	-56.2	167.7	0	0	0	108.4	I72 L75 L101 S121 A122 V125 L182	I72-I99 HydrophobicContact CD1-CG2 4.25Å; I72-I99 HydrophobicContact CG2-CG2 3.81Å; L75-I99 HydrophobicContact CD1-CD1 4.22Å; L75-I99 HydrophobicContact CD1-CG1 3.86Å; L75-I99 HydrophobicContact CD1-CG2 4.07Å; L75-I99 HydrophobicContact CG-CG1 3.97Å; I99-L101 HydrophobicContact CG2-CD2 3.5Å; I99-L101 HydrophobicContact CG2-CG 3.93Å; I99-S121 CarbonylContact O-C 3.44Å; I99-S121 WeakPolarHBondContact O-CA 3.34Å; I99-A122 HydrophobicContact CB-CB 4.22Å; I99-A122 PolarHBondContact N-O 2.85Å; I99-A122 PolarHBondContact O-N 2.85Å; I99-V125 HydrophobicContact CD1-CG1 4.06Å; I99-V125 HydrophobicContact CD1-CG2 4Å; I99-V125 HydrophobicContact CG1-CG2 4.03Å; I99-L182 HydrophobicContact CD1-CD2 3.98Å
100	A	94.1	Very high	91.9	Very high	28 Å²	28	45.7 Å²	45.7	23%	0.231	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	129.4	171.4	0	0	0	0	0	109.9	N73 E74	N73-A100 PolarHBondContact N-O 2.85Å; E74-A100 HydrophobicContact CB-CB 4.06Å; E74-A100 PolarHBondContact N-O 2.87Å; E74-A100 PolarHBondContact O-N 2.78Å
101	L	93.1	Very high	91.3	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	152.8	-175.6	-52.6	168.8	0	0	0	109.8	K71 I72 I99 A120 M155 M178 L182	K71-L101 CarbonylContact O-C 3.54Å; K71-L101 VanDerWaalsContact O-CA 3.27Å; K71-L101 WeakPolarHBondContact O-CA 3.33Å; I72-L101 HydrophobicContact CB-CD2 3.88Å; I72-L101 HydrophobicContact CD1-CD2 3.74Å; I72-L101 HydrophobicContact CG1-CD2 3.46Å; I72-L101 VanDerWaalsContact CG1-CD2 3.46Å; I72-L101 HydrophobicContact CG2-CD2 4.06Å; I99-L101 HydrophobicContact CG2-CD2 3.5Å; I99-L101 HydrophobicContact CG2-CG 3.93Å; L101-A120 HydrophobicContact CB-CB 4.4Å; L101-A120 PolarHBondContact N-O 3.07Å; L101-A120 PolarHBondContact O-N 3.13Å; L101-A120 VanDerWaalsContact O-O 3.13Å; L101-M155 HydrophobicContact CD1-CE 3.79Å; L101-M178 HydrophobicContact CD1-CE 4.5Å; L101-L182 HydrophobicContact CD1-CD2 3.89Å
102	S	91.9	Very high	90.7	Very high	25 Å²	25	58.4 Å²	58.4	18%	0.175	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	148	165	61.6	0	0	0	0	110.9	V70 K71 N73 I118	V70-S102 WeakPolarHBondContact CA-O 3.44Å; K71-S102 PolarHBondContact N-O 2.83Å; K71-S102 PolarHBondContact O-N 2.79Å; N73-S102 VanDerWaalsContact ND2-CB 3.3Å; N73-S102 WeakPolarHBondContact ND2-CB 3.38Å; N73-S102 PolarHBondContact ND2-OG 2.97Å; N73-S102 PolarHBondContact OD1-OG 3.07Å; S102-I118 WeakPolarHBondContact CA-O 3.16Å
103	F	91.2	Very high	90.2	Very high	1 Å²	1	64.5 Å²	64.5	0%	0.004	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	158.2	176.7	43.6	-86.9	0	0	0	111.1	I67 V70 A117 I118 A120 M157	I67-F103 HydrophobicContact CB-CD2 4.48Å; I67-F103 HydrophobicContact CD1-CD2 4.37Å; I67-F103 HydrophobicContact CD1-CE2 4.07Å; I67-F103 HydrophobicContact CG1-CD2 4.36Å; I67-F103 HydrophobicContact CG2-CB 3.95Å; I67-F103 HydrophobicContact CG2-CD2 3.38Å; I67-F103 HydrophobicContact CG2-CE2 4.07Å; I67-F103 HydrophobicContact CG2-CG 3.89Å; V70-F103 HydrophobicContact CB-CB 4.26Å; V70-F103 HydrophobicContact CG1-CB 4.49Å; V70-F103 HydrophobicContact CG1-CD1 4.37Å; V70-F103 HydrophobicContact CG2-CB 3.89Å; V70-F103 HydrophobicContact CG2-CG 4.46Å; F103-A117 WeakPolarHBondContact O-CA 3.05Å; F103-I118 HydrophobicContact CD2-CB 3.81Å; F103-I118 HydrophobicContact CD2-CD1 3.83Å; F103-I118 HydrophobicContact CD2-CG1 4.3Å; F103-I118 HydrophobicContact CD2-CG2 4.42Å; F103-I118 HydrophobicContact CE1-CB 4.45Å; F103-I118 HydrophobicContact CE1-CG2 4.2Å; F103-I118 HydrophobicContact CE2-CB 3.49Å; F103-I118 VanDerWaalsContact CE2-CB 3.49Å; F103-I118 HydrophobicContact CE2-CD1 3.29Å; F103-I118 HydrophobicContact CE2-CG1 3.96Å; F103-I118 HydrophobicContact CE2-CG2 3.64Å; F103-I118 HydrophobicContact CG-CB 4.46Å; F103-I118 HydrophobicContact CZ-CB 3.78Å; F103-I118 HydrophobicContact CZ-CD1 4.18Å; F103-I118 HydrophobicContact CZ-CG2 3.45Å; F103-I118 VanDerWaalsContact CZ-CG2 3.45Å; F103-I118 PolarHBondContact N-O 2.76Å; F103-I118 PolarHBondContact O-N 3.23Å; F103-A120 HydrophobicContact CE1-CB 3.6Å; F103-A120 HydrophobicContact CZ-CB 4.16Å; F103-M157 HydrophobicContact CE1-CE 4.22Å; F103-M157 HydrophobicContact CE2-CE 4.43Å; F103-M157 HydrophobicContact CZ-CE 3.55Å; F103-M157 HydrophobicContact CZ-CG 4.2Å; F103-M157 HydrophobicContact CZ-SD 3.85Å
104	Q	91.4	Very high	89.8	Confident	76 Å²	76	63 Å²	63	36%	0.355	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	138.2	175.6	-65.6	-60.1	-32.8	0	0	109.6	I67 N68 E69 G116	I67-Q104 WeakPolarHBondContact CA-O 3.49Å; N68-Q104 PolarHBondContact N-O 3.19Å; N68-Q104 VanDerWaalsContact N-O 3.15Å; N68-Q104 PolarHBondContact O-N 3.5Å; N68-Q104 VanDerWaalsContact OD1-CB 3.23Å; N68-Q104 WeakPolarHBondContact OD1-CB 3.47Å; N68-Q104 PolarHBondContact OD1-O 2.72Å; E69-Q104 HydrophobicContact CB-CG 4.23Å; Q104-G116 PolarHBondContact OE1-O 3.23Å
105	R	90.7	Very high	89.5	Confident	7 Å²	7	67.7 Å²	67.7	3%	0.026	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	144.8	173.8	57.6	170.9	-174.7	123.7	13.2	110.5	D114 T115 G116 I118 T160 Y167	R105-D114 IonicContact CZ-OD1 2.76Å; R105-D114 IonicContact CZ-OD2 2.73Å; R105-D114 IonicContact NE-OD2 3.32Å; R105-D114 IonicContact NH1-OD1 2.56Å; R105-D114 PolarHBondContact NH1-OD1 3.48Å; R105-D114 IonicContact NH1-OD2 2.92Å; R105-D114 PolarHBondContact NH1-OD2 2.87Å; R105-D114 VanDerWaalsContact NH2-CG 3.28Å; R105-D114 IonicContact NH2-OD1 2.84Å; R105-D114 PolarHBondContact NH2-OD1 3.05Å; R105-D114 IonicContact NH2-OD2 3.53Å; R105-D114 PolarHBondContact NH2-OD2 2.82Å; R105-T115 VanDerWaalsContact O-CA 3.26Å; R105-T115 WeakPolarHBondContact O-CA 3.2Å; R105-G116 WeakPolarHBondContact CG-O 3.37Å; R105-G116 PolarHBondContact N-O 2.99Å; R105-G116 PolarHBondContact O-N 2.9Å; R105-G116 VanDerWaalsContact O-N 3.14Å; R105-I118 HydrophobicContact CB-CD1 3.64Å; R105-I118 HydrophobicContact CB-CG1 4.1Å; R105-I118 HydrophobicContact CG-CD1 3.9Å; R105-I118 HydrophobicContact CG-CG1 3.83Å; R105-T160 PolarHBondContact NH2-O 2.71Å; R105-Y167 PolarHBondContact NH2-OH 2.84Å; R105-Y167 VanDerWaalsContact NH2-OH 3.1Å
106	R	90.4	Very high	89.2	Confident	123 Å²	123	64 Å²	64	46%	0.464	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	115.2	164	179.4	177.6	-176.8	-175.5	-0.9	108	Y65 T66 Y113 D114 T115	Y65-R106 CarbonylContact C-O 3.49Å; Y65-R106 WeakPolarHBondContact CA-O 3.32Å; T66-R106 PolarHBondContact N-O 2.89Å; T66-R106 PolarHBondContact O-N 2.81Å; R106-Y113 HydrophobicContact CG-CD1 4.13Å; R106-D114 CarbonylContact C-O 3.56Å; R106-D114 WeakPolarHBondContact CA-O 3.37Å; R106-T115 HydrophobicContact CB-CG2 4.14Å; R106-T115 HydrophobicContact CG-CG2 3.98Å
107	I	87.6	Confident	89	Confident	8 Å²	8	60.6 Å²	60.6	4%	0.041	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.5	179.8	-60.5	159.2	0	0	0	107.9	F63 E64 Y113 D114 L170	F63-I107 HydrophobicContact CB-CG2 4.34Å; F63-I107 HydrophobicContact CD1-CG2 4.16Å; E64-I107 CarbonylContact O-C 3.59Å; E64-I107 WeakPolarHBondContact O-CA 3.31Å; I107-Y113 WeakPolarHBondContact O-CA 3.29Å; I107-D114 PolarHBondContact N-O 2.84Å; I107-D114 PolarHBondContact O-N 2.88Å; I107-L170 HydrophobicContact CD1-CD1 3.42Å; I107-L170 VanDerWaalsContact CD1-CD1 3.42Å; I107-L170 HydrophobicContact CG1-CD1 3.99Å; I107-L170 HydrophobicContact CG2-CD1 4.13Å
108	L	86.8	Confident	88.8	Confident	37 Å²	37	60.5 Å²	60.5	19%	0.194	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	122.6	171	173.7	61.7	0	0	0	108.9	F63 E64 Y113	F63-L108 WeakPolarHBondContact CA-O 3.35Å; E64-L108 HydrophobicContact CB-CB 4.2Å; E64-L108 PolarHBondContact N-O 3.1Å; E64-L108 VanDerWaalsContact N-O 3.07Å; E64-L108 PolarHBondContact O-N 2.86Å; L108-Y113 HydrophobicContact CB-CD1 4.06Å; L108-Y113 HydrophobicContact CB-CE1 3.84Å; L108-Y113 HydrophobicContact CD1-CD1 4.11Å; L108-Y113 HydrophobicContact CD1-CD2 4.32Å; L108-Y113 HydrophobicContact CD1-CE1 3.81Å; L108-Y113 HydrophobicContact CD1-CE2 4.01Å; L108-Y113 HydrophobicContact CD1-CG 4.37Å; L108-Y113 HydrophobicContact CD2-CE1 4.18Å; L108-Y113 HydrophobicContact CG-CE1 4.15Å
109	Y	83.4	Confident	88.7	Confident	94 Å²	94	62.7 Å²	62.7	37%	0.369	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	114.8	171.5	179.8	-111.5	0	0	0	110.2	R62 F63 F111 F112	R62-Y109 HydrophobicContact CB-CD2 4.26Å; R62-Y109 HydrophobicContact CB-CE2 3.97Å; F63-Y109 AromaticContact CD1-CD2 3.4Å; F63-Y109 HydrophobicContact CD1-CD2 3.4Å; F63-Y109 HydrophobicContact CD1-CE2 4.26Å; F63-Y109 AromaticContact CD1-CG 3.9Å; F63-Y109 HydrophobicContact CD1-CG 3.9Å; F63-Y109 HydrophobicContact CE1-CD1 4.44Å; F63-Y109 AromaticContact CE1-CD2 3.03Å; F63-Y109 HydrophobicContact CE1-CD2 3.03Å; F63-Y109 AromaticContact CE1-CE2 3.56Å; F63-Y109 HydrophobicContact CE1-CE2 3.56Å; F63-Y109 AromaticContact CE1-CG 3.53Å; F63-Y109 HydrophobicContact CE1-CG 3.53Å; F63-Y109 HydrophobicContact CE2-CD2 4.49Å; F63-Y109 HydrophobicContact CE2-CE2 4.49Å; F63-Y109 HydrophobicContact CG-CD2 4.27Å; F63-Y109 AromaticContact CZ-CD2 3.66Å; F63-Y109 HydrophobicContact CZ-CD2 3.66Å; F63-Y109 AromaticContact CZ-CE2 3.69Å; F63-Y109 HydrophobicContact CZ-CE2 3.69Å; F63-Y109 HydrophobicContact CZ-CG 4.46Å; Y109-F111 VanDerWaalsContact C-N 3.3Å; Y109-F111 PolarHBondContact O-N 3.32Å; Y109-F112 PolarHBondContact N-O 2.92Å; Y109-F112 PolarHBondContact O-N 2.56Å
110	W	80.7	Confident	88.6	Confident	195 Å²	195	62.9 Å²	62.9	74%	0.739	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	-76.7	-178.6	-164	3.6	0	0	0	114.6
111	F	82.7	Confident	88.6	Confident	160 Å²	160	63.2 Å²	63.2	70%	0.702	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.1	3.6	175.9	-63.5	-65.8	0	0	0	113.5	Y109	Y109-F111 VanDerWaalsContact C-N 3.3Å; Y109-F111 PolarHBondContact O-N 3.32Å
112	F	83.1	Confident	88.7	Confident	154 Å²	154	63.1 Å²	63.1	68%	0.675	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.5	136.8	-178.2	-60.7	-81.4	0	0	0	110.7	Y109	Y109-F112 PolarHBondContact N-O 2.92Å; Y109-F112 PolarHBondContact O-N 2.56Å
113	Y	85.9	Confident	88.8	Confident	133 Å²	133	64.3 Å²	64.3	52%	0.522	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	126	167.1	-69.3	-83.8	0	0	0	109	R106 I107 L108	R106-Y113 HydrophobicContact CG-CD1 4.13Å; I107-Y113 WeakPolarHBondContact O-CA 3.29Å; L108-Y113 HydrophobicContact CB-CD1 4.06Å; L108-Y113 HydrophobicContact CB-CE1 3.84Å; L108-Y113 HydrophobicContact CD1-CD1 4.11Å; L108-Y113 HydrophobicContact CD1-CD2 4.32Å; L108-Y113 HydrophobicContact CD1-CE1 3.81Å; L108-Y113 HydrophobicContact CD1-CE2 4.01Å; L108-Y113 HydrophobicContact CD1-CG 4.37Å; L108-Y113 HydrophobicContact CD2-CE1 4.18Å; L108-Y113 HydrophobicContact CG-CE1 4.15Å
114	D	86.1	Confident	89	Confident	30 Å²	30	65 Å²	65	16%	0.16	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.9	162.9	167.8	126.3	0	0	0	107.4	R105 R106 I107 L163 Y167	R105-D114 IonicContact CZ-OD1 2.76Å; R105-D114 IonicContact CZ-OD2 2.73Å; R105-D114 IonicContact NE-OD2 3.32Å; R105-D114 IonicContact NH1-OD1 2.56Å; R105-D114 PolarHBondContact NH1-OD1 3.48Å; R105-D114 IonicContact NH1-OD2 2.92Å; R105-D114 PolarHBondContact NH1-OD2 2.87Å; R105-D114 VanDerWaalsContact NH2-CG 3.28Å; R105-D114 IonicContact NH2-OD1 2.84Å; R105-D114 PolarHBondContact NH2-OD1 3.05Å; R105-D114 IonicContact NH2-OD2 3.53Å; R105-D114 PolarHBondContact NH2-OD2 2.82Å; R106-D114 CarbonylContact C-O 3.56Å; R106-D114 WeakPolarHBondContact CA-O 3.37Å; I107-D114 PolarHBondContact N-O 2.84Å; I107-D114 PolarHBondContact O-N 2.88Å; D114-L163 HydrophobicContact CB-CD1 4.24Å; D114-Y167 PolarHBondContact OD1-OH 2.99Å
115	T	89.1	Confident	89.2	Confident	100 Å²	100	61.5 Å²	61.5	61%	0.613	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.5	146.2	174.4	54.4	0	0	0	0	110.1	R105 R106	R105-T115 VanDerWaalsContact O-CA 3.26Å; R105-T115 WeakPolarHBondContact O-CA 3.2Å; R106-T115 HydrophobicContact CB-CG2 4.14Å; R106-T115 HydrophobicContact CG-CG2 3.98Å
116	G	89.3	Confident	89.4	Confident	17 Å²	17	64.1 Å²	64.1	18%	0.175	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.2	-177.4	175.9	0	0	0	0	0	113.2	Q104 R105	Q104-G116 PolarHBondContact OE1-O 3.23Å; R105-G116 WeakPolarHBondContact CG-O 3.37Å; R105-G116 PolarHBondContact N-O 2.99Å; R105-G116 PolarHBondContact O-N 2.9Å; R105-G116 VanDerWaalsContact O-N 3.14Å
117	A	89.1	Confident	89.7	Confident	35 Å²	35	58.4 Å²	58.4	29%	0.289	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	142.2	175.2	0	0	0	0	0	111.3	F103 T160	F103-A117 WeakPolarHBondContact O-CA 3.05Å; A117-T160 PolarHBondContact O-OG1 3.42Å
118	I	89.6	Confident	90.1	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127.6	166.7	-60	166.7	0	0	0	107.5	S102 F103 R105 M157 F159	S102-I118 WeakPolarHBondContact CA-O 3.16Å; F103-I118 HydrophobicContact CD2-CB 3.81Å; F103-I118 HydrophobicContact CD2-CD1 3.83Å; F103-I118 HydrophobicContact CD2-CG1 4.3Å; F103-I118 HydrophobicContact CD2-CG2 4.42Å; F103-I118 HydrophobicContact CE1-CB 4.45Å; F103-I118 HydrophobicContact CE1-CG2 4.2Å; F103-I118 HydrophobicContact CE2-CB 3.49Å; F103-I118 VanDerWaalsContact CE2-CB 3.49Å; F103-I118 HydrophobicContact CE2-CD1 3.29Å; F103-I118 HydrophobicContact CE2-CG1 3.96Å; F103-I118 HydrophobicContact CE2-CG2 3.64Å; F103-I118 HydrophobicContact CG-CB 4.46Å; F103-I118 HydrophobicContact CZ-CB 3.78Å; F103-I118 HydrophobicContact CZ-CD1 4.18Å; F103-I118 HydrophobicContact CZ-CG2 3.45Å; F103-I118 VanDerWaalsContact CZ-CG2 3.45Å; F103-I118 PolarHBondContact N-O 2.76Å; F103-I118 PolarHBondContact O-N 3.23Å; R105-I118 HydrophobicContact CB-CD1 3.64Å; R105-I118 HydrophobicContact CB-CG1 4.1Å; R105-I118 HydrophobicContact CG-CD1 3.9Å; R105-I118 HydrophobicContact CG-CG1 3.83Å; I118-M157 HydrophobicContact CG2-CB 4.01Å; I118-M157 HydrophobicContact CG2-CG 4.21Å; I118-F159 HydrophobicContact CD1-CD1 3.85Å; I118-F159 HydrophobicContact CD1-CE1 3.37Å; I118-F159 HydrophobicContact CD1-CZ 3.97Å; I118-F159 HydrophobicContact CG1-CD1 3.83Å; I118-F159 HydrophobicContact CG1-CE1 3.89Å; I118-F159 HydrophobicContact CG1-CG 4.48Å
119	N	92.2	Very high	90.6	Very high	87 Å²	87	59.8 Å²	59.8	47%	0.465	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	129.5	168.6	-68.7	-28.3	0	0	0	108.5	K158	N119-K158 PolarHBondContact N-O 2.93Å; N119-K158 PolarHBondContact O-N 3.27Å
120	A	92.4	Very high	91.2	Very high	8 Å²	8	55.5 Å²	55.5	7%	0.066	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	155	178.9	0	0	0	0	0	111.8	L101 F103 M155 K156 M157	L101-A120 HydrophobicContact CB-CB 4.4Å; L101-A120 PolarHBondContact N-O 3.07Å; L101-A120 PolarHBondContact O-N 3.13Å; L101-A120 VanDerWaalsContact O-O 3.13Å; F103-A120 HydrophobicContact CE1-CB 3.6Å; F103-A120 HydrophobicContact CZ-CB 4.16Å; A120-M155 HydrophobicContact CB-CE 3.63Å; A120-K156 CarbonylContact C-O 3.6Å; A120-K156 WeakPolarHBondContact CA-O 3.47Å; A120-K156 WeakPolarHBondContact CB-O 3.5Å; A120-M157 HydrophobicContact CB-CG 3.86Å
121	S	94.5	Very high	92	Very high	35 Å²	35	47.5 Å²	47.5	25%	0.245	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	124.7	173.9	-179.9	0	0	0	0	109.3	I99 M155 K156	I99-S121 CarbonylContact O-C 3.44Å; I99-S121 WeakPolarHBondContact O-CA 3.34Å; S121-M155 CarbonylContact O-C 3.54Å; S121-M155 WeakPolarHBondContact O-CA 3.2Å; S121-K156 PolarHBondContact N-O 2.84Å; S121-K156 PolarHBondContact O-N 2.81Å
122	A	94.5	Very high	92.6	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	125.8	165.7	0	0	0	0	0	108.2	S98 I99 V125 I152 K154 L182	S98-A122 CarbonylContact C-O 3.56Å; S98-A122 WeakPolarHBondContact CA-O 3.4Å; S98-A122 WeakPolarHBondContact CB-O 3.21Å; I99-A122 HydrophobicContact CB-CB 4.22Å; I99-A122 PolarHBondContact N-O 2.85Å; I99-A122 PolarHBondContact O-N 2.85Å; A122-V125 HydrophobicContact CB-CG2 4.12Å; A122-I152 HydrophobicContact CB-CG2 3.84Å; A122-K154 WeakPolarHBondContact CA-O 3.49Å; A122-L182 HydrophobicContact CB-CD2 4.07Å
123	E	94.7	Very high	93.1	Very high	50 Å²	50	35.1 Å²	35.1	23%	0.234	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	146	-179.3	-71.2	176.7	-143.8	0	0	109.6	G153 K154 K156	E123-G153 PolarHBondContact O-N 2.76Å; E123-K154 HydrophobicContact CB-CD 4.35Å; E123-K154 HydrophobicContact CB-CG 3.84Å; E123-K154 VanDerWaalsContact CD-CE 3.49Å; E123-K154 PolarHBondContact N-O 2.92Å; E123-K154 PolarHBondContact O-N 2.71Å; E123-K154 WeakPolarHBondContact OE2-CE 3.15Å; E123-K154 IonicContact OE2-NZ 2.72Å; E123-K154 PolarHBondContact OE2-NZ 2.92Å; E123-K156 VanDerWaalsContact CD-NZ 3.33Å; E123-K156 WeakPolarHBondContact OE1-CD 3.49Å; E123-K156 VanDerWaalsContact OE1-CE 3.27Å; E123-K156 WeakPolarHBondContact OE1-CE 3.47Å; E123-K156 IonicContact OE1-NZ 2.7Å; E123-K156 PolarHBondContact OE1-NZ 3.34Å; E123-K156 IonicContact OE2-NZ 3.12Å; E123-K156 PolarHBondContact OE2-NZ 2.88Å; E123-K156 VanDerWaalsContact OE2-NZ 3.12Å
124	G	94.6	Very high	93.6	Very high	16 Å²	16	30.7 Å²	30.7	17%	0.165	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	71.8	45.1	-177.2	0	0	0	0	0	111.5	S97 G153	S97-G124 PolarHBondContact O-N 3.23Å; S97-G124 VanDerWaalsContact O-N 3.12Å; G124-G153 PolarHBondContact O-N 3.47Å
125	V	95	Very high	94	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	121.3	175.4	-173.8	0	0	0	0	108.8	N96 S97 I99 A122 I127 S151 I152 I186	N96-V125 PolarHBondContact N-O 2.98Å; S97-V125 PolarHBondContact N-O 2.81Å; S97-V125 PolarHBondContact O-N 2.78Å; I99-V125 HydrophobicContact CD1-CG1 4.06Å; I99-V125 HydrophobicContact CD1-CG2 4Å; I99-V125 HydrophobicContact CG1-CG2 4.03Å; A122-V125 HydrophobicContact CB-CG2 4.12Å; V125-I127 HydrophobicContact CG1-CD1 4.45Å; V125-I127 HydrophobicContact CG1-CG1 4.24Å; V125-S151 CarbonylContact C-O 3.53Å; V125-S151 WeakPolarHBondContact CA-O 3.39Å; V125-I152 HydrophobicContact CG1-CG1 4.39Å; V125-I152 HydrophobicContact CG2-CG1 4.12Å; V125-I186 HydrophobicContact CG1-CD1 4.42Å
126	N	95.9	Very high	94.2	Very high	62 Å²	62	29.3 Å²	29.3	33%	0.332	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	134.6	173.6	-51.7	-52	0	0	0	109.4	V94 Q95 N96 A150 S151	V94-N126 CarbonylContact O-C 3.58Å; V94-N126 WeakPolarHBondContact O-CA 3.37Å; Q95-N126 WeakPolarHBondContact CA-OD1 3.37Å; N96-N126 PolarHBondContact N-OD1 2.83Å; N126-A150 WeakPolarHBondContact O-CA 3.32Å; N126-S151 PolarHBondContact N-O 3.41Å; N126-S151 PolarHBondContact O-N 2.75Å
127	I	95.9	Very high	94.3	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	127.2	178	-52.1	174.8	0	0	0	107.2	L48 E93 V94 V125 I186 M190	L48-I127 HydrophobicContact CD1-CD1 3.8Å; E93-I127 CarbonylContact C-O 3.48Å; E93-I127 WeakPolarHBondContact CA-O 3.05Å; V94-I127 HydrophobicContact CB-CB 4.03Å; V94-I127 HydrophobicContact CB-CG1 4.38Å; V94-I127 HydrophobicContact CG2-CB 4.4Å; V94-I127 PolarHBondContact N-O 3.48Å; V94-I127 PolarHBondContact O-N 2.89Å; V125-I127 HydrophobicContact CG1-CD1 4.45Å; V125-I127 HydrophobicContact CG1-CG1 4.24Å; I127-I186 HydrophobicContact CD1-CG2 3.77Å; I127-I186 HydrophobicContact CG1-CG2 4.05Å; I127-I186 HydrophobicContact CG2-CG2 4.31Å; I127-M190 HydrophobicContact CG2-CG 4.48Å
128	H	96.3	Very high	94.4	Very high	70 Å²	70	42.1 Å²	42.1	32%	0.324	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	106.9	178	176.4	-78.4	0	0	0	108.7	L91 C148 D149	L91-H128 VanDerWaalsContact CD1-CD2 3.49Å; L91-H128 WeakPolarHBondContact CD1-CD2 3.36Å; L91-H128 VanDerWaalsContact CD1-NE2 3.29Å; L91-H128 WeakPolarHBondContact CD1-NE2 3.38Å; H128-C148 WeakPolarHBondContact O-CA 3.02Å; H128-D149 PolarHBondContact N-O 3.13Å; H128-D149 PolarHBondContact O-N 2.81Å
129	T	96.8	Very high	94.6	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.018	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	121.8	-175.3	-59.6	0	0	0	0	110.5	F92 L131 I146 T147 M190	F92-T129 PolarHBondContact N-O 2.97Å; F92-T129 PolarHBondContact O-N 3.41Å; T129-L131 HydrophobicContact CG2-CD1 4.21Å; T129-I146 HydrophobicContact CG2-CG2 3.55Å; T129-T147 CarbonylContact C-O 3.5Å; T129-T147 VanDerWaalsContact CA-O 3.29Å; T129-T147 WeakPolarHBondContact CA-O 3.43Å; T129-M190 HydrophobicContact CG2-CE 4.32Å
130	V	97.3	Very high	94.8	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.03	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.9	173.7	-172.5	0	0	0	0	109.6	Q85 L88 L90 L91 I146 T147	Q85-V130 HydrophobicContact CB-CG1 4.46Å; L88-V130 HydrophobicContact CB-CG1 4.24Å; L90-V130 CarbonylContact O-C 3.53Å; L90-V130 VanDerWaalsContact O-CA 3.31Å; L90-V130 WeakPolarHBondContact O-CA 3.46Å; L91-V130 HydrophobicContact CD1-CG2 3.88Å; V130-I146 WeakPolarHBondContact O-CA 3.47Å; V130-T147 WeakPolarHBondContact CB-OG1 3.36Å; V130-T147 PolarHBondContact N-O 3.49Å; V130-T147 PolarHBondContact O-N 3.2Å
131	L	96.8	Very high	94.9	Very high	26 Å²	26	42.6 Å²	42.6	14%	0.136	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	115.4	176.6	-64.2	86.1	0	0	0	109.6	G89 L90 T129 I143	G89-L131 WeakPolarHBondContact CA-O 3.33Å; L90-L131 HydrophobicContact CB-CB 4.47Å; L90-L131 PolarHBondContact N-O 3.16Å; L90-L131 PolarHBondContact O-N 3.32Å; T129-L131 HydrophobicContact CG2-CD1 4.21Å; L131-I143 HydrophobicContact CB-CD1 4.41Å; L131-I143 HydrophobicContact CB-CG2 4.22Å; L131-I143 HydrophobicContact CD2-CD1 4.34Å; L131-I143 HydrophobicContact CD2-CG1 4.43Å; L131-I143 HydrophobicContact CD2-CG2 4.45Å
132	H	95.9	Very high	94.9	Very high	36 Å²	36	45.6 Å²	45.6	17%	0.167	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	125.9	176.5	-63.3	-83.2	0	0	0	110.4	L88 I143 S144 N145	L88-H132 PolarHBondContact O-ND1 2.8Å; L88-H132 VanDerWaalsContact O-ND1 3.08Å; H132-I143 CarbonylContact O-C 3.56Å; H132-I143 VanDerWaalsContact O-CA 3.27Å; H132-I143 WeakPolarHBondContact O-CA 3.46Å; H132-S144 PolarHBondContact O-N 3.1Å; H132-S144 PolarHBondContact O-OG 3.24Å; H132-N145 HydrophobicContact CB-CB 4.2Å; H132-N145 WeakPolarHBondContact CB-O 3.43Å; H132-N145 PolarHBondContact N-O 2.82Å
133	M	94.1	Very high	94.9	Very high	18 Å²	18	45.9 Å²	45.9	9%	0.089	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.1	-178.7	-65.5	170.2	-69.3	0	0	110.3	L90 L141 K142 I143 P225 V227 L232	L90-M133 HydrophobicContact CD1-CE 4.27Å; L90-M133 HydrophobicContact CD1-SD 4.07Å; L90-M133 HydrophobicContact CD2-CE 4.41Å; L90-M133 HydrophobicContact CG-CE 3.75Å; L90-M133 HydrophobicContact CG-SD 4.22Å; M133-L141 HydrophobicContact CB-CD1 4.15Å; M133-K142 WeakPolarHBondContact CA-O 3.36Å; M133-I143 HydrophobicContact CG-CD1 3.63Å; M133-P225 HydrophobicContact CB-CG 4.16Å; M133-V227 HydrophobicContact CE-CG2 3.77Å; M133-L232 HydrophobicContact CE-CD1 3.65Å; M133-L232 HydrophobicContact CE-CD2 3.99Å; M133-L232 HydrophobicContact CE-CG 4.44Å; M133-L232 HydrophobicContact SD-CD1 4.26Å; M133-L232 HydrophobicContact SD-CD2 3.89Å
134	T	95.3	Very high	94.9	Very high	40 Å²	40	46.1 Å²	46.1	25%	0.245	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	166.9	174.9	65.4	0	0	0	0	110.5	K142 S144 D224	T134-K142 PolarHBondContact N-O 3.09Å; T134-K142 PolarHBondContact O-N 2.95Å; T134-S144 WeakPolarHBondContact CG2-OG 3.11Å; T134-S144 WeakPolarHBondContact OG1-CB 3.32Å; T134-D224 WeakPolarHBondContact CA-OD1 3.36Å; T134-D224 WeakPolarHBondContact CB-OD1 3.5Å
135	K	94.9	Very high	95	Very high	73 Å²	73	49.5 Å²	49.5	32%	0.317	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	139.4	166	-179.9	-176.3	72.1	169	0	109.6	R140 L221 L222 D224	K135-R140 WeakPolarHBondContact CA-O 3.34Å; K135-L221 HydrophobicContact CB-CB 4.21Å; K135-L221 HydrophobicContact CB-CD1 4.21Å; K135-L221 HydrophobicContact CD-CB 3.63Å; K135-L221 WeakPolarHBondContact CD-O 3.27Å; K135-L221 HydrophobicContact CG-CB 3.74Å; K135-L221 HydrophobicContact CG-CD1 4.35Å; K135-L222 PolarHBondContact NZ-O 2.89Å; K135-D224 WeakPolarHBondContact CB-OD1 3.42Å; K135-D224 PolarHBondContact N-OD1 3.43Å
136	D	93.3	Very high	95	Very high	29 Å²	29	49.9 Å²	49.9	16%	0.155	25%	0.249	C	C	.	.			trans	-89.6	176.6	169.3	84	-6.5	0	0	0	112.9	L138 G139 R140	D136-L138 PolarHBondContact O-N 3.48Å; D136-L138 WeakPolarHBondContact OD1-CA 3.43Å; D136-L138 WeakPolarHBondContact OD1-CB 3.33Å; D136-L138 PolarHBondContact OD1-N 3.4Å; D136-G139 PolarHBondContact O-N 3.32Å; D136-G139 PolarHBondContact OD1-N 3.2Å; D136-R140 PolarHBondContact N-O 3.05Å; D136-R140 WeakPolarHBondContact OD1-CB 2.96Å; D136-R140 PolarHBondContact OD1-N 3.25Å; D136-R140 IonicContact OD2-CZ 3.74Å; D136-R140 VanDerWaalsContact OD2-CZ 3.24Å; D136-R140 IonicContact OD2-NE 2.76Å; D136-R140 PolarHBondContact OD2-NE 2.89Å; D136-R140 IonicContact OD2-NH2 3.47Å; D136-R140 PolarHBondContact OD2-NH2 2.91Å
137	E	91.5	Very high	95	Very high	204 Å²	204	49.9 Å²	49.9	95%	0.953	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-23.6	-179	-62.4	-177.5	174.8	0	0	113.6
138	L	91.9	Very high	95.1	Very high	116 Å²	116	51.3 Å²	51.3	61%	0.607	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-2.3	177.8	-59.6	177.1	0	0	0	112.5	D136 R140 S220	D136-L138 PolarHBondContact O-N 3.48Å; D136-L138 WeakPolarHBondContact OD1-CA 3.43Å; D136-L138 WeakPolarHBondContact OD1-CB 3.33Å; D136-L138 PolarHBondContact OD1-N 3.4Å; L138-R140 HydrophobicContact CB-CG 4.42Å; L138-S220 PolarHBondContact O-OG 2.93Å
139	G	93.9	Very high	95.1	Very high	6 Å²	6	53.1 Å²	53.1	6%	0.062	27%	0.273	C	S	.	.	S	Bend	trans	80.9	17.2	-176.4	0	0	0	0	0	114.5	D136 L221	D136-G139 PolarHBondContact O-N 3.32Å; D136-G139 PolarHBondContact OD1-N 3.2Å; G139-L221 PolarHBondContact O-N 2.98Å
140	R	94.6	Very high	95	Very high	73 Å²	73	53.7 Å²	53.7	28%	0.275	28%	0.279	S	S	.	.			trans	-81.4	151.5	173	-60.4	-179.6	-62	163.7	7.8	110.9	K135 D136 L138 E203 V207	K135-R140 WeakPolarHBondContact CA-O 3.34Å; D136-R140 PolarHBondContact N-O 3.05Å; D136-R140 WeakPolarHBondContact OD1-CB 2.96Å; D136-R140 PolarHBondContact OD1-N 3.25Å; D136-R140 IonicContact OD2-CZ 3.74Å; D136-R140 VanDerWaalsContact OD2-CZ 3.24Å; D136-R140 IonicContact OD2-NE 2.76Å; D136-R140 PolarHBondContact OD2-NE 2.89Å; D136-R140 IonicContact OD2-NH2 3.47Å; D136-R140 PolarHBondContact OD2-NH2 2.91Å; L138-R140 HydrophobicContact CB-CG 4.42Å; R140-E203 IonicContact CZ-OE1 2.72Å; R140-E203 IonicContact NH1-OE1 2.98Å; R140-E203 PolarHBondContact NH1-OE1 3.39Å; R140-E203 IonicContact NH2-OE1 3.55Å; R140-V207 HydrophobicContact CB-CG2 4.14Å; R140-V207 HydrophobicContact CG-CB 4.35Å; R140-V207 HydrophobicContact CG-CG2 3.44Å; R140-V207 VanDerWaalsContact CG-CG2 3.44Å
141	L	94.4	Very high	95	Very high	28 Å²	28	55.7 Å²	55.7	15%	0.147	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	131.5	167.5	179.8	61.7	0	0	0	109.6	M133 L202 L221 P225 M234	M133-L141 HydrophobicContact CB-CD1 4.15Å; L141-L202 HydrophobicContact CD2-CD2 4.03Å; L141-L202 HydrophobicContact CG-CD1 4.28Å; L141-L221 HydrophobicContact CB-CD1 3.94Å; L141-L221 HydrophobicContact CD1-CD1 4.24Å; L141-P225 HydrophobicContact CD1-CG 3.46Å; L141-P225 VanDerWaalsContact CD1-CG 3.46Å; L141-M234 HydrophobicContact CD2-SD 3.9Å
142	K	94.4	Very high	94.9	Very high	98 Å²	98	54.8 Å²	54.8	43%	0.426	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	145.9	178.7	-174.1	-177	173.4	179	0	111.6	M133 T134 S144 N199	M133-K142 WeakPolarHBondContact CA-O 3.36Å; T134-K142 PolarHBondContact N-O 3.09Å; T134-K142 PolarHBondContact O-N 2.95Å; K142-S144 PolarHBondContact O-N 2.92Å; K142-N199 WeakPolarHBondContact CG-OD1 3.18Å
143	I	95.6	Very high	94.8	Very high	5 Å²	5	55.4 Å²	55.4	3%	0.026	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	106.1	160.7	-48.8	-51.4	0	0	0	108.4	L131 H132 M133 I146 L195 I198 N199 L202	L131-I143 HydrophobicContact CB-CD1 4.41Å; L131-I143 HydrophobicContact CB-CG2 4.22Å; L131-I143 HydrophobicContact CD2-CD1 4.34Å; L131-I143 HydrophobicContact CD2-CG1 4.43Å; L131-I143 HydrophobicContact CD2-CG2 4.45Å; H132-I143 CarbonylContact O-C 3.56Å; H132-I143 VanDerWaalsContact O-CA 3.27Å; H132-I143 WeakPolarHBondContact O-CA 3.46Å; M133-I143 HydrophobicContact CG-CD1 3.63Å; I143-I146 HydrophobicContact CG2-CD1 4.14Å; I143-I146 HydrophobicContact CG2-CG1 3.81Å; I143-L195 HydrophobicContact CG2-CD2 4.25Å; I143-I198 HydrophobicContact CG1-CG2 4.06Å; I143-N199 WeakPolarHBondContact CB-OD1 3.48Å; I143-N199 PolarHBondContact N-OD1 2.82Å; I143-N199 PolarHBondContact O-ND2 3.02Å; I143-L202 HydrophobicContact CD1-CD1 3.97Å; I143-L202 HydrophobicContact CG1-CD1 3.94Å
144	S	94.7	Very high	94.8	Very high	55 Å²	55	59.4 Å²	59.4	39%	0.385	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-33.9	-175.4	58.1	0	0	0	0	113.1	H132 T134 K142	H132-S144 PolarHBondContact O-N 3.1Å; H132-S144 PolarHBondContact O-OG 3.24Å; T134-S144 WeakPolarHBondContact CG2-OG 3.11Å; T134-S144 WeakPolarHBondContact OG1-CB 3.32Å; K142-S144 PolarHBondContact O-N 2.92Å
145	N	95.6	Very high	94.6	Very high	87 Å²	87	58.4 Å²	58.4	47%	0.465	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	157	-179	-167	15.2	0	0	0	110.8	H132	H132-N145 HydrophobicContact CB-CB 4.2Å; H132-N145 WeakPolarHBondContact CB-O 3.43Å; H132-N145 PolarHBondContact N-O 2.82Å
146	I	96.2	Very high	94.5	Very high	11 Å²	11	59.7 Å²	59.7	6%	0.056	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128	174.3	-62.9	-176.7	0	0	0	108.6	T129 V130 I143 N191 L195	T129-I146 HydrophobicContact CG2-CG2 3.55Å; V130-I146 WeakPolarHBondContact O-CA 3.47Å; I143-I146 HydrophobicContact CG2-CD1 4.14Å; I143-I146 HydrophobicContact CG2-CG1 3.81Å; I146-N191 WeakPolarHBondContact CG2-OD1 3.38Å; I146-L195 HydrophobicContact CD1-CD2 4.24Å; I146-L195 HydrophobicContact CD1-CG 3.79Å; I146-L195 HydrophobicContact CG1-CD2 4.01Å; I146-L195 HydrophobicContact CG1-CG 3.98Å
147	T	96.3	Very high	94.3	Very high	62 Å²	62	59.4 Å²	59.4	38%	0.38	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	121.2	167.2	62	0	0	0	0	108.5	T129 V130	T129-T147 CarbonylContact C-O 3.5Å; T129-T147 VanDerWaalsContact CA-O 3.29Å; T129-T147 WeakPolarHBondContact CA-O 3.43Å; V130-T147 WeakPolarHBondContact CB-OG1 3.36Å; V130-T147 PolarHBondContact N-O 3.49Å; V130-T147 PolarHBondContact O-N 3.2Å
148	C	96.9	Very high	94.1	Very high	32 Å²	32	57.5 Å²	57.5	22%	0.216	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.9	178.7	175.3	0	0	0	0	110.2	H128 C187	H128-C148 WeakPolarHBondContact O-CA 3.02Å; C148-C187 HydrophobicContact CB-CB 3.7Å; C148-C187 WeakPolarHBondContact CB-SG 3Å; C148-C187 PolarHBondContact O-SG 3.44Å; C148-C187 WeakPolarHBondContact SG-CA 3.23Å; C148-C187 WeakPolarHBondContact SG-CB 3.26Å; C148-C187 CovalentContact SG-SG 2.06Å; C148-C187 PolarHBondContact SG-SG 3.45Å
149	D	96.6	Very high	93.8	Very high	108 Å²	108	53.6 Å²	53.6	58%	0.578	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.3	130.8	165.3	-177.9	41.8	0	0	0	108.9	H128	H128-D149 PolarHBondContact N-O 3.13Å; H128-D149 PolarHBondContact O-N 2.81Å
150	A	95.7	Very high	93.2	Very high	16 Å²	16	56.9 Å²	56.9	13%	0.132	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	133.7	-178	0	0	0	0	0	110	N126 I186	N126-A150 WeakPolarHBondContact O-CA 3.32Å; A150-I186 HydrophobicContact CB-CB 3.94Å; A150-I186 HydrophobicContact CB-CD1 4.35Å; A150-I186 HydrophobicContact CB-CG2 3.63Å
151	S	95.9	Very high	92.3	Very high	47 Å²	47	56.3 Å²	56.3	33%	0.329	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	147.1	179.7	64	0	0	0	0	112	V125 N126 N183	V125-S151 CarbonylContact C-O 3.53Å; V125-S151 WeakPolarHBondContact CA-O 3.39Å; N126-S151 PolarHBondContact N-O 3.41Å; N126-S151 PolarHBondContact O-N 2.75Å; S151-N183 WeakPolarHBondContact CA-OD1 2.83Å
152	I	95.6	Very high	91.6	Very high	7 Å²	7	61.7 Å²	61.7	4%	0.036	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	118.2	175.3	-65.2	160.5	0	0	0	107.5	A122 V125 R179 L182 N183 I186	A122-I152 HydrophobicContact CB-CG2 3.84Å; V125-I152 HydrophobicContact CG1-CG1 4.39Å; V125-I152 HydrophobicContact CG2-CG1 4.12Å; I152-R179 HydrophobicContact CB-CG 3.96Å; I152-R179 HydrophobicContact CG2-CG 3.89Å; I152-L182 HydrophobicContact CD1-CB 3.93Å; I152-L182 HydrophobicContact CD1-CD2 3.54Å; I152-L182 HydrophobicContact CD1-CG 3.62Å; I152-N183 WeakPolarHBondContact CB-OD1 3.37Å; I152-N183 WeakPolarHBondContact CD1-OD1 3.48Å; I152-N183 WeakPolarHBondContact CG1-OD1 3.4Å; I152-N183 PolarHBondContact N-OD1 3.1Å; I152-I186 HydrophobicContact CD1-CD1 4.31Å
153	G	93.8	Very high	90.6	Very high	48 Å²	48	60.7 Å²	60.7	50%	0.495	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	-56.8	178.7	0	0	0	0	0	111.9	E123 G124 R179	E123-G153 PolarHBondContact O-N 2.76Å; G124-G153 PolarHBondContact O-N 3.47Å; G153-R179 PolarHBondContact O-NH1 3.24Å; G153-R179 VanDerWaalsContact O-NH1 3.16Å
154	K	93.3	Very high	89.8	Confident	103 Å²	103	62.2 Å²	62.2	45%	0.448	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	155	-176.8	67.4	-168.6	179.4	-176.9	0	112.7	A122 E123	A122-K154 WeakPolarHBondContact CA-O 3.49Å; E123-K154 HydrophobicContact CB-CD 4.35Å; E123-K154 HydrophobicContact CB-CG 3.84Å; E123-K154 VanDerWaalsContact CD-CE 3.49Å; E123-K154 PolarHBondContact N-O 2.92Å; E123-K154 PolarHBondContact O-N 2.71Å; E123-K154 WeakPolarHBondContact OE2-CE 3.15Å; E123-K154 IonicContact OE2-NZ 2.72Å; E123-K154 PolarHBondContact OE2-NZ 2.92Å
155	M	92.5	Very high	89.1	Confident	18 Å²	18	70.4 Å²	70.4	9%	0.089	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	134.6	174.2	-170.5	168.4	-169.5	0	0	109.8	L101 A120 S121 M157 T175 M178 R179	L101-M155 HydrophobicContact CD1-CE 3.79Å; A120-M155 HydrophobicContact CB-CE 3.63Å; S121-M155 CarbonylContact O-C 3.54Å; S121-M155 WeakPolarHBondContact O-CA 3.2Å; M155-M157 HydrophobicContact CE-CE 3.7Å; M155-M157 HydrophobicContact SD-CE 3.97Å; M155-T175 HydrophobicContact CG-CG2 4.47Å; M155-T175 WeakPolarHBondContact O-CG2 3.48Å; M155-M178 HydrophobicContact CE-CB 3.6Å; M155-M178 HydrophobicContact CE-CE 4.44Å; M155-M178 HydrophobicContact CE-CG 4.3Å; M155-M178 HydrophobicContact SD-CB 3.4Å; M155-M178 WeakPolarHBondContact SD-CB 3.4Å; M155-R179 HydrophobicContact CB-CB 4.23Å; M155-R179 HydrophobicContact SD-CB 4.34Å
156	K	91.1	Very high	88.2	Confident	100 Å²	100	67.4 Å²	67.4	44%	0.435	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	139.3	176.2	-64.9	179	-174.4	160.7	0	109.1	A120 S121 E123	A120-K156 CarbonylContact C-O 3.6Å; A120-K156 WeakPolarHBondContact CA-O 3.47Å; A120-K156 WeakPolarHBondContact CB-O 3.5Å; S121-K156 PolarHBondContact N-O 2.84Å; S121-K156 PolarHBondContact O-N 2.81Å; E123-K156 VanDerWaalsContact CD-NZ 3.33Å; E123-K156 WeakPolarHBondContact OE1-CD 3.49Å; E123-K156 VanDerWaalsContact OE1-CE 3.27Å; E123-K156 WeakPolarHBondContact OE1-CE 3.47Å; E123-K156 IonicContact OE1-NZ 2.7Å; E123-K156 PolarHBondContact OE1-NZ 3.34Å; E123-K156 IonicContact OE2-NZ 3.12Å; E123-K156 PolarHBondContact OE2-NZ 2.88Å; E123-K156 VanDerWaalsContact OE2-NZ 3.12Å
157	M	90.2	Very high	87.6	Confident	24 Å²	24	67.5 Å²	67.5	12%	0.118	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.8	175.9	-71.8	177.5	-180	0	0	109.6	F103 I118 A120 M155 F159 L174 T175 M178	F103-M157 HydrophobicContact CE1-CE 4.22Å; F103-M157 HydrophobicContact CE2-CE 4.43Å; F103-M157 HydrophobicContact CZ-CE 3.55Å; F103-M157 HydrophobicContact CZ-CG 4.2Å; F103-M157 HydrophobicContact CZ-SD 3.85Å; I118-M157 HydrophobicContact CG2-CB 4.01Å; I118-M157 HydrophobicContact CG2-CG 4.21Å; A120-M157 HydrophobicContact CB-CG 3.86Å; M155-M157 HydrophobicContact CE-CE 3.7Å; M155-M157 HydrophobicContact SD-CE 3.97Å; M157-F159 HydrophobicContact CB-CD2 4.34Å; M157-F159 HydrophobicContact CB-CE2 3.68Å; M157-F159 HydrophobicContact CB-CZ 4.37Å; M157-F159 HydrophobicContact SD-CZ 4.4Å; M157-L174 VanDerWaalsContact CE-C 3.47Å; M157-L174 HydrophobicContact CE-CB 4.04Å; M157-L174 VanDerWaalsContact CE-O 3.3Å; M157-L174 WeakPolarHBondContact CE-O 3.38Å; M157-L174 HydrophobicContact SD-CB 3.68Å; M157-T175 HydrophobicContact CB-CG2 4.12Å; M157-T175 HydrophobicContact CE-CG2 4.19Å; M157-T175 HydrophobicContact CG-CG2 3.66Å; M157-T175 HydrophobicContact SD-CG2 3.74Å; M157-M178 HydrophobicContact CE-CB 3.65Å; M157-M178 HydrophobicContact CE-CG 3.63Å
158	K	87.4	Confident	86.9	Confident	163 Å²	163	70 Å²	70	71%	0.709	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	111.7	173.9	-69.4	-176.6	179.2	178	0	108.2	N119	N119-K158 PolarHBondContact N-O 2.93Å; N119-K158 PolarHBondContact O-N 3.27Å
159	F	85.2	Confident	86.2	Confident	35 Å²	35	73.1 Å²	73.1	15%	0.154	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	141.5	176.2	-66.3	-103.2	0	0	0	109.5	I118 M157 Y167 A171 L174	I118-F159 HydrophobicContact CD1-CD1 3.85Å; I118-F159 HydrophobicContact CD1-CE1 3.37Å; I118-F159 HydrophobicContact CD1-CZ 3.97Å; I118-F159 HydrophobicContact CG1-CD1 3.83Å; I118-F159 HydrophobicContact CG1-CE1 3.89Å; I118-F159 HydrophobicContact CG1-CG 4.48Å; M157-F159 HydrophobicContact CB-CD2 4.34Å; M157-F159 HydrophobicContact CB-CE2 3.68Å; M157-F159 HydrophobicContact CB-CZ 4.37Å; M157-F159 HydrophobicContact SD-CZ 4.4Å; F159-Y167 HydrophobicContact CB-CD1 4.16Å; F159-Y167 HydrophobicContact CB-CD2 3.53Å; F159-Y167 HydrophobicContact CB-CE2 4.16Å; F159-Y167 HydrophobicContact CB-CG 3.53Å; F159-Y167 AromaticContact CD1-CD1 3.95Å; F159-Y167 HydrophobicContact CD1-CD1 3.95Å; F159-Y167 HydrophobicContact CD1-CG 4.03Å; F159-Y167 HydrophobicContact CG-CD1 4.22Å; F159-Y167 HydrophobicContact CG-CD2 4.33Å; F159-Y167 AromaticContact CG-CG 3.81Å; F159-Y167 HydrophobicContact CG-CG 3.81Å; F159-A171 HydrophobicContact CD2-CB 4.43Å; F159-A171 HydrophobicContact CE2-CB 3.58Å; F159-A171 HydrophobicContact CZ-CB 4.23Å; F159-L174 HydrophobicContact CE1-CD1 4.25Å; F159-L174 HydrophobicContact CZ-CD1 4.02Å
160	T	80.4	Confident	85.3	Confident	74 Å²	74	68 Å²	68	45%	0.454	37%	0.37	S	S	.	.			trans	-101.4	129.5	172.9	53.4	0	0	0	0	108.7	R105 A117	R105-T160 PolarHBondContact NH2-O 2.71Å; A117-T160 PolarHBondContact O-OG1 3.42Å
161	G	77.1	Confident	84.8	Confident	61 Å²	61	68.1 Å²	68.1	63%	0.629	37%	0.371	S	S	*	.	S	Bend	trans	138.4	-168.9	176.3	0	0	0	0	0	114.7	Y167	G161-Y167 WeakPolarHBondContact CA-OH 3.27Å
162	T	78.3	Confident	84.1	Confident	141 Å²	141	70.6 Å²	70.6	87%	0.865	38%	0.384	S	S	*	.	S	Bend	trans	-105.2	-9.2	-172.2	53.7	0	0	0	0	114.6	G164 Y167	T162-G164 VanDerWaalsContact C-N 3.31Å; T162-G164 PolarHBondContact O-N 2.92Å; T162-G164 VanDerWaalsContact O-N 3.11Å; T162-Y167 PolarHBondContact N-OH 2.82Å
163	L	74.3	Confident	83.5	Confident	78 Å²	78	74.3 Å²	74.3	41%	0.408	40%	0.4	S	S	.	.			trans	-88.4	53.7	-176.5	-62.8	166.8	0	0	0	113	D114 R165 V166 Y167	D114-L163 HydrophobicContact CB-CD1 4.24Å; L163-R165 PolarHBondContact O-N 3.19Å; L163-V166 HydrophobicContact CB-CB 4.12Å; L163-V166 HydrophobicContact CB-CG2 4.24Å; L163-V166 WeakPolarHBondContact O-CB 3.45Å; L163-V166 PolarHBondContact O-N 2.8Å; L163-Y167 HydrophobicContact CB-CD1 4.34Å; L163-Y167 HydrophobicContact CB-CE1 3.64Å; L163-Y167 HydrophobicContact CB-CE2 4.24Å; L163-Y167 PolarHBondContact N-OH 2.85Å; L163-Y167 WeakPolarHBondContact O-CD1 3.3Å; L163-Y167 WeakPolarHBondContact O-CD2 3.41Å; L163-Y167 VanDerWaalsContact O-CG 3.3Å; L163-Y167 PolarHBondContact O-N 3.38Å
164	G	78.9	Confident	83.1	Confident	36 Å²	36	72.2 Å²	72.2	37%	0.371	38%	0.378	S	S	.	.	H	α-helix	trans	-49	-49	-171.6	0	0	0	0	0	115.3	T162 V166 Y167 D168	T162-G164 VanDerWaalsContact C-N 3.31Å; T162-G164 PolarHBondContact O-N 2.92Å; T162-G164 VanDerWaalsContact O-N 3.11Å; G164-V166 VanDerWaalsContact C-N 3.3Å; G164-V166 PolarHBondContact O-N 3.06Å; G164-Y167 WeakPolarHBondContact O-CB 2.88Å; G164-Y167 PolarHBondContact O-N 2.83Å; G164-Y167 VanDerWaalsContact O-N 3.1Å; G164-D168 PolarHBondContact O-N 2.85Å
165	R	78.9	Confident	83	Confident	228 Å²	228	68.5 Å²	68.5	86%	0.86	36%	0.364	S	S	*	.	H	α-helix	trans	-63.4	-32.5	179.5	-71.5	-174	-179.3	161.1	0.7	113.8	L163 F169	L163-R165 PolarHBondContact O-N 3.19Å; R165-F169 PolarHBondContact O-N 3.39Å
166	V	77.5	Confident	82.8	Confident	24 Å²	24	71.4 Å²	71.4	15%	0.145	38%	0.383	C	S	.	.	H	α-helix	trans	-71.8	-39.1	176.2	178.4	0	0	0	0	109.4	F63 L163 G164 F169 L170	F63-V166 HydrophobicContact CD1-CG1 3.89Å; F63-V166 HydrophobicContact CE1-CB 4.31Å; F63-V166 HydrophobicContact CE1-CG1 3.48Å; F63-V166 VanDerWaalsContact CE1-CG1 3.48Å; F63-V166 HydrophobicContact CE1-CG2 3.84Å; F63-V166 HydrophobicContact CZ-CB 4.46Å; F63-V166 HydrophobicContact CZ-CG1 3.91Å; F63-V166 HydrophobicContact CZ-CG2 3.89Å; L163-V166 HydrophobicContact CB-CB 4.12Å; L163-V166 HydrophobicContact CB-CG2 4.24Å; L163-V166 WeakPolarHBondContact O-CB 3.45Å; L163-V166 PolarHBondContact O-N 2.8Å; G164-V166 VanDerWaalsContact C-N 3.3Å; G164-V166 PolarHBondContact O-N 3.06Å; V166-F169 PolarHBondContact O-N 3.28Å; V166-L170 HydrophobicContact CG1-CD1 3.82Å; V166-L170 HydrophobicContact CG1-CG 4.44Å; V166-L170 WeakPolarHBondContact O-CB 3.33Å; V166-L170 WeakPolarHBondContact O-CG 3.24Å; V166-L170 PolarHBondContact O-N 3.42Å
167	Y	83.3	Confident	82.7	Confident	12 Å²	12	67.8 Å²	67.8	5%	0.047	37%	0.374	C	S	.	.	H	α-helix	trans	-65.6	-42.3	177.3	-55.1	-20.8	0	0	0	111.8	R105 D114 F159 G161 T162 L163 G164 F169 L170 A171	R105-Y167 PolarHBondContact NH2-OH 2.84Å; R105-Y167 VanDerWaalsContact NH2-OH 3.1Å; D114-Y167 PolarHBondContact OD1-OH 2.99Å; F159-Y167 HydrophobicContact CB-CD1 4.16Å; F159-Y167 HydrophobicContact CB-CD2 3.53Å; F159-Y167 HydrophobicContact CB-CE2 4.16Å; F159-Y167 HydrophobicContact CB-CG 3.53Å; F159-Y167 AromaticContact CD1-CD1 3.95Å; F159-Y167 HydrophobicContact CD1-CD1 3.95Å; F159-Y167 HydrophobicContact CD1-CG 4.03Å; F159-Y167 HydrophobicContact CG-CD1 4.22Å; F159-Y167 HydrophobicContact CG-CD2 4.33Å; F159-Y167 AromaticContact CG-CG 3.81Å; F159-Y167 HydrophobicContact CG-CG 3.81Å; G161-Y167 WeakPolarHBondContact CA-OH 3.27Å; T162-Y167 PolarHBondContact N-OH 2.82Å; L163-Y167 HydrophobicContact CB-CD1 4.34Å; L163-Y167 HydrophobicContact CB-CE1 3.64Å; L163-Y167 HydrophobicContact CB-CE2 4.24Å; L163-Y167 PolarHBondContact N-OH 2.85Å; L163-Y167 WeakPolarHBondContact O-CD1 3.3Å; L163-Y167 WeakPolarHBondContact O-CD2 3.41Å; L163-Y167 VanDerWaalsContact O-CG 3.3Å; L163-Y167 PolarHBondContact O-N 3.38Å; G164-Y167 WeakPolarHBondContact O-CB 2.88Å; G164-Y167 PolarHBondContact O-N 2.83Å; G164-Y167 VanDerWaalsContact O-N 3.1Å; Y167-F169 VanDerWaalsContact C-N 3.32Å; Y167-F169 PolarHBondContact O-N 2.91Å; Y167-L170 PolarHBondContact O-N 3.25Å; Y167-A171 WeakPolarHBondContact O-CA 3.4Å; Y167-A171 WeakPolarHBondContact O-CB 3.46Å; Y167-A171 PolarHBondContact O-N 3.31Å
168	D	82.3	Confident	82.6	Confident	114 Å²	114	66.7 Å²	66.7	61%	0.61	37%	0.368	S	S	*	.	H	α-helix	trans	-61.1	-41.1	177.7	-65.8	-28.4	0	0	0	112.1	G164 T172	G164-D168 PolarHBondContact O-N 2.85Å; D168-T172 PolarHBondContact O-OG1 3.31Å
169	F	81.2	Confident	82.9	Confident	98 Å²	98	63.5 Å²	63.5	43%	0.43	35%	0.352	S	S	.	.	H	α-helix	trans	-66.2	-53	176.9	177.9	-104.8	0	0	0	111.7	E60 F63 R165 V166 Y167 A171 T172	E60-F169 HydrophobicContact CB-CE1 4.37Å; E60-F169 HydrophobicContact CG-CE1 3.53Å; E60-F169 HydrophobicContact CG-CZ 3.67Å; F63-F169 HydrophobicContact CD2-CD1 4.45Å; F63-F169 HydrophobicContact CD2-CE1 4.41Å; F63-F169 HydrophobicContact CE2-CD1 4.45Å; R165-F169 PolarHBondContact O-N 3.39Å; V166-F169 PolarHBondContact O-N 3.28Å; Y167-F169 VanDerWaalsContact C-N 3.32Å; Y167-F169 PolarHBondContact O-N 2.91Å; F169-A171 VanDerWaalsContact C-N 3.31Å; F169-A171 PolarHBondContact O-N 3.27Å; F169-T172 PolarHBondContact O-N 3.15Å
170	L	79.4	Confident	83.1	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-65.6	-33.7	179.7	-71.1	172.4	0	0	0	112.3	I107 V166 Y167 T172 F173 L174	I107-L170 HydrophobicContact CD1-CD1 3.42Å; I107-L170 VanDerWaalsContact CD1-CD1 3.42Å; I107-L170 HydrophobicContact CG1-CD1 3.99Å; I107-L170 HydrophobicContact CG2-CD1 4.13Å; V166-L170 HydrophobicContact CG1-CD1 3.82Å; V166-L170 HydrophobicContact CG1-CG 4.44Å; V166-L170 WeakPolarHBondContact O-CB 3.33Å; V166-L170 WeakPolarHBondContact O-CG 3.24Å; V166-L170 PolarHBondContact O-N 3.42Å; Y167-L170 PolarHBondContact O-N 3.25Å; L170-T172 VanDerWaalsContact C-N 3.26Å; L170-T172 PolarHBondContact O-N 3.14Å; L170-F173 PolarHBondContact O-N 3.31Å; L170-L174 HydrophobicContact CB-CD1 4.06Å; L170-L174 VanDerWaalsContact O-CB 3.22Å; L170-L174 WeakPolarHBondContact O-CB 3.41Å; L170-L174 WeakPolarHBondContact O-CG 3.16Å; L170-L174 PolarHBondContact O-N 3.26Å
171	A	83.6	Confident	83.6	Confident	20 Å²	20	65.6 Å²	65.6	17%	0.165	36%	0.356	C	S	.	.	H	α-helix	trans	-55.4	-42.5	177	0	0	0	0	0	111.6	F159 Y167 F169 F173 T175	F159-A171 HydrophobicContact CD2-CB 4.43Å; F159-A171 HydrophobicContact CE2-CB 3.58Å; F159-A171 HydrophobicContact CZ-CB 4.23Å; Y167-A171 WeakPolarHBondContact O-CA 3.4Å; Y167-A171 WeakPolarHBondContact O-CB 3.46Å; Y167-A171 PolarHBondContact O-N 3.31Å; F169-A171 VanDerWaalsContact C-N 3.31Å; F169-A171 PolarHBondContact O-N 3.27Å; A171-F173 PolarHBondContact O-N 2.96Å; A171-T175 WeakPolarHBondContact O-CB 3.49Å; A171-T175 WeakPolarHBondContact O-CG2 3.28Å; A171-T175 PolarHBondContact O-N 3.29Å; A171-T175 PolarHBondContact O-OG1 2.75Å
172	T	81.7	Confident	84.3	Confident	98 Å²	98	62.7 Å²	62.7	60%	0.601	33%	0.326	S	S	*	.	H	α-helix	trans	-62.9	-44.7	-176.9	-55.2	0	0	0	0	111.7	D168 F169 L170 T175 T176	D168-T172 PolarHBondContact O-OG1 3.31Å; F169-T172 PolarHBondContact O-N 3.15Å; L170-T172 VanDerWaalsContact C-N 3.26Å; L170-T172 PolarHBondContact O-N 3.14Å; T172-T175 PolarHBondContact O-OG1 2.91Å; T172-T175 VanDerWaalsContact O-OG1 3.11Å; T172-T176 PolarHBondContact O-OG1 3.4Å
173	F	83.3	Confident	85	Confident	85 Å²	85	57.9 Å²	57.9	37%	0.373	30%	0.295	S	S	.	.	H	α-helix	trans	-73.6	-48.7	178.5	175.6	-91	0	0	0	111.9	Y65 L170 A171 T175 T176 G177	Y65-F173 HydrophobicContact CE1-CD1 4.39Å; Y65-F173 AromaticContact CE1-CE1 3.94Å; Y65-F173 HydrophobicContact CE1-CE1 3.94Å; Y65-F173 HydrophobicContact CE2-CE1 4.49Å; Y65-F173 AromaticContact CZ-CE1 3.62Å; Y65-F173 WeakPolarHBondContact OH-CE1 3.43Å; L170-F173 PolarHBondContact O-N 3.31Å; A171-F173 PolarHBondContact O-N 2.96Å; F173-T175 PolarHBondContact O-N 2.83Å; F173-T176 WeakPolarHBondContact O-CB 3.31Å; F173-T176 PolarHBondContact O-N 3.39Å; F173-T176 VanDerWaalsContact O-N 3.14Å; F173-G177 PolarHBondContact O-N 2.72Å
174	L	85.6	Confident	85.8	Confident	4 Å²	4	59 Å²	59	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-65.3	-37.9	-176.2	-67.9	176.9	0	0	0	112.5	Y65 I67 M157 F159 L170 T176 G177 M178	Y65-L174 HydrophobicContact CD2-CD2 3.94Å; Y65-L174 HydrophobicContact CE2-CD2 3.84Å; I67-L174 HydrophobicContact CD1-CD1 3.7Å; I67-L174 HydrophobicContact CD1-CD2 3.28Å; I67-L174 HydrophobicContact CD1-CG 4Å; M157-L174 VanDerWaalsContact CE-C 3.47Å; M157-L174 HydrophobicContact CE-CB 4.04Å; M157-L174 VanDerWaalsContact CE-O 3.3Å; M157-L174 WeakPolarHBondContact CE-O 3.38Å; M157-L174 HydrophobicContact SD-CB 3.68Å; F159-L174 HydrophobicContact CE1-CD1 4.25Å; F159-L174 HydrophobicContact CZ-CD1 4.02Å; L170-L174 HydrophobicContact CB-CD1 4.06Å; L170-L174 VanDerWaalsContact O-CB 3.22Å; L170-L174 WeakPolarHBondContact O-CB 3.41Å; L170-L174 WeakPolarHBondContact O-CG 3.16Å; L170-L174 PolarHBondContact O-N 3.26Å; L174-T176 VanDerWaalsContact C-N 3.3Å; L174-T176 PolarHBondContact O-N 2.96Å; L174-G177 PolarHBondContact O-N 2.98Å; L174-M178 VanDerWaalsContact O-CB 3.26Å; L174-M178 WeakPolarHBondContact O-CB 3.28Å; L174-M178 PolarHBondContact O-N 2.56Å
175	T	90.1	Very high	86.5	Confident	25 Å²	25	60 Å²	60	15%	0.153	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-39.6	174	51.8	0	0	0	0	111.8	M155 M157 A171 T172 F173 R179	M155-T175 HydrophobicContact CG-CG2 4.47Å; M155-T175 WeakPolarHBondContact O-CG2 3.48Å; M157-T175 HydrophobicContact CB-CG2 4.12Å; M157-T175 HydrophobicContact CE-CG2 4.19Å; M157-T175 HydrophobicContact CG-CG2 3.66Å; M157-T175 HydrophobicContact SD-CG2 3.74Å; A171-T175 WeakPolarHBondContact O-CB 3.49Å; A171-T175 WeakPolarHBondContact O-CG2 3.28Å; A171-T175 PolarHBondContact O-N 3.29Å; A171-T175 PolarHBondContact O-OG1 2.75Å; T172-T175 PolarHBondContact O-OG1 2.91Å; T172-T175 VanDerWaalsContact O-OG1 3.11Å; F173-T175 PolarHBondContact O-N 2.83Å; T175-R179 WeakPolarHBondContact O-CB 3.33Å; T175-R179 PolarHBondContact O-N 2.95Å
176	T	88.9	Confident	87.3	Confident	79 Å²	79	49.2 Å²	49.2	49%	0.485	25%	0.253	S	S	.	.	H	α-helix	trans	-68	-49.3	178.1	-56.9	0	0	0	0	111.2	T172 F173 L174 R179 F180	T172-T176 PolarHBondContact O-OG1 3.4Å; F173-T176 WeakPolarHBondContact O-CB 3.31Å; F173-T176 PolarHBondContact O-N 3.39Å; F173-T176 VanDerWaalsContact O-N 3.14Å; L174-T176 VanDerWaalsContact C-N 3.3Å; L174-T176 PolarHBondContact O-N 2.96Å; T176-R179 PolarHBondContact O-N 2.88Å; T176-F180 PolarHBondContact O-N 2.95Å
177	G	88.8	Confident	88.2	Confident	24 Å²	24	49.1 Å²	49.1	25%	0.247	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-47.9	178.8	0	0	0	0	0	112.5	F173 L174 R179 F180 L181	F173-G177 PolarHBondContact O-N 2.72Å; L174-G177 PolarHBondContact O-N 2.98Å; G177-R179 PolarHBondContact O-N 2.89Å; G177-F180 WeakPolarHBondContact O-CB 3.47Å; G177-F180 PolarHBondContact O-N 2.86Å; G177-L181 WeakPolarHBondContact O-CG 3.42Å; G177-L181 PolarHBondContact O-N 3.02Å
178	M	89	Confident	88.8	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-66.9	-38.1	178.4	-83.3	-58.6	-68.2	0	0	113.4	M56 V70 L101 M155 M157 L174 F180 L181 L182	M56-M178 HydrophobicContact CE-CG 3.5Å; M56-M178 HydrophobicContact CE-SD 3.02Å; M56-M178 WeakPolarHBondContact CE-SD 3.48Å; M56-M178 HydrophobicContact SD-CG 3.96Å; M56-M178 HydrophobicContact SD-SD 3.53Å; V70-M178 HydrophobicContact CG1-CE 3.77Å; V70-M178 HydrophobicContact CG2-CE 4.2Å; L101-M178 HydrophobicContact CD1-CE 4.5Å; M155-M178 HydrophobicContact CE-CB 3.6Å; M155-M178 HydrophobicContact CE-CE 4.44Å; M155-M178 HydrophobicContact CE-CG 4.3Å; M155-M178 HydrophobicContact SD-CB 3.4Å; M155-M178 WeakPolarHBondContact SD-CB 3.4Å; M157-M178 HydrophobicContact CE-CB 3.65Å; M157-M178 HydrophobicContact CE-CG 3.63Å; L174-M178 VanDerWaalsContact O-CB 3.26Å; L174-M178 WeakPolarHBondContact O-CB 3.28Å; L174-M178 PolarHBondContact O-N 2.56Å; M178-F180 VanDerWaalsContact C-N 3.28Å; M178-F180 PolarHBondContact O-N 2.7Å; M178-L181 PolarHBondContact O-N 3.39Å; M178-L182 VanDerWaalsContact O-CB 3.29Å; M178-L182 WeakPolarHBondContact O-CB 3.27Å; M178-L182 PolarHBondContact O-N 3.22Å
179	R	92.4	Very high	89.4	Confident	96 Å²	96	47.1 Å²	47.1	36%	0.362	25%	0.249	S	C	.	.	H	α-helix	trans	-59.7	-43.3	174	-176.2	-179.6	73.3	148.5	1.4	110.7	I152 G153 M155 T175 T176 G177 N183	I152-R179 HydrophobicContact CB-CG 3.96Å; I152-R179 HydrophobicContact CG2-CG 3.89Å; G153-R179 PolarHBondContact O-NH1 3.24Å; G153-R179 VanDerWaalsContact O-NH1 3.16Å; M155-R179 HydrophobicContact CB-CB 4.23Å; M155-R179 HydrophobicContact SD-CB 4.34Å; T175-R179 WeakPolarHBondContact O-CB 3.33Å; T175-R179 PolarHBondContact O-N 2.95Å; T176-R179 PolarHBondContact O-N 2.88Å; G177-R179 PolarHBondContact O-N 2.89Å; R179-N183 WeakPolarHBondContact O-CB 3.4Å; R179-N183 VanDerWaalsContact O-CG 3.3Å; R179-N183 PolarHBondContact O-N 3.43Å; R179-N183 PolarHBondContact O-ND2 2.76Å; R179-N183 VanDerWaalsContact O-ND2 3.13Å
180	F	91.2	Very high	90.1	Very high	118 Å²	118	43 Å²	43	52%	0.518	23%	0.231	S	C	.	.	H	α-helix	trans	-64.2	-48.4	177.7	178.3	-97.8	0	0	0	112.1	T176 G177 M178 N183 Q184	T176-F180 PolarHBondContact O-N 2.95Å; G177-F180 WeakPolarHBondContact O-CB 3.47Å; G177-F180 PolarHBondContact O-N 2.86Å; M178-F180 VanDerWaalsContact C-N 3.28Å; M178-F180 PolarHBondContact O-N 2.7Å; F180-N183 PolarHBondContact O-N 3.35Å; F180-Q184 VanDerWaalsContact CE1-CD 3.46Å; F180-Q184 HydrophobicContact CE1-CG 4.23Å; F180-Q184 HydrophobicContact CZ-CG 4.2Å; F180-Q184 PolarHBondContact O-N 3.34Å
181	L	89.9	Confident	90.9	Very high	35 Å²	35	45.6 Å²	45.6	18%	0.183	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-45.4	179.3	-70.5	175.6	0	0	0	112.3	P54 M56 G177 M178 N183 Q184 Q185	P54-L181 HydrophobicContact CG-CD1 4.5Å; P54-L181 HydrophobicContact CG-CD2 4.46Å; M56-L181 HydrophobicContact CG-CD1 3.62Å; M56-L181 HydrophobicContact SD-CD1 3.46Å; M56-L181 WeakPolarHBondContact SD-CD1 2.88Å; G177-L181 WeakPolarHBondContact O-CG 3.42Å; G177-L181 PolarHBondContact O-N 3.02Å; M178-L181 PolarHBondContact O-N 3.39Å; L181-N183 PolarHBondContact O-N 3.32Å; L181-Q184 PolarHBondContact O-N 3.3Å; L181-Q184 VanDerWaalsContact O-N 3.15Å; L181-Q185 WeakPolarHBondContact O-CG 3.09Å; L181-Q185 PolarHBondContact O-N 3Å; L181-Q185 VanDerWaalsContact O-N 3.07Å
182	L	91.3	Very high	91.5	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-62.7	-43.7	177.5	179.3	61.7	0	0	0	111.2	M53 I72 I99 L101 A122 I152 M178 Q184 Q185 I186	M53-L182 HydrophobicContact CE-CB 3.93Å; M53-L182 HydrophobicContact CE-CD1 3.21Å; M53-L182 HydrophobicContact CE-CG 4.13Å; I72-L182 HydrophobicContact CD1-CD1 4.3Å; I99-L182 HydrophobicContact CD1-CD2 3.98Å; L101-L182 HydrophobicContact CD1-CD2 3.89Å; A122-L182 HydrophobicContact CB-CD2 4.07Å; I152-L182 HydrophobicContact CD1-CB 3.93Å; I152-L182 HydrophobicContact CD1-CD2 3.54Å; I152-L182 HydrophobicContact CD1-CG 3.62Å; M178-L182 VanDerWaalsContact O-CB 3.29Å; M178-L182 WeakPolarHBondContact O-CB 3.27Å; M178-L182 PolarHBondContact O-N 3.22Å; L182-Q184 VanDerWaalsContact C-N 3.27Å; L182-Q184 PolarHBondContact O-N 2.85Å; L182-Q185 PolarHBondContact O-N 2.64Å; L182-Q185 VanDerWaalsContact O-N 3.13Å; L182-I186 HydrophobicContact CD1-CG1 4.46Å; L182-I186 HydrophobicContact CG-CD1 4.44Å; L182-I186 WeakPolarHBondContact O-CG1 3.36Å; L182-I186 PolarHBondContact O-N 2.89Å
183	N	92.7	Very high	92.1	Very high	39 Å²	39	44.6 Å²	44.6	21%	0.209	23%	0.231	C	C	.	.	H	α-helix	trans	-55.5	-43.3	172.9	-84.4	-33.9	0	0	0	111.9	S151 I152 R179 F180 L181 Q185	S151-N183 WeakPolarHBondContact CA-OD1 2.83Å; I152-N183 WeakPolarHBondContact CB-OD1 3.37Å; I152-N183 WeakPolarHBondContact CD1-OD1 3.48Å; I152-N183 WeakPolarHBondContact CG1-OD1 3.4Å; I152-N183 PolarHBondContact N-OD1 3.1Å; R179-N183 WeakPolarHBondContact O-CB 3.4Å; R179-N183 VanDerWaalsContact O-CG 3.3Å; R179-N183 PolarHBondContact O-N 3.43Å; R179-N183 PolarHBondContact O-ND2 2.76Å; R179-N183 VanDerWaalsContact O-ND2 3.13Å; F180-N183 PolarHBondContact O-N 3.35Å; L181-N183 PolarHBondContact O-N 3.32Å; N183-Q185 VanDerWaalsContact C-N 3.3Å; N183-Q185 PolarHBondContact O-N 3.29Å
184	Q	92.4	Very high	92.7	Very high	103 Å²	103	40.8 Å²	40.8	48%	0.481	22%	0.216	S	C	.	.	H	α-helix	trans	-67.8	-25.6	179.1	-82.1	-166.6	-27	0	0	114	F180 L181 L182 P188	F180-Q184 VanDerWaalsContact CE1-CD 3.46Å; F180-Q184 HydrophobicContact CE1-CG 4.23Å; F180-Q184 HydrophobicContact CZ-CG 4.2Å; F180-Q184 PolarHBondContact O-N 3.34Å; L181-Q184 PolarHBondContact O-N 3.3Å; L181-Q184 VanDerWaalsContact O-N 3.15Å; L182-Q184 VanDerWaalsContact C-N 3.27Å; L182-Q184 PolarHBondContact O-N 2.85Å; Q184-P188 WeakPolarHBondContact O-CD 3.35Å; Q184-P188 WeakPolarHBondContact O-CG 3.39Å
185	Q	93.3	Very high	93.2	Very high	57 Å²	57	43.6 Å²	43.6	27%	0.266	23%	0.23	S	C	.	.	H	α-helix	trans	-89.5	-22.7	-177.3	-68.6	-61.3	-25.7	0	0	114.2	I51 M53 L181 L182 N183 P188 A189	I51-Q185 HydrophobicContact CD1-CB 4.49Å; I51-Q185 HydrophobicContact CG2-CB 3.6Å; I51-Q185 HydrophobicContact CG2-CG 4.13Å; M53-Q185 HydrophobicContact CE-CB 4.12Å; M53-Q185 HydrophobicContact CE-CG 4.22Å; M53-Q185 HydrophobicContact SD-CB 4.34Å; M53-Q185 HydrophobicContact SD-CG 3.79Å; L181-Q185 WeakPolarHBondContact O-CG 3.09Å; L181-Q185 PolarHBondContact O-N 3Å; L181-Q185 VanDerWaalsContact O-N 3.07Å; L182-Q185 PolarHBondContact O-N 2.64Å; L182-Q185 VanDerWaalsContact O-N 3.13Å; N183-Q185 VanDerWaalsContact C-N 3.3Å; N183-Q185 PolarHBondContact O-N 3.29Å; Q185-P188 WeakPolarHBondContact O-CD 3.28Å; Q185-A189 PolarHBondContact O-N 2.85Å
186	I	94.6	Very high	93.4	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-60.6	-53.2	-179.4	-69.9	165	0	0	0	111.1	L48 V125 I127 A150 I152 L182 A189 M190	L48-I186 HydrophobicContact CD2-CG2 4.15Å; V125-I186 HydrophobicContact CG1-CD1 4.42Å; I127-I186 HydrophobicContact CD1-CG2 3.77Å; I127-I186 HydrophobicContact CG1-CG2 4.05Å; I127-I186 HydrophobicContact CG2-CG2 4.31Å; A150-I186 HydrophobicContact CB-CB 3.94Å; A150-I186 HydrophobicContact CB-CD1 4.35Å; A150-I186 HydrophobicContact CB-CG2 3.63Å; I152-I186 HydrophobicContact CD1-CD1 4.31Å; L182-I186 HydrophobicContact CD1-CG1 4.46Å; L182-I186 HydrophobicContact CG-CD1 4.44Å; L182-I186 WeakPolarHBondContact O-CG1 3.36Å; L182-I186 PolarHBondContact O-N 2.89Å; I186-A189 WeakPolarHBondContact O-CB 3.43Å; I186-A189 PolarHBondContact O-N 3.08Å; I186-M190 HydrophobicContact CG2-CG 4.3Å; I186-M190 WeakPolarHBondContact O-CG 3.49Å; I186-M190 PolarHBondContact O-N 3.34Å
187	C	96.6	Very high	93.6	Very high	22 Å²	22	43 Å²	43	15%	0.149	23%	0.225	C	C	.	.	H	α-helix	trans	-67.3	-39.6	-175.5	-75.7	0	0	0	0	114.8	C148 A189 M190 N191	C148-C187 HydrophobicContact CB-CB 3.7Å; C148-C187 WeakPolarHBondContact CB-SG 3Å; C148-C187 PolarHBondContact O-SG 3.44Å; C148-C187 WeakPolarHBondContact SG-CA 3.23Å; C148-C187 WeakPolarHBondContact SG-CB 3.26Å; C148-C187 CovalentContact SG-SG 2.06Å; C148-C187 PolarHBondContact SG-SG 3.45Å; C187-A189 VanDerWaalsContact C-N 3.3Å; C187-A189 PolarHBondContact O-N 2.89Å; C187-M190 PolarHBondContact O-N 3.33Å; C187-N191 WeakPolarHBondContact O-CB 3.23Å; C187-N191 PolarHBondContact O-N 2.7Å; C187-N191 PolarHBondContact O-ND2 3.4Å
188	P	96	Very high	93.8	Very high	66 Å²	66	43.2 Å²	43.2	43%	0.429	22%	0.221	S	C	.	.	H	α-helix	trans	-55.5	-41.9	169.3	-29.8	36.8	0	0	0	113.7	Q184 Q185 N191 H192	Q184-P188 WeakPolarHBondContact O-CD 3.35Å; Q184-P188 WeakPolarHBondContact O-CG 3.39Å; Q185-P188 WeakPolarHBondContact O-CD 3.28Å; P188-N191 PolarHBondContact O-N 3.45Å; P188-H192 PolarHBondContact O-N 3.02Å
189	A	95.3	Very high	94	Very high	17 Å²	17	43.8 Å²	43.8	14%	0.14	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-45.9	175.8	0	0	0	0	0	111.6	L48 I51 Q185 I186 C187 N191 H192 A193	L48-A189 HydrophobicContact CD2-CB 4.17Å; I51-A189 HydrophobicContact CD1-CB 3.95Å; I51-A189 HydrophobicContact CG1-CB 3.81Å; Q185-A189 PolarHBondContact O-N 2.85Å; I186-A189 WeakPolarHBondContact O-CB 3.43Å; I186-A189 PolarHBondContact O-N 3.08Å; C187-A189 VanDerWaalsContact C-N 3.3Å; C187-A189 PolarHBondContact O-N 2.89Å; A189-N191 VanDerWaalsContact C-N 3.33Å; A189-N191 PolarHBondContact O-N 2.82Å; A189-H192 PolarHBondContact O-N 2.95Å; A189-A193 WeakPolarHBondContact O-CB 3.16Å; A189-A193 PolarHBondContact O-N 3.45Å
190	M	95.8	Very high	94	Very high	12 Å²	12	40 Å²	40	6%	0.059	21%	0.212	C	C	.	.	H	α-helix	trans	-61.7	-39.8	175.6	-65.4	-58.9	-67.1	0	0	112.5	V44 L48 F92 I127 T129 I186 C187 A193 G194	V44-M190 HydrophobicContact CG1-CE 4.23Å; V44-M190 HydrophobicContact CG1-SD 3.85Å; V44-M190 HydrophobicContact CG2-CE 3.91Å; V44-M190 HydrophobicContact CG2-SD 4.3Å; L48-M190 HydrophobicContact CD2-CG 4.49Å; L48-M190 HydrophobicContact CD2-SD 4.21Å; F92-M190 HydrophobicContact CD1-CE 3.87Å; F92-M190 HydrophobicContact CE1-CE 4.13Å; I127-M190 HydrophobicContact CG2-CG 4.48Å; T129-M190 HydrophobicContact CG2-CE 4.32Å; I186-M190 HydrophobicContact CG2-CG 4.3Å; I186-M190 WeakPolarHBondContact O-CG 3.49Å; I186-M190 PolarHBondContact O-N 3.34Å; C187-M190 PolarHBondContact O-N 3.33Å; M190-A193 PolarHBondContact O-N 3.06Å; M190-G194 PolarHBondContact O-N 3.32Å
191	N	96.4	Very high	94	Very high	55 Å²	55	35 Å²	35	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-63.9	-44.5	176.6	-75	-13.9	0	0	0	111.2	I146 C187 P188 A189 L195	I146-N191 WeakPolarHBondContact CG2-OD1 3.38Å; C187-N191 WeakPolarHBondContact O-CB 3.23Å; C187-N191 PolarHBondContact O-N 2.7Å; C187-N191 PolarHBondContact O-ND2 3.4Å; P188-N191 PolarHBondContact O-N 3.45Å; A189-N191 VanDerWaalsContact C-N 3.33Å; A189-N191 PolarHBondContact O-N 2.82Å; N191-L195 VanDerWaalsContact O-CB 3.23Å; N191-L195 WeakPolarHBondContact O-CB 3.43Å; N191-L195 PolarHBondContact O-N 2.83Å
192	H	95.6	Very high	94	Very high	93 Å²	93	34.7 Å²	34.7	43%	0.431	19%	0.189	S	C	.	.	H	α-helix	trans	-61.2	-48	174.9	-178.1	71.8	0	0	0	111.2	P188 A189 G194 V196 L197	P188-H192 PolarHBondContact O-N 3.02Å; A189-H192 PolarHBondContact O-N 2.95Å; H192-G194 PolarHBondContact O-N 2.96Å; H192-V196 WeakPolarHBondContact O-CA 3.43Å; H192-V196 VanDerWaalsContact O-CB 3.26Å; H192-V196 WeakPolarHBondContact O-CB 3.46Å; H192-V196 PolarHBondContact O-N 2.88Å; H192-L197 PolarHBondContact O-N 3Å
193	A	95.1	Very high	94	Very high	4 Å²	4	38.9 Å²	38.9	3%	0.033	21%	0.208	C	C	.	.	I	π-helix	trans	-55.9	-48.9	179.6	0	0	0	0	0	111.9	F43 E47 A189 M190 L197 I198	F43-A193 HydrophobicContact CE1-CB 3.84Å; F43-A193 HydrophobicContact CZ-CB 3.97Å; E47-A193 HydrophobicContact CB-CB 4.46Å; E47-A193 HydrophobicContact CG-CB 3.93Å; A189-A193 WeakPolarHBondContact O-CB 3.16Å; A189-A193 PolarHBondContact O-N 3.45Å; M190-A193 PolarHBondContact O-N 3.06Å; A193-L197 VanDerWaalsContact O-CB 3.31Å; A193-L197 WeakPolarHBondContact O-CB 3.45Å; A193-L197 PolarHBondContact O-N 2.89Å; A193-I198 WeakPolarHBondContact O-CG1 3.26Å; A193-I198 PolarHBondContact O-N 3.24Å
194	G	94.9	Very high	93.7	Very high	5 Å²	5	38.3 Å²	38.3	5%	0.052	21%	0.206	C	C	.	.	I	π-helix	trans	-81.9	-40.5	-177.8	0	0	0	0	0	115	M190 H192	M190-G194 PolarHBondContact O-N 3.32Å; H192-G194 PolarHBondContact O-N 2.96Å
195	L	96	Very high	93.7	Very high	63 Å²	63	34.9 Å²	34.9	33%	0.33	19%	0.191	S	C	.	.	I	π-helix	trans	-80.5	-25.4	-176.4	-69.1	173.2	0	0	0	113.3	I143 I146 N191 N199	I143-L195 HydrophobicContact CG2-CD2 4.25Å; I146-L195 HydrophobicContact CD1-CD2 4.24Å; I146-L195 HydrophobicContact CD1-CG 3.79Å; I146-L195 HydrophobicContact CG1-CD2 4.01Å; I146-L195 HydrophobicContact CG1-CG 3.98Å; N191-L195 VanDerWaalsContact O-CB 3.23Å; N191-L195 WeakPolarHBondContact O-CB 3.43Å; N191-L195 PolarHBondContact O-N 2.83Å; L195-N199 WeakPolarHBondContact O-CB 3.46Å; L195-N199 PolarHBondContact O-ND2 3.36Å
196	V	94.4	Very high	93.3	Very high	76 Å²	76	33.5 Å²	33.5	46%	0.461	19%	0.187	S	C	.	.	I	π-helix	trans	-107.9	-61.7	-178.2	-175	0	0	0	0	110.2	H192 S200	H192-V196 WeakPolarHBondContact O-CA 3.43Å; H192-V196 VanDerWaalsContact O-CB 3.26Å; H192-V196 WeakPolarHBondContact O-CB 3.46Å; H192-V196 PolarHBondContact O-N 2.88Å; V196-S200 WeakPolarHBondContact O-CB 3.3Å; V196-S200 PolarHBondContact O-N 3.44Å
197	L	94.1	Very high	93.3	Very high	14 Å²	14	34.6 Å²	34.6	7%	0.073	19%	0.194	C	C	.	.	I	π-helix	trans	-71.8	-48.2	-169.8	-54.7	-178.9	0	0	0	112.5	F43 E47 H192 A193 N199 S200 L201 I474 I478	F43-L197 HydrophobicContact CE2-CD1 4.08Å; F43-L197 HydrophobicContact CZ-CB 4.03Å; F43-L197 HydrophobicContact CZ-CD1 3.9Å; E47-L197 VanDerWaalsContact CD-CD1 3.48Å; E47-L197 HydrophobicContact CG-CD1 4.44Å; E47-L197 WeakPolarHBondContact OE2-CD1 3.34Å; H192-L197 PolarHBondContact O-N 3Å; A193-L197 VanDerWaalsContact O-CB 3.31Å; A193-L197 WeakPolarHBondContact O-CB 3.45Å; A193-L197 PolarHBondContact O-N 2.89Å; L197-N199 VanDerWaalsContact C-N 3.35Å; L197-N199 PolarHBondContact O-N 2.91Å; L197-S200 WeakPolarHBondContact O-CB 3.27Å; L197-S200 PolarHBondContact O-N 3.22Å; L197-L201 PolarHBondContact O-N 3.35Å; L197-I474 HydrophobicContact CB-CD1 4.22Å; L197-I474 HydrophobicContact CB-CG2 4.13Å; L197-I474 HydrophobicContact CD2-CG2 4.22Å; L197-I478 HydrophobicContact CD2-CD1 4.21Å
198	I	93.3	Very high	93.2	Very high	30 Å²	30	39 Å²	39	15%	0.154	21%	0.208	C	C	.	.	I	π-helix	trans	-65.5	-39.2	176.7	-61.7	-58.6	0	0	0	111.1	F43 I143 A193 S200 L201 L202 L470 I474	F43-I198 HydrophobicContact CD1-CD1 4.41Å; F43-I198 HydrophobicContact CE1-CD1 3.86Å; F43-I198 HydrophobicContact CE1-CG1 4.2Å; F43-I198 HydrophobicContact CZ-CD1 4.2Å; I143-I198 HydrophobicContact CG1-CG2 4.06Å; A193-I198 WeakPolarHBondContact O-CG1 3.26Å; A193-I198 PolarHBondContact O-N 3.24Å; I198-S200 VanDerWaalsContact C-N 3.34Å; I198-S200 PolarHBondContact O-N 3.46Å; I198-L201 WeakPolarHBondContact O-CB 3.37Å; I198-L201 PolarHBondContact O-N 3.09Å; I198-L201 VanDerWaalsContact O-N 3.15Å; I198-L202 HydrophobicContact CG2-CD1 4.25Å; I198-L202 HydrophobicContact CG2-CG 4.3Å; I198-L202 WeakPolarHBondContact O-CG 3.35Å; I198-L202 PolarHBondContact O-N 3.24Å; I198-L470 HydrophobicContact CD1-CD2 4.06Å; I198-I474 HydrophobicContact CD1-CD1 4.36Å
199	N	93.8	Very high	93	Very high	13 Å²	13	38.3 Å²	38.3	7%	0.07	20%	0.202	C	C	.	.	H	α-helix	trans	-62	-40.5	174.7	-86.5	-28	0	0	0	112.4	K142 I143 L195 L197 L201 L202 E203	K142-N199 WeakPolarHBondContact CG-OD1 3.18Å; I143-N199 WeakPolarHBondContact CB-OD1 3.48Å; I143-N199 PolarHBondContact N-OD1 2.82Å; I143-N199 PolarHBondContact O-ND2 3.02Å; L195-N199 WeakPolarHBondContact O-CB 3.46Å; L195-N199 PolarHBondContact O-ND2 3.36Å; L197-N199 VanDerWaalsContact C-N 3.35Å; L197-N199 PolarHBondContact O-N 2.91Å; N199-L201 PolarHBondContact O-N 3.41Å; N199-L202 PolarHBondContact O-N 3.46Å; N199-L202 VanDerWaalsContact O-N 3.11Å; N199-E203 WeakPolarHBondContact O-CG 3.41Å; N199-E203 PolarHBondContact O-N 3.24Å
200	S	91.6	Very high	93	Very high	16 Å²	16	44.4 Å²	44.4	11%	0.112	23%	0.228	C	C	.	.	H	α-helix	trans	-57.6	-39.1	173.8	-178.7	0	0	0	0	111.9	V196 L197 I198 E203	V196-S200 WeakPolarHBondContact O-CB 3.3Å; V196-S200 PolarHBondContact O-N 3.44Å; L197-S200 WeakPolarHBondContact O-CB 3.27Å; L197-S200 PolarHBondContact O-N 3.22Å; I198-S200 VanDerWaalsContact C-N 3.34Å; I198-S200 PolarHBondContact O-N 3.46Å; S200-E203 PolarHBondContact O-N 2.93Å
201	L	90.4	Very high	92.9	Very high	13 Å²	13	46 Å²	46	7%	0.068	24%	0.238	C	C	.	.	H	α-helix	trans	-66.4	-45.8	173	176.8	64.2	0	0	0	112.6	L197 I198 N199 E203 T204 A441 L470 M473 I474	L197-L201 PolarHBondContact O-N 3.35Å; I198-L201 WeakPolarHBondContact O-CB 3.37Å; I198-L201 PolarHBondContact O-N 3.09Å; I198-L201 VanDerWaalsContact O-N 3.15Å; N199-L201 PolarHBondContact O-N 3.41Å; L201-E203 PolarHBondContact O-N 3.46Å; L201-T204 VanDerWaalsContact O-CB 3.3Å; L201-T204 WeakPolarHBondContact O-CB 3.32Å; L201-T204 WeakPolarHBondContact O-CG2 3.33Å; L201-T204 PolarHBondContact O-N 2.65Å; L201-T204 PolarHBondContact O-OG1 2.98Å; L201-A441 HydrophobicContact CD1-CB 4.33Å; L201-L470 HydrophobicContact CD2-CD1 3.31Å; L201-M473 HydrophobicContact CD1-CB 3.71Å; L201-M473 HydrophobicContact CD1-CE 3.66Å; L201-M473 HydrophobicContact CD2-CE 4.21Å; L201-M473 HydrophobicContact CG-CE 4.49Å; L201-I474 HydrophobicContact CB-CG1 4.01Å
202	L	91.6	Very high	92.8	Very high	28 Å²	28	45.1 Å²	45.1	15%	0.147	23%	0.233	C	C	.	.	H	α-helix	trans	-61.7	-29.5	179.5	-67.3	177.4	0	0	0	112.1	L141 I143 I198 N199 T204 I205	L141-L202 HydrophobicContact CD2-CD2 4.03Å; L141-L202 HydrophobicContact CG-CD1 4.28Å; I143-L202 HydrophobicContact CD1-CD1 3.97Å; I143-L202 HydrophobicContact CG1-CD1 3.94Å; I198-L202 HydrophobicContact CG2-CD1 4.25Å; I198-L202 HydrophobicContact CG2-CG 4.3Å; I198-L202 WeakPolarHBondContact O-CG 3.35Å; I198-L202 PolarHBondContact O-N 3.24Å; N199-L202 PolarHBondContact O-N 3.46Å; N199-L202 VanDerWaalsContact O-N 3.11Å; L202-T204 PolarHBondContact O-N 3.45Å; L202-I205 HydrophobicContact CD2-CD1 3.92Å; L202-I205 WeakPolarHBondContact O-CB 3.32Å; L202-I205 WeakPolarHBondContact O-CG1 3.3Å; L202-I205 PolarHBondContact O-N 2.78Å; L202-I205 VanDerWaalsContact O-N 3.07Å
203	E	89.4	Confident	92.8	Very high	89 Å²	89	48 Å²	48	42%	0.416	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-17.1	172.9	-71.8	-173.5	151.9	0	0	114	R140 N199 S200 L201 I205	R140-E203 IonicContact CZ-OE1 2.72Å; R140-E203 IonicContact NH1-OE1 2.98Å; R140-E203 PolarHBondContact NH1-OE1 3.39Å; R140-E203 IonicContact NH2-OE1 3.55Å; N199-E203 WeakPolarHBondContact O-CG 3.41Å; N199-E203 PolarHBondContact O-N 3.24Å; S200-E203 PolarHBondContact O-N 2.93Å; L201-E203 PolarHBondContact O-N 3.46Å; E203-I205 PolarHBondContact O-N 3.04Å
204	T	88.1	Confident	92.8	Very high	27 Å²	27	51.3 Å²	51.3	17%	0.166	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-17.1	172.4	71.1	0	0	0	0	112.6	L201 L202 P206 K477	L201-T204 VanDerWaalsContact O-CB 3.3Å; L201-T204 WeakPolarHBondContact O-CB 3.32Å; L201-T204 WeakPolarHBondContact O-CG2 3.33Å; L201-T204 PolarHBondContact O-N 2.65Å; L201-T204 PolarHBondContact O-OG1 2.98Å; L202-T204 PolarHBondContact O-N 3.45Å; T204-P206 WeakPolarHBondContact O-CD 3.38Å; T204-K477 HydrophobicContact CG2-CB 4.06Å; T204-K477 HydrophobicContact CG2-CD 3.91Å; T204-K477 HydrophobicContact CG2-CG 3.91Å
205	I	90.8	Very high	92.9	Very high	31 Å²	31	51.1 Å²	51.1	16%	0.159	25%	0.254	C	S	.	.	S	Bend	trans	-73.1	118.6	179.9	-58	175.4	0	0	0	108.3	L202 E203 V207 P439 A441	L202-I205 HydrophobicContact CD2-CD1 3.92Å; L202-I205 WeakPolarHBondContact O-CB 3.32Å; L202-I205 WeakPolarHBondContact O-CG1 3.3Å; L202-I205 PolarHBondContact O-N 2.78Å; L202-I205 VanDerWaalsContact O-N 3.07Å; E203-I205 PolarHBondContact O-N 3.04Å; I205-V207 PolarHBondContact O-N 3.21Å; I205-P439 HydrophobicContact CG2-CB 3.82Å; I205-A441 HydrophobicContact CD1-CB 4.43Å; I205-A441 HydrophobicContact CG1-CB 4.06Å
206	P	86.7	Confident	92.9	Very high	28 Å²	28	48.1 Å²	48.1	18%	0.182	24%	0.238	C	C	.	.			trans	-68	125.6	-176.6	25.7	-32.9	0	0	0	111	T204 T209	T204-P206 WeakPolarHBondContact O-CD 3.38Å; P206-T209 HydrophobicContact CB-CG2 3.29Å; P206-T209 HydrophobicContact CG-CG2 4.4Å
207	V	93.1	Very high	93	Very high	25 Å²	25	44.6 Å²	44.6	15%	0.152	22%	0.217	C	C	.	.	S	Bend	trans	-89.7	-53.5	170.6	168.1	0	0	0	0	111	R140 I205 Y219 S220	R140-V207 HydrophobicContact CB-CG2 4.14Å; R140-V207 HydrophobicContact CG-CB 4.35Å; R140-V207 HydrophobicContact CG-CG2 3.44Å; R140-V207 VanDerWaalsContact CG-CG2 3.44Å; I205-V207 PolarHBondContact O-N 3.21Å; V207-Y219 WeakPolarHBondContact O-CA 3.38Å; V207-Y219 PolarHBondContact O-N 3.3Å; V207-S220 WeakPolarHBondContact CG1-OG 3.31Å
208	R	94.4	Very high	93.2	Very high	115 Å²	115	44.2 Å²	44.2	43%	0.434	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.3	171.2	-68	-176.2	71.7	163.7	-9.3	109.6	I217 D218 F241 E246	R208-I217 VanDerWaalsContact CA-O 3.31Å; R208-I217 WeakPolarHBondContact CA-O 3.21Å; R208-D218 HydrophobicContact CG-CB 3.98Å; R208-D218 IonicContact CZ-OD2 2.63Å; R208-D218 IonicContact NE-OD2 2.65Å; R208-D218 IonicContact NH1-OD2 2.66Å; R208-F241 VanDerWaalsContact NH2-CE2 3.34Å; R208-E246 IonicContact CZ-OE2 3.84Å; R208-E246 IonicContact NH2-OE2 2.63Å; R208-E246 PolarHBondContact NH2-OE2 3.38Å
209	T	92.7	Very high	93.3	Very high	51 Å²	51	42.9 Å²	42.9	31%	0.313	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	144.6	-179.9	48.2	0	0	0	0	111.8	P206 G216 I217	P206-T209 HydrophobicContact CB-CG2 3.29Å; P206-T209 HydrophobicContact CG-CG2 4.4Å; T209-G216 CarbonylContact O-C 3.46Å; T209-G216 WeakPolarHBondContact O-CA 3.45Å; T209-I217 PolarHBondContact N-O 3.26Å; T209-I217 PolarHBondContact O-N 2.93Å; T209-I217 WeakPolarHBondContact OG1-CG2 3.38Å
210	E	94.9	Very high	93.5	Very high	145 Å²	145	43 Å²	43	68%	0.678	21%	0.211	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-67.4	131.6	168.3	-61.6	-179.1	-178.5	0	0	110	L243	E210-L243 HydrophobicContact CG-CD1 4.14Å; E210-L243 HydrophobicContact CG-CD2 4.16Å
211	V	94.1	Very high	93.7	Very high	46 Å²	46	42.6 Å²	42.6	28%	0.279	21%	0.207	S	C	.	.	S	Bend	trans	-86.5	-43.7	172.8	175.8	0	0	0	0	109.1	V215 I217 F240 V436	V211-V215 HydrophobicContact CB-CG2 4.04Å; V211-V215 WeakPolarHBondContact CB-O 3.24Å; V211-V215 HydrophobicContact CG1-CG2 4.49Å; V211-V215 PolarHBondContact N-O 2.91Å; V211-I217 HydrophobicContact CG2-CB 3.95Å; V211-I217 HydrophobicContact CG2-CG2 3.79Å; V211-F240 HydrophobicContact CG2-CD1 4.24Å; V211-F240 HydrophobicContact CG2-CE1 3.94Å; V211-V436 HydrophobicContact CG1-CG1 3.8Å; V211-V436 HydrophobicContact CG2-CG1 4.34Å
212	D	93.9	Very high	94	Very high	35 Å²	35	43.5 Å²	43.5	19%	0.187	21%	0.212	C	C	.	.	S	Bend	trans	-154.4	-169.6	171.7	62.9	34.9	0	0	0	109.8	Y214 V215 L243 Y282	D212-Y214 PolarHBondContact O-N 3.2Å; D212-Y214 VanDerWaalsContact O-N 3.09Å; D212-Y214 WeakPolarHBondContact OD1-CA 3.44Å; D212-Y214 WeakPolarHBondContact OD1-CB 3.5Å; D212-Y214 PolarHBondContact OD1-N 2.79Å; D212-V215 PolarHBondContact N-O 3.15Å; D212-V215 PolarHBondContact OD1-N 2.84Å; D212-V215 VanDerWaalsContact OD1-N 3.13Å; D212-L243 WeakPolarHBondContact O-CD1 3.42Å; D212-Y282 VanDerWaalsContact OD2-CE1 3.3Å; D212-Y282 WeakPolarHBondContact OD2-CE1 3.43Å; D212-Y282 PolarHBondContact OD2-OH 3.4Å
213	K	94.8	Very high	94.1	Very high	155 Å²	155	44.6 Å²	44.6	67%	0.674	22%	0.221	S	C	*	.	S	Bend	trans	-67.5	-3.8	-178.5	69	-179.5	-173.9	172.6	0	115.5
214	Y	95.5	Very high	94.4	Very high	73 Å²	73	44.2 Å²	44.2	29%	0.286	22%	0.222	S	C	.	.	S	Bend	trans	-113.3	-39.4	-177.7	-58.1	-71.7	0	0	0	112.6	D212 L243 A285 I287 W431	D212-Y214 PolarHBondContact O-N 3.2Å; D212-Y214 VanDerWaalsContact O-N 3.09Å; D212-Y214 WeakPolarHBondContact OD1-CA 3.44Å; D212-Y214 WeakPolarHBondContact OD1-CB 3.5Å; D212-Y214 PolarHBondContact OD1-N 2.79Å; Y214-L243 PolarHBondContact O-N 2.73Å; Y214-A285 HydrophobicContact CD1-CB 4.47Å; Y214-I287 HydrophobicContact CD1-CG2 3.66Å; Y214-I287 HydrophobicContact CD2-CG2 3.99Å; Y214-I287 HydrophobicContact CE1-CG2 3.61Å; Y214-I287 HydrophobicContact CE2-CG2 3.94Å; Y214-I287 HydrophobicContact CG-CG2 3.83Å; Y214-W431 HydrophobicContact CE2-CH2 4.12Å
215	V	96.8	Very high	94.8	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	144.6	-172.3	-53.9	0	0	0	0	112.7	V211 D212 F240 F241 Y282	V211-V215 HydrophobicContact CB-CG2 4.04Å; V211-V215 WeakPolarHBondContact CB-O 3.24Å; V211-V215 HydrophobicContact CG1-CG2 4.49Å; V211-V215 PolarHBondContact N-O 2.91Å; D212-V215 PolarHBondContact N-O 3.15Å; D212-V215 PolarHBondContact OD1-N 2.84Å; D212-V215 VanDerWaalsContact OD1-N 3.13Å; V215-F240 HydrophobicContact CG2-CD1 4.37Å; V215-F241 CarbonylContact C-O 3.57Å; V215-F241 VanDerWaalsContact CA-O 3.29Å; V215-F241 WeakPolarHBondContact CA-O 3.47Å; V215-F241 WeakPolarHBondContact CB-O 3.26Å; V215-Y282 HydrophobicContact CB-CE1 4.33Å; V215-Y282 HydrophobicContact CG1-CD1 3.63Å; V215-Y282 HydrophobicContact CG1-CD2 4.27Å; V215-Y282 HydrophobicContact CG1-CE1 3.76Å; V215-Y282 HydrophobicContact CG1-CE2 4.37Å; V215-Y282 HydrophobicContact CG1-CG 3.93Å; V215-Y282 HydrophobicContact CG2-CD1 4.29Å; V215-Y282 HydrophobicContact CG2-CD2 4.35Å; V215-Y282 HydrophobicContact CG2-CE1 3.61Å; V215-Y282 HydrophobicContact CG2-CE2 3.66Å; V215-Y282 WeakPolarHBondContact CG2-OH 3.45Å
216	G	96.7	Very high	95.1	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	169.8	167.4	0	0	0	0	0	111.8	T209 F240 F241	T209-G216 CarbonylContact O-C 3.46Å; T209-G216 WeakPolarHBondContact O-CA 3.45Å; G216-F240 CarbonylContact O-C 3.59Å; G216-F240 VanDerWaalsContact O-CA 3.25Å; G216-F240 WeakPolarHBondContact O-CA 3.34Å; G216-F241 PolarHBondContact N-O 3.45Å; G216-F241 PolarHBondContact O-N 2.91Å
217	I	97.1	Very high	95.5	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	140.9	174.1	-171.6	162.4	0	0	0	110.6	R208 T209 V211 Y219 M239 F240 F274	R208-I217 VanDerWaalsContact CA-O 3.31Å; R208-I217 WeakPolarHBondContact CA-O 3.21Å; T209-I217 PolarHBondContact N-O 3.26Å; T209-I217 PolarHBondContact O-N 2.93Å; T209-I217 WeakPolarHBondContact OG1-CG2 3.38Å; V211-I217 HydrophobicContact CG2-CB 3.95Å; V211-I217 HydrophobicContact CG2-CG2 3.79Å; I217-Y219 HydrophobicContact CB-CE2 4.42Å; I217-Y219 HydrophobicContact CD1-CD2 4.36Å; I217-Y219 HydrophobicContact CD1-CE1 3.9Å; I217-Y219 HydrophobicContact CD1-CE2 3.51Å; I217-Y219 VanDerWaalsContact CD1-OH 3.25Å; I217-Y219 WeakPolarHBondContact CD1-OH 3.37Å; I217-Y219 HydrophobicContact CG1-CD2 4.14Å; I217-Y219 HydrophobicContact CG1-CE1 4.37Å; I217-Y219 HydrophobicContact CG1-CE2 3.75Å; I217-Y219 HydrophobicContact CG2-CD2 4.17Å; I217-Y219 HydrophobicContact CG2-CE2 3.78Å; I217-M239 CarbonylContact C-O 3.53Å; I217-M239 WeakPolarHBondContact CA-O 3.4Å; I217-F240 HydrophobicContact CB-CD1 4.23Å; I217-F240 HydrophobicContact CB-CE1 4.37Å; I217-F240 HydrophobicContact CD1-CD1 4.38Å; I217-F240 HydrophobicContact CD1-CD2 4.09Å; I217-F240 HydrophobicContact CD1-CE1 3.96Å; I217-F240 HydrophobicContact CD1-CE2 3.61Å; I217-F240 HydrophobicContact CD1-CG 4.46Å; I217-F240 HydrophobicContact CD1-CZ 3.57Å; I217-F240 HydrophobicContact CG1-CD2 4.4Å; I217-F240 HydrophobicContact CG1-CE2 4.4Å; I217-F240 HydrophobicContact CG1-CG 4.46Å; I217-F240 HydrophobicContact CG1-CZ 4.49Å; I217-F274 HydrophobicContact CD1-CE2 3.79Å; I217-F274 HydrophobicContact CD1-CZ 4.07Å
218	D	97	Very high	95.6	Very high	7 Å²	7	46.2 Å²	46.2	4%	0.037	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	113	179.6	-173.5	-21.4	0	0	0	110.3	R208 S220 R237 G238 M239 F241	R208-D218 HydrophobicContact CG-CB 3.98Å; R208-D218 IonicContact CZ-OD2 2.63Å; R208-D218 IonicContact NE-OD2 2.65Å; R208-D218 IonicContact NH1-OD2 2.66Å; D218-S220 VanDerWaalsContact OD1-CB 3.24Å; D218-S220 WeakPolarHBondContact OD1-CB 3.38Å; D218-S220 PolarHBondContact OD1-N 3.28Å; D218-S220 PolarHBondContact OD1-OG 2.63Å; D218-S220 VanDerWaalsContact OD1-OG 3.13Å; D218-R237 IonicContact OD2-NE 3.42Å; D218-G238 VanDerWaalsContact O-CA 3.31Å; D218-G238 WeakPolarHBondContact O-CA 3.35Å; D218-G238 PolarHBondContact O-N 3.25Å; D218-M239 HydrophobicContact CB-CE 4.29Å; D218-M239 PolarHBondContact N-O 2.78Å; D218-M239 PolarHBondContact O-N 2.82Å; D218-F241 HydrophobicContact CB-CD1 4.27Å; D218-F241 HydrophobicContact CB-CE1 4.2Å
219	Y	96.7	Very high	95.6	Very high	1 Å²	1	44.5 Å²	44.5	0%	0.004	24%	0.241	C	C	.	.			trans	-111.7	34.1	172.8	-65.3	-67.4	0	0	0	111.4	C24 V207 I217 L221 F236 F274 S437 P439	C24-Y219 HydrophobicContact CB-CE1 4.39Å; V207-Y219 WeakPolarHBondContact O-CA 3.38Å; V207-Y219 PolarHBondContact O-N 3.3Å; I217-Y219 HydrophobicContact CB-CE2 4.42Å; I217-Y219 HydrophobicContact CD1-CD2 4.36Å; I217-Y219 HydrophobicContact CD1-CE1 3.9Å; I217-Y219 HydrophobicContact CD1-CE2 3.51Å; I217-Y219 VanDerWaalsContact CD1-OH 3.25Å; I217-Y219 WeakPolarHBondContact CD1-OH 3.37Å; I217-Y219 HydrophobicContact CG1-CD2 4.14Å; I217-Y219 HydrophobicContact CG1-CE1 4.37Å; I217-Y219 HydrophobicContact CG1-CE2 3.75Å; I217-Y219 HydrophobicContact CG2-CD2 4.17Å; I217-Y219 HydrophobicContact CG2-CE2 3.78Å; Y219-L221 PolarHBondContact O-N 2.79Å; Y219-F236 HydrophobicContact CD1-CB 4.48Å; Y219-F236 WeakPolarHBondContact O-CD1 3.29Å; Y219-F274 AromaticContact CE1-CE2 3.86Å; Y219-F274 HydrophobicContact CE1-CE2 3.86Å; Y219-S437 VanDerWaalsContact CE2-O 3.24Å; Y219-S437 WeakPolarHBondContact CE2-O 3.4Å; Y219-S437 PolarHBondContact OH-O 2.84Å; Y219-P439 HydrophobicContact CD1-CG 3.73Å; Y219-P439 HydrophobicContact CD2-CB 4.11Å; Y219-P439 HydrophobicContact CD2-CG 4.12Å; Y219-P439 HydrophobicContact CE1-CG 4.14Å; Y219-P439 HydrophobicContact CE2-CG 4.48Å; Y219-P439 HydrophobicContact CG-CB 4.02Å; Y219-P439 HydrophobicContact CG-CG 3.71Å
220	S	96.7	Very high	95.7	Very high	17 Å²	17	49.3 Å²	49.3	12%	0.119	25%	0.254	C	S	.	.			trans	-59.7	135.8	166.7	-72.1	0	0	0	0	109.7	L138 V207 D218 R237	L138-S220 PolarHBondContact O-OG 2.93Å; V207-S220 WeakPolarHBondContact CG1-OG 3.31Å; D218-S220 VanDerWaalsContact OD1-CB 3.24Å; D218-S220 WeakPolarHBondContact OD1-CB 3.38Å; D218-S220 PolarHBondContact OD1-N 3.28Å; D218-S220 PolarHBondContact OD1-OG 2.63Å; D218-S220 VanDerWaalsContact OD1-OG 3.13Å; S220-R237 WeakPolarHBondContact O-CB 3.42Å; S220-R237 PolarHBondContact O-N 2.89Å
221	L	96.9	Very high	95.8	Very high	6 Å²	6	42.4 Å²	42.4	3%	0.031	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-60.5	139.7	169.4	-74.9	171.4	0	0	0	110	K135 G139 L141 Y219 M234 F236	K135-L221 HydrophobicContact CB-CB 4.21Å; K135-L221 HydrophobicContact CB-CD1 4.21Å; K135-L221 HydrophobicContact CD-CB 3.63Å; K135-L221 WeakPolarHBondContact CD-O 3.27Å; K135-L221 HydrophobicContact CG-CB 3.74Å; K135-L221 HydrophobicContact CG-CD1 4.35Å; G139-L221 PolarHBondContact O-N 2.98Å; L141-L221 HydrophobicContact CB-CD1 3.94Å; L141-L221 HydrophobicContact CD1-CD1 4.24Å; Y219-L221 PolarHBondContact O-N 2.79Å; L221-M234 HydrophobicContact CD2-CB 3.96Å; L221-M234 HydrophobicContact CD2-CG 4.43Å; L221-F236 HydrophobicContact CD2-CD1 3.65Å; L221-F236 HydrophobicContact CD2-CE1 3.38Å; L221-F236 HydrophobicContact CD2-CE2 4.26Å; L221-F236 HydrophobicContact CD2-CG 4.27Å; L221-F236 HydrophobicContact CD2-CZ 3.72Å; L221-F236 HydrophobicContact CG-CD1 4.09Å; L221-F236 HydrophobicContact CG-CE1 3.79Å
222	L	95.6	Very high	95.9	Very high	33 Å²	33	40.6 Å²	40.6	17%	0.173	21%	0.21	C	C	.	.	S	Bend	trans	-85.7	-35.6	176.5	-64.1	178.3	0	0	0	111.2	E20 P22 K135 D235 R237	E20-L222 HydrophobicContact CG-CD2 4.44Å; P22-L222 HydrophobicContact CB-CD1 3.98Å; K135-L222 PolarHBondContact NZ-O 2.89Å; L222-D235 PolarHBondContact N-O 2.8Å; L222-R237 HydrophobicContact CD2-CB 3.89Å; L222-R237 HydrophobicContact CD2-CG 4.3Å; L222-R237 HydrophobicContact CG-CB 4.47Å
223	S	94.9	Very high	96	Very high	50 Å²	50	39.7 Å²	39.7	35%	0.35	21%	0.205	S	C	.	.	S	Bend	trans	-141.6	174.3	179.2	63.8	0	0	0	0	111.4
224	D	95.8	Very high	96.1	Very high	82 Å²	82	32.9 Å²	32.9	44%	0.439	18%	0.176	S	C	.	.			trans	-59.3	147.9	167.6	-67.8	-29.1	0	0	0	110.8	T134 K135	T134-D224 WeakPolarHBondContact CA-OD1 3.36Å; T134-D224 WeakPolarHBondContact CB-OD1 3.5Å; K135-D224 WeakPolarHBondContact CB-OD1 3.42Å; K135-D224 PolarHBondContact N-OD1 3.43Å
225	P	95.8	Very high	96.1	Very high	15 Å²	15	31 Å²	31	10%	0.097	17%	0.171	C	C	.	.			trans	-61.9	139.9	176.4	-20.1	31.6	0	0	0	112.1	M133 L141 L232 D233 M234	M133-P225 HydrophobicContact CB-CG 4.16Å; L141-P225 HydrophobicContact CD1-CG 3.46Å; L141-P225 VanDerWaalsContact CD1-CG 3.46Å; P225-L232 HydrophobicContact CB-CD1 3.43Å; P225-L232 VanDerWaalsContact CB-CD1 3.43Å; P225-D233 WeakPolarHBondContact CA-O 3.36Å; P225-M234 HydrophobicContact CB-CG 3.99Å; P225-M234 HydrophobicContact CG-CG 4.27Å
226	V	96	Very high	96.1	Very high	77 Å²	77	31.6 Å²	31.6	47%	0.467	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	114.4	-179.7	-179.7	0	0	0	0	109.4	D233	V226-D233 HydrophobicContact CB-CB 4.4Å; V226-D233 PolarHBondContact N-O 3.01Å; V226-D233 PolarHBondContact O-N 2.85Å
227	V	96.6	Very high	96.1	Very high	16 Å²	16	34.8 Å²	34.8	10%	0.097	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	121.7	178.3	-176.1	0	0	0	0	110.6	F84 Q85 G87 G89 M133 L232	F84-V227 HydrophobicContact CB-CG1 3.78Å; F84-V227 HydrophobicContact CD1-CG1 3.96Å; F84-V227 HydrophobicContact CG-CG1 4.21Å; Q85-V227 WeakPolarHBondContact O-CG1 3.03Å; G87-V227 PolarHBondContact N-O 2.98Å; G87-V227 VanDerWaalsContact N-O 3.09Å; G89-V227 WeakPolarHBondContact O-CG1 3.39Å; M133-V227 HydrophobicContact CE-CG2 3.77Å; V227-L232 HydrophobicContact CG2-CD1 3.78Å
228	T	95.6	Very high	96.1	Very high	45 Å²	45	34.7 Å²	34.7	28%	0.276	19%	0.185	S	C	.	.			trans	-108.7	177.6	170.9	77.2	0	0	0	0	110	F84 R230 S231	F84-T228 WeakPolarHBondContact CB-O 3.45Å; T228-R230 PolarHBondContact O-N 2.82Å; T228-R230 VanDerWaalsContact O-N 3.1Å; T228-R230 PolarHBondContact OG1-N 3.49Å; T228-S231 PolarHBondContact N-O 2.96Å; T228-S231 PolarHBondContact OG1-N 2.94Å; T228-S231 PolarHBondContact OG1-O 2.76Å; T228-S231 PolarHBondContact OG1-OG 2.94Å
229	S	94.3	Very high	96.1	Very high	79 Å²	79	35 Å²	35	55%	0.552	19%	0.187	S	C	*	.	S	Bend	trans	-68	-7.3	176.7	63.7	0	0	0	0	114.3
230	R	94.7	Very high	96.1	Very high	151 Å²	151	35.5 Å²	35.5	57%	0.57	19%	0.189	S	C	*	.	S	Bend	trans	-135.4	-7.9	-175.1	-65	-174.3	-179.7	-173	-0.2	114.5	T29 N30 F84 T228 Y262	T29-R230 WeakPolarHBondContact CA-O 3.49Å; N30-R230 PolarHBondContact N-O 3.34Å; N30-R230 WeakPolarHBondContact OD1-CA 3.26Å; N30-R230 PolarHBondContact OD1-O 3.41Å; F84-R230 VanDerWaalsContact CD2-C 3.46Å; F84-R230 WeakPolarHBondContact CE2-O 3.47Å; T228-R230 PolarHBondContact O-N 2.82Å; T228-R230 VanDerWaalsContact O-N 3.1Å; T228-R230 PolarHBondContact OG1-N 3.49Å; R230-Y262 HydrophobicContact CB-CD1 3.94Å; R230-Y262 HydrophobicContact CB-CE1 3.7Å
231	S	95.9	Very high	96.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	155.7	-178.4	61.9	0	0	0	0	114.2	I28 F84 T228 D233	I28-S231 CarbonylContact O-C 3.58Å; I28-S231 WeakPolarHBondContact O-CA 3.38Å; I28-S231 WeakPolarHBondContact O-CB 3.35Å; F84-S231 VanDerWaalsContact CE2-N 3.31Å; F84-S231 VanDerWaalsContact CZ-C 3.49Å; T228-S231 PolarHBondContact N-O 2.96Å; T228-S231 PolarHBondContact OG1-N 2.94Å; T228-S231 PolarHBondContact OG1-O 2.76Å; T228-S231 PolarHBondContact OG1-OG 2.94Å; S231-D233 PolarHBondContact OG-OD1 3.17Å
232	L	96.7	Very high	96.1	Very high	9 Å²	9	36.2 Å²	36.2	5%	0.047	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	115.9	161.6	165.6	67.3	0	0	0	107.7	R27 I28 F84 M133 P225 V227 M234	R27-L232 CarbonylContact C-O 3.32Å; R27-L232 WeakPolarHBondContact CA-O 3.45Å; I28-L232 HydrophobicContact CB-CB 4.46Å; I28-L232 HydrophobicContact CD1-CD2 4.36Å; I28-L232 PolarHBondContact N-O 2.86Å; I28-L232 PolarHBondContact O-N 2.97Å; F84-L232 HydrophobicContact CD1-CB 4.22Å; F84-L232 HydrophobicContact CE1-CB 3.4Å; F84-L232 VanDerWaalsContact CE1-CB 3.4Å; F84-L232 HydrophobicContact CZ-CB 3.92Å; F84-L232 VanDerWaalsContact CZ-N 3.31Å; M133-L232 HydrophobicContact CE-CD1 3.65Å; M133-L232 HydrophobicContact CE-CD2 3.99Å; M133-L232 HydrophobicContact CE-CG 4.44Å; M133-L232 HydrophobicContact SD-CD1 4.26Å; M133-L232 HydrophobicContact SD-CD2 3.89Å; P225-L232 HydrophobicContact CB-CD1 3.43Å; P225-L232 VanDerWaalsContact CB-CD1 3.43Å; V227-L232 HydrophobicContact CG2-CD1 3.78Å; L232-M234 HydrophobicContact CG-CG 4.48Å
233	D	96.4	Very high	96.2	Very high	15 Å²	15	37 Å²	37	8%	0.08	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130.4	-179.1	-67.4	-5.8	0	0	0	110.3	R27 P225 V226 S231	R27-D233 WeakPolarHBondContact CB-OD1 3.44Å; R27-D233 VanDerWaalsContact CG-OD1 3.3Å; R27-D233 WeakPolarHBondContact CG-OD1 3.39Å; R27-D233 IonicContact CZ-OD1 3.24Å; R27-D233 IonicContact CZ-OD2 3.55Å; R27-D233 IonicContact NE-OD1 3.45Å; R27-D233 PolarHBondContact NE-OD1 2.93Å; R27-D233 IonicContact NE-OD2 3.91Å; R27-D233 PolarHBondContact NE-OD2 2.83Å; R27-D233 IonicContact NH2-OD1 2.77Å; R27-D233 IonicContact NH2-OD2 2.83Å; R27-D233 PolarHBondContact NH2-OD2 2.77Å; P225-D233 WeakPolarHBondContact CA-O 3.36Å; V226-D233 HydrophobicContact CB-CB 4.4Å; V226-D233 PolarHBondContact N-O 3.01Å; V226-D233 PolarHBondContact O-N 2.85Å; S231-D233 PolarHBondContact OG-OD1 3.17Å
234	M	96.3	Very high	96.1	Very high	13 Å²	13	38 Å²	38	6%	0.064	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.6	-179.5	-67	174.7	-71.6	0	0	109.6	K25 I26 I28 L141 L221 P225 L232 F236	K25-M234 WeakPolarHBondContact CA-O 3.22Å; I26-M234 HydrophobicContact CB-CE 4.23Å; I26-M234 HydrophobicContact CG2-CE 4.04Å; I26-M234 PolarHBondContact N-O 3.42Å; I26-M234 PolarHBondContact O-N 3Å; I28-M234 HydrophobicContact CD1-CE 4Å; I28-M234 HydrophobicContact CG1-CE 4.33Å; L141-M234 HydrophobicContact CD2-SD 3.9Å; L221-M234 HydrophobicContact CD2-CB 3.96Å; L221-M234 HydrophobicContact CD2-CG 4.43Å; P225-M234 HydrophobicContact CB-CG 3.99Å; P225-M234 HydrophobicContact CG-CG 4.27Å; L232-M234 HydrophobicContact CG-CG 4.48Å; M234-F236 HydrophobicContact CB-CD2 4.26Å; M234-F236 HydrophobicContact CB-CE2 3.53Å; M234-F236 HydrophobicContact CB-CZ 3.94Å; M234-F236 HydrophobicContact SD-CE2 4.5Å; M234-F236 HydrophobicContact SD-CZ 4.2Å
235	D	96.4	Very high	96	Very high	33 Å²	33	37.8 Å²	37.8	18%	0.176	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	112.4	179.8	-72.9	-25.6	0	0	0	109.3	P22 K25 L222	P22-D235 HydrophobicContact CB-CB 3.96Å; P22-D235 HydrophobicContact CG-CB 4.23Å; K25-D235 WeakPolarHBondContact CD-OD1 3.23Å; K25-D235 VanDerWaalsContact CG-OD1 3.28Å; K25-D235 WeakPolarHBondContact CG-OD1 3.39Å; K25-D235 IonicContact NZ-OD1 2.75Å; K25-D235 PolarHBondContact NZ-OD1 3.46Å; K25-D235 IonicContact NZ-OD2 3.57Å; K25-D235 PolarHBondContact NZ-OD2 2.9Å; L222-D235 PolarHBondContact N-O 2.8Å
236	F	96.8	Very high	95.9	Very high	12 Å²	12	41.5 Å²	41.5	5%	0.053	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	146.2	-178.7	-63.9	-80.8	0	0	0	111.1	G23 C24 I26 Y219 L221 M234 G238 P439	G23-F236 PolarHBondContact N-O 3.3Å; C24-F236 HydrophobicContact CB-CB 4.06Å; C24-F236 PolarHBondContact N-O 3.45Å; C24-F236 CarbonylContact O-C 3.57Å; C24-F236 WeakPolarHBondContact O-CA 3.4Å; C24-F236 WeakPolarHBondContact O-CB 3.22Å; C24-F236 PolarHBondContact O-N 2.83Å; I26-F236 HydrophobicContact CB-CD2 4.39Å; I26-F236 HydrophobicContact CB-CE2 3.88Å; I26-F236 HydrophobicContact CD1-CD2 4.08Å; I26-F236 HydrophobicContact CD1-CE2 3.61Å; I26-F236 HydrophobicContact CD1-CZ 4.36Å; I26-F236 HydrophobicContact CG1-CD2 3.92Å; I26-F236 HydrophobicContact CG1-CE2 3.69Å; Y219-F236 HydrophobicContact CD1-CB 4.48Å; Y219-F236 WeakPolarHBondContact O-CD1 3.29Å; L221-F236 HydrophobicContact CD2-CD1 3.65Å; L221-F236 HydrophobicContact CD2-CE1 3.38Å; L221-F236 HydrophobicContact CD2-CE2 4.26Å; L221-F236 HydrophobicContact CD2-CG 4.27Å; L221-F236 HydrophobicContact CD2-CZ 3.72Å; L221-F236 HydrophobicContact CG-CD1 4.09Å; L221-F236 HydrophobicContact CG-CE1 3.79Å; M234-F236 HydrophobicContact CB-CD2 4.26Å; M234-F236 HydrophobicContact CB-CE2 3.53Å; M234-F236 HydrophobicContact CB-CZ 3.94Å; M234-F236 HydrophobicContact SD-CE2 4.5Å; M234-F236 HydrophobicContact SD-CZ 4.2Å; F236-G238 VanDerWaalsContact C-N 3.31Å; F236-G238 PolarHBondContact O-N 3.38Å; F236-P439 HydrophobicContact CE1-CG 4.46Å; F236-P439 HydrophobicContact CZ-CG 4.44Å
237	R	96.4	Very high	95.7	Very high	67 Å²	67	45 Å²	45	25%	0.253	24%	0.243	S	C	.	.			trans	-54.6	-48.4	174.8	-170.8	-178.9	-72.7	-81.6	-13.5	111	E20 G23 D218 S220 L222 M239	E20-R237 VanDerWaalsContact CD-NH1 3.26Å; E20-R237 IonicContact OE1-CZ 3.01Å; E20-R237 IonicContact OE1-NH1 3.81Å; E20-R237 PolarHBondContact OE1-NH1 3.11Å; E20-R237 IonicContact OE2-CZ 3.75Å; E20-R237 VanDerWaalsContact OE2-CZ 3.26Å; E20-R237 IonicContact OE2-NH1 3.91Å; E20-R237 PolarHBondContact OE2-NH1 2.65Å; E20-R237 IonicContact OE2-NH2 3.75Å; E20-R237 PolarHBondContact OE2-NH2 3.2Å; G23-R237 WeakPolarHBondContact CA-O 3.1Å; G23-R237 PolarHBondContact N-O 3.31Å; D218-R237 IonicContact OD2-NE 3.42Å; S220-R237 WeakPolarHBondContact O-CB 3.42Å; S220-R237 PolarHBondContact O-N 2.89Å; L222-R237 HydrophobicContact CD2-CB 3.89Å; L222-R237 HydrophobicContact CD2-CG 4.3Å; L222-R237 HydrophobicContact CG-CB 4.47Å; R237-M239 HydrophobicContact CG-CB 3.84Å; R237-M239 HydrophobicContact CG-CE 4.46Å; R237-M239 PolarHBondContact O-N 2.83Å
238	G	96.3	Very high	95.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.25	C	C	.	.			trans	57.5	46.9	173.9	0	0	0	0	0	112.4	D218 F236 F274	D218-G238 VanDerWaalsContact O-CA 3.31Å; D218-G238 WeakPolarHBondContact O-CA 3.35Å; D218-G238 PolarHBondContact O-N 3.25Å; F236-G238 VanDerWaalsContact C-N 3.31Å; F236-G238 PolarHBondContact O-N 3.38Å; G238-F274 VanDerWaalsContact O-CD2 3.27Å; G238-F274 WeakPolarHBondContact O-CD2 3.42Å
239	M	96.6	Very high	95.4	Very high	14 Å²	14	46.8 Å²	46.8	7%	0.069	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	133.3	-170.9	175.2	-171.7	69	0	0	110.3	I217 D218 R237 T249 Y273	I217-M239 CarbonylContact C-O 3.53Å; I217-M239 WeakPolarHBondContact CA-O 3.4Å; D218-M239 HydrophobicContact CB-CE 4.29Å; D218-M239 PolarHBondContact N-O 2.78Å; D218-M239 PolarHBondContact O-N 2.82Å; R237-M239 HydrophobicContact CG-CB 3.84Å; R237-M239 HydrophobicContact CG-CE 4.46Å; R237-M239 PolarHBondContact O-N 2.83Å; M239-T249 HydrophobicContact CE-CG2 4.26Å; M239-T249 HydrophobicContact SD-CG2 4.1Å; M239-Y273 HydrophobicContact CB-CE1 3.92Å; M239-Y273 HydrophobicContact CG-CE1 4.09Å; M239-Y273 VanDerWaalsContact CG-OH 3.32Å; M239-Y273 WeakPolarHBondContact CG-OH 3.44Å; M239-Y273 PolarHBondContact SD-OH 3.28Å
240	F	97.7	Very high	95.4	Very high	12 Å²	12	45.3 Å²	45.3	5%	0.053	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	150	169.6	-65	-109.3	0	0	0	111.3	V211 V215 G216 I217 F274 S277 G278 S281 V436	V211-F240 HydrophobicContact CG2-CD1 4.24Å; V211-F240 HydrophobicContact CG2-CE1 3.94Å; V215-F240 HydrophobicContact CG2-CD1 4.37Å; G216-F240 CarbonylContact O-C 3.59Å; G216-F240 VanDerWaalsContact O-CA 3.25Å; G216-F240 WeakPolarHBondContact O-CA 3.34Å; I217-F240 HydrophobicContact CB-CD1 4.23Å; I217-F240 HydrophobicContact CB-CE1 4.37Å; I217-F240 HydrophobicContact CD1-CD1 4.38Å; I217-F240 HydrophobicContact CD1-CD2 4.09Å; I217-F240 HydrophobicContact CD1-CE1 3.96Å; I217-F240 HydrophobicContact CD1-CE2 3.61Å; I217-F240 HydrophobicContact CD1-CG 4.46Å; I217-F240 HydrophobicContact CD1-CZ 3.57Å; I217-F240 HydrophobicContact CG1-CD2 4.4Å; I217-F240 HydrophobicContact CG1-CE2 4.4Å; I217-F240 HydrophobicContact CG1-CG 4.46Å; I217-F240 HydrophobicContact CG1-CZ 4.49Å; F240-F274 WeakPolarHBondContact CD2-O 3.33Å; F240-F274 HydrophobicContact CE2-CD1 4.33Å; F240-F274 HydrophobicContact CE2-CD2 4.4Å; F240-F274 AromaticContact CE2-CE1 3.99Å; F240-F274 HydrophobicContact CE2-CE1 3.99Å; F240-F274 HydrophobicContact CE2-CE2 4.07Å; F240-F274 AromaticContact CE2-CZ 3.85Å; F240-F274 HydrophobicContact CE2-CZ 3.85Å; F240-F274 VanDerWaalsContact CE2-O 3.29Å; F240-F274 WeakPolarHBondContact CE2-O 3.39Å; F240-F274 HydrophobicContact CZ-CE1 4.35Å; F240-F274 HydrophobicContact CZ-CZ 4.14Å; F240-S277 PolarHBondContact N-OG 3.31Å; F240-S277 VanDerWaalsContact N-OG 3.13Å; F240-G278 VanDerWaalsContact CB-CA 3.47Å; F240-G278 VanDerWaalsContact CG-CA 3.46Å; F240-S281 VanDerWaalsContact C-OG 3.32Å; F240-S281 PolarHBondContact O-OG 2.82Å; F240-S281 VanDerWaalsContact O-OG 3.13Å; F240-V436 HydrophobicContact CE1-CG1 3.81Å; F240-V436 HydrophobicContact CZ-CB 4.37Å; F240-V436 HydrophobicContact CZ-CG1 3.85Å; F240-V436 HydrophobicContact CZ-CG2 4.22Å
241	F	97.1	Very high	95.4	Very high	8 Å²	8	42.3 Å²	42.3	4%	0.035	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	151.2	176	61.3	-87.9	0	0	0	111.1	R208 V215 G216 D218 L243 E246 S281	R208-F241 VanDerWaalsContact NH2-CE2 3.34Å; V215-F241 CarbonylContact C-O 3.57Å; V215-F241 VanDerWaalsContact CA-O 3.29Å; V215-F241 WeakPolarHBondContact CA-O 3.47Å; V215-F241 WeakPolarHBondContact CB-O 3.26Å; G216-F241 PolarHBondContact N-O 3.45Å; G216-F241 PolarHBondContact O-N 2.91Å; D218-F241 HydrophobicContact CB-CD1 4.27Å; D218-F241 HydrophobicContact CB-CE1 4.2Å; F241-L243 HydrophobicContact CD2-CD2 4.44Å; F241-L243 HydrophobicContact CE2-CD2 3.8Å; F241-E246 HydrophobicContact CD2-CB 4.22Å; F241-E246 HydrophobicContact CD2-CG 3.78Å; F241-E246 HydrophobicContact CE2-CG 4.04Å; F241-S281 WeakPolarHBondContact CA-OG 3.03Å; F241-S281 PolarHBondContact N-OG 2.89Å
242	E	96.9	Very high	95.3	Very high	29 Å²	29	43.1 Å²	43.1	14%	0.136	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	131.3	174.7	-177.2	-171.1	-178.4	0	0	110.3	G244 N245 E246 K284 A285	E242-G244 VanDerWaalsContact C-N 3.33Å; E242-G244 PolarHBondContact O-N 2.83Å; E242-N245 CarbonylContact O-C 3.6Å; E242-N245 PolarHBondContact O-N 2.91Å; E242-E246 WeakPolarHBondContact O-CA 3.47Å; E242-E246 PolarHBondContact O-N 3.3Å; E242-K284 VanDerWaalsContact OE2-CB 3.3Å; E242-K284 WeakPolarHBondContact OE2-CB 3.02Å; E242-A285 HydrophobicContact CG-CB 4.2Å; E242-A285 WeakPolarHBondContact OE1-CA 3.33Å
243	L	96.3	Very high	95.1	Very high	50 Å²	50	52.3 Å²	52.3	26%	0.262	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-29.4	179.6	-63.2	177.9	0	0	0	113.1	E210 D212 Y214 F241 N245	E210-L243 HydrophobicContact CG-CD1 4.14Å; E210-L243 HydrophobicContact CG-CD2 4.16Å; D212-L243 WeakPolarHBondContact O-CD1 3.42Å; Y214-L243 PolarHBondContact O-N 2.73Å; F241-L243 HydrophobicContact CD2-CD2 4.44Å; F241-L243 HydrophobicContact CE2-CD2 3.8Å; L243-N245 VanDerWaalsContact C-N 3.35Å
244	G	93.6	Very high	95	Very high	72 Å²	72	52.5 Å²	52.5	74%	0.742	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-23.4	177.6	0	0	0	0	0	114.2	E242	E242-G244 VanDerWaalsContact C-N 3.33Å; E242-G244 PolarHBondContact O-N 2.83Å
245	N	94.4	Very high	94.9	Very high	76 Å²	76	55.6 Å²	55.6	41%	0.406	30%	0.299	S	S	.	.			trans	-157.1	81.8	179.4	-174.5	2	0	0	0	111.2	E242 L243 N247 N248	E242-N245 CarbonylContact O-C 3.6Å; E242-N245 PolarHBondContact O-N 2.91Å; L243-N245 VanDerWaalsContact C-N 3.35Å; N245-N247 PolarHBondContact O-N 2.98Å; N245-N247 VanDerWaalsContact O-N 3.12Å; N245-N248 PolarHBondContact O-N 2.86Å; N245-N248 VanDerWaalsContact O-N 3.17Å
246	E	92.3	Very high	94.8	Very high	93 Å²	93	58 Å²	58	44%	0.435	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-22	-174.5	-56.2	-163.6	-177.1	0	0	114.3	R208 F241 E242 N248 T249	R208-E246 IonicContact CZ-OE2 3.84Å; R208-E246 IonicContact NH2-OE2 2.63Å; R208-E246 PolarHBondContact NH2-OE2 3.38Å; F241-E246 HydrophobicContact CD2-CB 4.22Å; F241-E246 HydrophobicContact CD2-CG 3.78Å; F241-E246 HydrophobicContact CE2-CG 4.04Å; E242-E246 WeakPolarHBondContact O-CA 3.47Å; E242-E246 PolarHBondContact O-N 3.3Å; E246-N248 VanDerWaalsContact C-N 3.27Å; E246-N248 PolarHBondContact O-N 2.88Å; E246-T249 WeakPolarHBondContact O-CG2 3.42Å
247	N	91.7	Very high	94.7	Very high	151 Å²	151	57.6 Å²	57.6	81%	0.807	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-19	-178.6	-68.6	-28.3	0	0	0	112.8	N245 T249	N245-N247 PolarHBondContact O-N 2.98Å; N245-N247 VanDerWaalsContact O-N 3.12Å; N247-T249 PolarHBondContact O-N 2.77Å; N247-T249 VanDerWaalsContact O-N 3.12Å
248	N	92.7	Very high	94.6	Very high	43 Å²	43	58.4 Å²	58.4	23%	0.23	32%	0.32	C	S	.	.			trans	-87.1	78	-178.6	-178.7	17	0	0	0	110.5	N245 E246 Y280 K284	N245-N248 PolarHBondContact O-N 2.86Å; N245-N248 VanDerWaalsContact O-N 3.17Å; E246-N248 VanDerWaalsContact C-N 3.27Å; E246-N248 PolarHBondContact O-N 2.88Å; N248-Y280 PolarHBondContact OD1-OH 2.88Å; N248-K284 WeakPolarHBondContact ND2-CD 2.85Å; N248-K284 WeakPolarHBondContact ND2-CG 3.44Å
249	T	94.1	Very high	94.5	Very high	55 Å²	55	58.7 Å²	58.7	34%	0.337	32%	0.321	S	S	.	.			trans	-104.6	162	-178.1	56.9	0	0	0	0	112.8	M239 E246 N247	M239-T249 HydrophobicContact CE-CG2 4.26Å; M239-T249 HydrophobicContact SD-CG2 4.1Å; E246-T249 WeakPolarHBondContact O-CG2 3.42Å; N247-T249 PolarHBondContact O-N 2.77Å; N247-T249 VanDerWaalsContact O-N 3.12Å
250	L	95	Very high	94.3	Very high	49 Å²	49	66.8 Å²	66.8	26%	0.257	35%	0.351	S	S	.	.			trans	-85	133.7	171.6	-174.6	66.9	0	0	0	109.4	Y273 D276 Y280	L250-Y273 HydrophobicContact CB-CE2 4.08Å; L250-Y273 HydrophobicContact CD2-CD2 4.18Å; L250-Y273 HydrophobicContact CD2-CE2 4.18Å; L250-Y273 HydrophobicContact CG-CD2 4.48Å; L250-Y273 HydrophobicContact CG-CE2 4.09Å; L250-Y273 WeakPolarHBondContact O-CE2 3.14Å; L250-Y273 PolarHBondContact O-OH 3.24Å; L250-D276 HydrophobicContact CD2-CB 3.7Å; L250-Y280 HydrophobicContact CB-CD1 4.08Å; L250-Y280 HydrophobicContact CB-CG 4.15Å; L250-Y280 HydrophobicContact CD1-CD2 4.17Å; L250-Y280 HydrophobicContact CD1-CE2 4.48Å; L250-Y280 HydrophobicContact CD1-CG 4.4Å
251	V	93.7	Very high	94	Very high	88 Å²	88	68.3 Å²	68.3	53%	0.533	36%	0.358	S	S	.	.			trans	-73.9	134.9	173.9	-176.1	0	0	0	0	110.1	Y253	V251-Y253 HydrophobicContact CB-CD2 4.42Å; V251-Y253 HydrophobicContact CB-CE2 3.73Å; V251-Y253 HydrophobicContact CG1-CD2 4.36Å; V251-Y253 HydrophobicContact CG1-CE1 4.01Å; V251-Y253 HydrophobicContact CG1-CE2 3.69Å; V251-Y253 VanDerWaalsContact CG1-CZ 3.48Å; V251-Y253 PolarHBondContact O-N 3.08Å
252	N	94.8	Very high	93.9	Very high	17 Å²	17	72 Å²	72	9%	0.091	37%	0.373	C	S	.	.			trans	-83.7	112.8	-177.7	-165.9	-7.5	0	0	0	112.5	P21 A254 Y273	P21-N252 HydrophobicContact CG-CB 4.1Å; P21-N252 PolarHBondContact O-ND2 2.95Å; N252-A254 WeakPolarHBondContact OD1-CB 3.46Å; N252-A254 PolarHBondContact OD1-N 3.47Å; N252-Y273 VanDerWaalsContact CA-CE2 3.49Å; N252-Y273 HydrophobicContact CB-CD1 3.96Å; N252-Y273 HydrophobicContact CB-CD2 3.69Å; N252-Y273 HydrophobicContact CB-CE1 3.84Å; N252-Y273 HydrophobicContact CB-CE2 3.58Å; N252-Y273 HydrophobicContact CB-CG 3.86Å; N252-Y273 WeakPolarHBondContact ND2-CD1 3.18Å; N252-Y273 VanDerWaalsContact OD1-CB 3.24Å; N252-Y273 WeakPolarHBondContact OD1-CB 3.41Å; N252-Y273 VanDerWaalsContact OD1-CG 3.24Å
253	Y	92.3	Very high	93.8	Very high	202 Å²	202	74.9 Å²	74.9	79%	0.792	39%	0.389	S	S	*	.			trans	-119	13.5	172.1	-58.5	-69.3	0	0	0	112.6	V251	V251-Y253 HydrophobicContact CB-CD2 4.42Å; V251-Y253 HydrophobicContact CB-CE2 3.73Å; V251-Y253 HydrophobicContact CG1-CD2 4.36Å; V251-Y253 HydrophobicContact CG1-CE1 4.01Å; V251-Y253 HydrophobicContact CG1-CE2 3.69Å; V251-Y253 VanDerWaalsContact CG1-CZ 3.48Å; V251-Y253 PolarHBondContact O-N 3.08Å
254	A	93.5	Very high	93.8	Very high	18 Å²	18	75.1 Å²	75.1	15%	0.149	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-75	159.4	-175.3	0	0	0	0	0	112.4	N252	N252-A254 WeakPolarHBondContact OD1-CB 3.46Å; N252-A254 PolarHBondContact OD1-N 3.47Å
255	V	93.8	Very high	93.9	Very high	78 Å²	78	73.5 Å²	73.5	47%	0.473	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-69.9	134.4	174.9	-179.6	0	0	0	0	109.5	P257 Y457	V255-P257 WeakPolarHBondContact O-CD 3.24Å; V255-Y457 HydrophobicContact CG1-CD1 4.3Å; V255-Y457 HydrophobicContact CG1-CE1 4.45Å
256	N	94.3	Very high	94	Very high	83 Å²	83	70 Å²	70	44%	0.444	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-59.8	124.4	174.1	-72.6	-4.6	0	0	0	110.7	P21 I258	P21-N256 WeakPolarHBondContact CA-OD1 3.3Å; P21-N256 WeakPolarHBondContact CB-OD1 3.38Å; N256-I258 PolarHBondContact O-N 3.37Å
257	P	94.9	Very high	94.3	Very high	5 Å²	5	65.9 Å²	65.9	3%	0.032	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-62.2	124.7	172.9	-22.5	34.1	0	0	0	111.2	K25 V255 Y457	K25-P257 HydrophobicContact CB-CB 4.43Å; K25-P257 WeakPolarHBondContact CD-O 3.33Å; V255-P257 WeakPolarHBondContact O-CD 3.24Å; P257-Y457 HydrophobicContact CB-CD2 3.9Å; P257-Y457 HydrophobicContact CB-CE2 4.47Å; P257-Y457 HydrophobicContact CB-CG 4.1Å; P257-Y457 HydrophobicContact CG-CG 4.45Å
258	I	93.8	Very high	94.5	Very high	84 Å²	84	58.8 Å²	58.8	43%	0.431	28%	0.284	S	S	.	.			trans	-109.7	112.3	176.1	-56.1	173.4	0	0	0	108.4	N256 R260 Y457 I459	N256-I258 PolarHBondContact O-N 3.37Å; I258-R260 HydrophobicContact CG2-CG 4.02Å; I258-Y457 PolarHBondContact O-OH 3.21Å; I258-I459 WeakPolarHBondContact O-CD1 3.39Å
259	V	94.3	Very high	94.8	Very high	5 Å²	5	56.7 Å²	56.7	3%	0.03	27%	0.273	C	S	.	.			trans	-95.3	130.6	172.5	-174.4	0	0	0	0	108.6	K25 R27 Y267 I459	K25-V259 HydrophobicContact CD-CG2 4.41Å; R27-V259 HydrophobicContact CB-CG1 4.48Å; R27-V259 VanDerWaalsContact CZ-O 3.24Å; R27-V259 VanDerWaalsContact NH1-C 3.26Å; R27-V259 PolarHBondContact NH1-O 3.26Å; R27-V259 PolarHBondContact NH2-O 3.02Å; R27-V259 VanDerWaalsContact NH2-O 3.13Å; V259-Y267 HydrophobicContact CG1-CD1 4.13Å; V259-Y267 HydrophobicContact CG1-CD2 4.27Å; V259-Y267 HydrophobicContact CG1-CG 3.74Å; V259-I459 HydrophobicContact CG2-CD1 4.27Å; V259-I459 HydrophobicContact CG2-CG1 4.49Å
260	R	92.8	Very high	95	Very high	184 Å²	184	54.1 Å²	54.1	69%	0.694	26%	0.257	S	S	*	.			trans	-123.1	-10.6	179.6	-64.1	-175.8	177.7	177.7	-0.6	113.1	I258 Y262	I258-R260 HydrophobicContact CG2-CG 4.02Å; R260-Y262 WeakPolarHBondContact O-CD2 3.24Å; R260-Y262 WeakPolarHBondContact O-CE2 3.37Å
261	E	92.2	Very high	95.1	Very high	44 Å²	44	51.8 Å²	51.8	21%	0.206	24%	0.244	C	C	.	.			trans	-85	152.2	-172.3	-58.3	71.1	-148.6	0	0	110.6	Y267	E261-Y267 HydrophobicContact CB-CD1 4.13Å; E261-Y267 HydrophobicContact CB-CE1 3.36Å; E261-Y267 HydrophobicContact CB-CE2 4.27Å; E261-Y267 VanDerWaalsContact CB-CZ 3.44Å; E261-Y267 WeakPolarHBondContact CB-OH 3.41Å; E261-Y267 HydrophobicContact CG-CE1 4.22Å
262	Y	94.5	Very high	95.3	Very high	87 Å²	87	49.5 Å²	49.5	34%	0.341	23%	0.228	S	C	.	.			trans	-142.1	5	-178.1	-64.2	-88.1	0	0	0	113	T29 R230 R260 R264 Y267	T29-Y262 HydrophobicContact CG2-CD1 4.22Å; R230-Y262 HydrophobicContact CB-CD1 3.94Å; R230-Y262 HydrophobicContact CB-CE1 3.7Å; R260-Y262 WeakPolarHBondContact O-CD2 3.24Å; R260-Y262 WeakPolarHBondContact O-CE2 3.37Å; Y262-R264 VanDerWaalsContact C-N 3.33Å; Y262-R264 PolarHBondContact O-N 3.21Å; Y262-Y267 PolarHBondContact N-OH 3.28Å
263	D	94.5	Very high	95.4	Very high	89 Å²	89	49 Å²	49	48%	0.476	23%	0.225	S	C	.	.	S	Bend	trans	-77.5	-12	-175.7	61.8	-64.3	0	0	0	114.1	R31 Y267	R31-D263 WeakPolarHBondContact CD-O 3.38Å; R31-D263 PolarHBondContact NH1-O 2.89Å; D263-Y267 VanDerWaalsContact CG-OH 3.23Å; D263-Y267 PolarHBondContact N-OH 3.34Å; D263-Y267 PolarHBondContact OD1-OH 3.44Å
264	R	96.1	Very high	95.7	Very high	55 Å²	55	39.5 Å²	39.5	21%	0.208	19%	0.188	C	C	.	.	S	Bend	trans	-122.7	165.2	178.2	-60.8	-176.7	-176.8	-88	-15.6	111.7	T29 Y262 Y267 E448 V450 G461 A462	T29-R264 VanDerWaalsContact CG2-O 3.3Å; T29-R264 WeakPolarHBondContact CG2-O 3.28Å; T29-R264 PolarHBondContact OG1-O 2.62Å; Y262-R264 VanDerWaalsContact C-N 3.33Å; Y262-R264 PolarHBondContact O-N 3.21Å; R264-Y267 HydrophobicContact CB-CE1 4.47Å; R264-Y267 HydrophobicContact CB-CE2 4.1Å; R264-Y267 PolarHBondContact N-OH 3.11Å; R264-E448 PolarHBondContact NH1-O 2.96Å; R264-V450 VanDerWaalsContact CZ-CG2 3.46Å; R264-V450 VanDerWaalsContact NH2-CG2 3.26Å; R264-G461 WeakPolarHBondContact CD-O 3.43Å; R264-A462 WeakPolarHBondContact CB-O 3.37Å
265	M	96.4	Very high	95.9	Very high	38 Å²	38	40.1 Å²	40.1	19%	0.187	19%	0.187	C	C	.	.	S	Bend	trans	-66.3	-39.9	-175.9	-63.4	-176.9	175.3	0	0	113	T29 R31 M35 A462 N463 L464	T29-M265 PolarHBondContact N-O 2.75Å; T29-M265 PolarHBondContact OG1-O 3.3Å; R31-M265 HydrophobicContact CB-CG 4.14Å; M35-M265 HydrophobicContact CB-CE 3.91Å; M35-M265 HydrophobicContact CB-SD 4.02Å; M35-M265 HydrophobicContact CG-CE 4.29Å; M35-M265 HydrophobicContact CG-SD 4.29Å; M35-M265 HydrophobicContact SD-SD 3.95Å; M265-A462 PolarHBondContact N-O 3.27Å; M265-N463 HydrophobicContact CG-CB 4.36Å; M265-N463 PolarHBondContact N-OD1 2.97Å; M265-N463 HydrophobicContact SD-CB 4.16Å; M265-L464 HydrophobicContact CB-CG 4.44Å; M265-L464 HydrophobicContact SD-CB 4.09Å; M265-L464 PolarHBondContact SD-N 2.85Å
266	V	97.1	Very high	96.1	Very high	2 Å²	2	37.7 Å²	37.7	1%	0.012	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	145.9	-175.8	64.2	0	0	0	0	111.2	I26 R27 F446 A462 L464	I26-V266 HydrophobicContact CG2-CG2 3.81Å; R27-V266 CarbonylContact O-C 3.49Å; R27-V266 VanDerWaalsContact O-CA 3.26Å; R27-V266 WeakPolarHBondContact O-CA 3.36Å; R27-V266 WeakPolarHBondContact O-CG2 3.48Å; V266-F446 HydrophobicContact CG1-CD1 3.7Å; V266-F446 HydrophobicContact CG1-CE1 3.53Å; V266-F446 HydrophobicContact CG2-CE1 4.22Å; V266-A462 HydrophobicContact CG1-CB 4.22Å; V266-A462 WeakPolarHBondContact CG1-O 3.27Å; V266-A462 PolarHBondContact N-O 2.73Å; V266-A462 PolarHBondContact O-N 2.89Å; V266-L464 HydrophobicContact CB-CD1 4.27Å; V266-L464 HydrophobicContact CB-CG 4.28Å; V266-L464 HydrophobicContact CG1-CD1 4.31Å; V266-L464 HydrophobicContact CG1-CD2 3.77Å; V266-L464 HydrophobicContact CG1-CG 3.79Å
267	Y	97.7	Very high	96.3	Very high	6 Å²	6	33.7 Å²	33.7	2%	0.024	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	136	171.8	-64.7	-95.1	0	0	0	110.5	I26 R27 T29 V259 E261 Y262 D263 R264 I459 I460 G461	I26-Y267 CarbonylContact C-O 3.56Å; I26-Y267 WeakPolarHBondContact CA-O 3.41Å; R27-Y267 HydrophobicContact CG-CD2 4.49Å; R27-Y267 PolarHBondContact N-O 3.01Å; R27-Y267 PolarHBondContact O-N 3.21Å; T29-Y267 HydrophobicContact CG2-CD2 3.91Å; T29-Y267 HydrophobicContact CG2-CE2 3.73Å; V259-Y267 HydrophobicContact CG1-CD1 4.13Å; V259-Y267 HydrophobicContact CG1-CD2 4.27Å; V259-Y267 HydrophobicContact CG1-CG 3.74Å; E261-Y267 HydrophobicContact CB-CD1 4.13Å; E261-Y267 HydrophobicContact CB-CE1 3.36Å; E261-Y267 HydrophobicContact CB-CE2 4.27Å; E261-Y267 VanDerWaalsContact CB-CZ 3.44Å; E261-Y267 WeakPolarHBondContact CB-OH 3.41Å; E261-Y267 HydrophobicContact CG-CE1 4.22Å; Y262-Y267 PolarHBondContact N-OH 3.28Å; D263-Y267 VanDerWaalsContact CG-OH 3.23Å; D263-Y267 PolarHBondContact N-OH 3.34Å; D263-Y267 PolarHBondContact OD1-OH 3.44Å; R264-Y267 HydrophobicContact CB-CE1 4.47Å; R264-Y267 HydrophobicContact CB-CE2 4.1Å; R264-Y267 PolarHBondContact N-OH 3.11Å; Y267-I459 HydrophobicContact CD1-CG2 3.78Å; Y267-I460 CarbonylContact C-O 3.52Å; Y267-I460 WeakPolarHBondContact CA-O 3.48Å; Y267-G461 VanDerWaalsContact CD1-CA 3.49Å
268	L	97.2	Very high	96.4	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.01	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	110.5	175.6	177.3	70.3	0	0	0	109.1	C24 K25 I26 L270 I438 I459 I460	C24-L268 WeakPolarHBondContact SG-CD1 3.17Å; K25-L268 CarbonylContact O-C 3.53Å; K25-L268 WeakPolarHBondContact O-CA 3.36Å; I26-L268 HydrophobicContact CD1-CD1 4.23Å; I26-L268 HydrophobicContact CG1-CD1 3.73Å; L268-L270 HydrophobicContact CD1-CD2 3.87Å; L268-L270 HydrophobicContact CD2-CD1 4.03Å; L268-L270 HydrophobicContact CD2-CD2 4.08Å; L268-L270 HydrophobicContact CD2-CG 4.1Å; L268-L270 HydrophobicContact CG-CD1 4.42Å; L268-L270 HydrophobicContact CG-CD2 3.84Å; L268-L270 HydrophobicContact CG-CG 3.93Å; L268-I438 HydrophobicContact CD1-CG2 4.12Å; L268-I438 HydrophobicContact CD2-CD1 3.67Å; L268-I438 HydrophobicContact CD2-CG1 3.87Å; L268-I438 HydrophobicContact CD2-CG2 4.21Å; L268-I459 CarbonylContact O-C 3.57Å; L268-I459 WeakPolarHBondContact O-CA 3.16Å; L268-I460 HydrophobicContact CB-CB 4.27Å; L268-I460 HydrophobicContact CD2-CD1 4.34Å; L268-I460 PolarHBondContact N-O 3.34Å; L268-I460 PolarHBondContact O-N 3.31Å
269	G	97.6	Very high	96.5	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	118.6	171.7	0	0	0	0	0	110.8	C24 K25 L458	C24-G269 CarbonylContact C-O 3.45Å; C24-G269 WeakPolarHBondContact CA-O 3.36Å; K25-G269 PolarHBondContact N-O 3.46Å; K25-G269 PolarHBondContact O-N 2.77Å; G269-L458 CarbonylContact C-O 3.6Å; G269-L458 WeakPolarHBondContact CA-O 3.34Å
270	L	98.1	Very high	96.7	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118.6	177.9	-59.1	179	0	0	0	109.9	C24 L268 F274 F275 L386 Y457 L458 I460	C24-L270 HydrophobicContact CB-CD2 4.04Å; L268-L270 HydrophobicContact CD1-CD2 3.87Å; L268-L270 HydrophobicContact CD2-CD1 4.03Å; L268-L270 HydrophobicContact CD2-CD2 4.08Å; L268-L270 HydrophobicContact CD2-CG 4.1Å; L268-L270 HydrophobicContact CG-CD1 4.42Å; L268-L270 HydrophobicContact CG-CD2 3.84Å; L268-L270 HydrophobicContact CG-CG 3.93Å; L270-F274 HydrophobicContact CD1-CD1 4.29Å; L270-F274 HydrophobicContact CD1-CE1 4.23Å; L270-F274 HydrophobicContact CD2-CD1 4.29Å; L270-F274 HydrophobicContact CD2-CD2 4.06Å; L270-F274 HydrophobicContact CD2-CE1 4.45Å; L270-F274 HydrophobicContact CD2-CE2 4.22Å; L270-F274 HydrophobicContact CD2-CG 4.1Å; L270-F274 HydrophobicContact CD2-CZ 4.42Å; L270-F275 HydrophobicContact CB-CE2 3.92Å; L270-F275 HydrophobicContact CB-CZ 4.19Å; L270-F275 HydrophobicContact CD1-CE2 4.46Å; L270-F275 HydrophobicContact CD1-CZ 3.89Å; L270-L386 HydrophobicContact CD1-CD1 3.87Å; L270-L386 HydrophobicContact CD1-CD2 3.49Å; L270-L386 VanDerWaalsContact CD1-CD2 3.49Å; L270-L386 HydrophobicContact CD1-CG 4.33Å; L270-Y457 CarbonylContact O-C 3.5Å; L270-Y457 VanDerWaalsContact O-CA 3.24Å; L270-Y457 WeakPolarHBondContact O-CA 3.4Å; L270-Y457 WeakPolarHBondContact O-CB 3.42Å; L270-L458 HydrophobicContact CB-CD1 3.98Å; L270-L458 HydrophobicContact CB-CG 4.21Å; L270-L458 HydrophobicContact CD1-CD1 4.14Å; L270-L458 HydrophobicContact CG-CD1 4.25Å; L270-L458 PolarHBondContact N-O 3.49Å; L270-L458 PolarHBondContact O-N 3.3Å; L270-I460 HydrophobicContact CD1-CD1 4.47Å
271	S	97.9	Very high	96.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	165.6	176.3	67.7	0	0	0	0	111.9	G23 Y273 F274 F275	G23-S271 WeakPolarHBondContact CA-OG 3.45Å; G23-S271 PolarHBondContact O-N 2.73Å; G23-S271 PolarHBondContact O-OG 3.07Å; G23-S271 VanDerWaalsContact O-OG 3.08Å; S271-Y273 PolarHBondContact O-N 3.13Å; S271-Y273 PolarHBondContact OG-N 3.44Å; S271-F274 WeakPolarHBondContact O-CB 3.41Å; S271-F274 PolarHBondContact O-N 3.3Å; S271-F274 PolarHBondContact OG-N 3.25Å; S271-F275 WeakPolarHBondContact O-CD2 3.39Å
272	E	97.8	Very high	97.1	Very high	40 Å²	40	24.2 Å²	24.2	19%	0.187	11%	0.111	C	C	.	.	H	α-helix	trans	-53.5	-35.9	167.9	-79.4	169.5	170.1	0	0	112.3	F274 F275 D276 T338 I339 G456	E272-F274 VanDerWaalsContact C-N 3.3Å; E272-F274 PolarHBondContact O-N 3.49Å; E272-F275 PolarHBondContact O-N 2.96Å; E272-F275 VanDerWaalsContact O-N 3.13Å; E272-D276 WeakPolarHBondContact O-CB 3.2Å; E272-D276 PolarHBondContact O-N 3.32Å; E272-T338 VanDerWaalsContact OE1-CA 3.24Å; E272-T338 WeakPolarHBondContact OE1-CA 3.27Å; E272-I339 HydrophobicContact CG-CB 4.16Å; E272-I339 HydrophobicContact CG-CD1 3.9Å; E272-I339 HydrophobicContact CG-CG1 3.74Å; E272-I339 PolarHBondContact OE1-N 3.17Å; E272-G456 WeakPolarHBondContact CG-O 3.48Å; E272-G456 PolarHBondContact N-O 2.76Å
273	Y	97.9	Very high	97.2	Very high	8 Å²	8	23.2 Å²	23.2	3%	0.031	11%	0.107	C	C	.	.	H	α-helix	trans	-61.3	-35.7	180	177.2	-104.9	0	0	0	113.4	M239 L250 N252 S271 F275 D276 S277	M239-Y273 HydrophobicContact CB-CE1 3.92Å; M239-Y273 HydrophobicContact CG-CE1 4.09Å; M239-Y273 VanDerWaalsContact CG-OH 3.32Å; M239-Y273 WeakPolarHBondContact CG-OH 3.44Å; M239-Y273 PolarHBondContact SD-OH 3.28Å; L250-Y273 HydrophobicContact CB-CE2 4.08Å; L250-Y273 HydrophobicContact CD2-CD2 4.18Å; L250-Y273 HydrophobicContact CD2-CE2 4.18Å; L250-Y273 HydrophobicContact CG-CD2 4.48Å; L250-Y273 HydrophobicContact CG-CE2 4.09Å; L250-Y273 WeakPolarHBondContact O-CE2 3.14Å; L250-Y273 PolarHBondContact O-OH 3.24Å; N252-Y273 VanDerWaalsContact CA-CE2 3.49Å; N252-Y273 HydrophobicContact CB-CD1 3.96Å; N252-Y273 HydrophobicContact CB-CD2 3.69Å; N252-Y273 HydrophobicContact CB-CE1 3.84Å; N252-Y273 HydrophobicContact CB-CE2 3.58Å; N252-Y273 HydrophobicContact CB-CG 3.86Å; N252-Y273 WeakPolarHBondContact ND2-CD1 3.18Å; N252-Y273 VanDerWaalsContact OD1-CB 3.24Å; N252-Y273 WeakPolarHBondContact OD1-CB 3.41Å; N252-Y273 VanDerWaalsContact OD1-CG 3.24Å; S271-Y273 PolarHBondContact O-N 3.13Å; S271-Y273 PolarHBondContact OG-N 3.44Å; Y273-F275 VanDerWaalsContact C-N 3.28Å; Y273-F275 PolarHBondContact O-N 3.26Å; Y273-D276 PolarHBondContact O-N 3.01Å; Y273-S277 VanDerWaalsContact O-CB 3.28Å; Y273-S277 WeakPolarHBondContact O-CB 3.31Å; Y273-S277 PolarHBondContact O-N 2.94Å; Y273-S277 PolarHBondContact O-OG 3.38Å
274	F	97.9	Very high	97.3	Very high	2 Å²	2	23 Å²	23	1%	0.009	10%	0.102	C	C	.	.	H	α-helix	trans	-56.1	-45.3	175.1	177.4	-90	0	0	0	111.3	C24 I217 Y219 G238 F240 L270 S271 E272 S277 L386 V436	C24-F274 HydrophobicContact CB-CD2 4.36Å; I217-F274 HydrophobicContact CD1-CE2 3.79Å; I217-F274 HydrophobicContact CD1-CZ 4.07Å; Y219-F274 AromaticContact CE1-CE2 3.86Å; Y219-F274 HydrophobicContact CE1-CE2 3.86Å; G238-F274 VanDerWaalsContact O-CD2 3.27Å; G238-F274 WeakPolarHBondContact O-CD2 3.42Å; F240-F274 WeakPolarHBondContact CD2-O 3.33Å; F240-F274 HydrophobicContact CE2-CD1 4.33Å; F240-F274 HydrophobicContact CE2-CD2 4.4Å; F240-F274 AromaticContact CE2-CE1 3.99Å; F240-F274 HydrophobicContact CE2-CE1 3.99Å; F240-F274 HydrophobicContact CE2-CE2 4.07Å; F240-F274 AromaticContact CE2-CZ 3.85Å; F240-F274 HydrophobicContact CE2-CZ 3.85Å; F240-F274 VanDerWaalsContact CE2-O 3.29Å; F240-F274 WeakPolarHBondContact CE2-O 3.39Å; F240-F274 HydrophobicContact CZ-CE1 4.35Å; F240-F274 HydrophobicContact CZ-CZ 4.14Å; L270-F274 HydrophobicContact CD1-CD1 4.29Å; L270-F274 HydrophobicContact CD1-CE1 4.23Å; L270-F274 HydrophobicContact CD2-CD1 4.29Å; L270-F274 HydrophobicContact CD2-CD2 4.06Å; L270-F274 HydrophobicContact CD2-CE1 4.45Å; L270-F274 HydrophobicContact CD2-CE2 4.22Å; L270-F274 HydrophobicContact CD2-CG 4.1Å; L270-F274 HydrophobicContact CD2-CZ 4.42Å; S271-F274 WeakPolarHBondContact O-CB 3.41Å; S271-F274 PolarHBondContact O-N 3.3Å; S271-F274 PolarHBondContact OG-N 3.25Å; E272-F274 VanDerWaalsContact C-N 3.3Å; E272-F274 PolarHBondContact O-N 3.49Å; F274-S277 PolarHBondContact O-OG 2.86Å; F274-S277 VanDerWaalsContact O-OG 3.11Å; F274-L386 HydrophobicContact CE1-CD2 3.58Å; F274-L386 HydrophobicContact CZ-CD2 4.12Å; F274-V436 HydrophobicContact CE1-CG2 4.41Å; F274-V436 HydrophobicContact CZ-CG2 4Å
275	F	97.5	Very high	97.3	Very high	31 Å²	31	21.7 Å²	21.7	14%	0.136	10%	0.103	C	C	.	.	H	α-helix	trans	-77.5	-41	179.5	-60.2	-76.6	0	0	0	112.2	L270 S271 E272 Y273 G278 L279 T337 I339 V379 L386 V388 L458	L270-F275 HydrophobicContact CB-CE2 3.92Å; L270-F275 HydrophobicContact CB-CZ 4.19Å; L270-F275 HydrophobicContact CD1-CE2 4.46Å; L270-F275 HydrophobicContact CD1-CZ 3.89Å; S271-F275 WeakPolarHBondContact O-CD2 3.39Å; E272-F275 PolarHBondContact O-N 2.96Å; E272-F275 VanDerWaalsContact O-N 3.13Å; Y273-F275 VanDerWaalsContact C-N 3.28Å; Y273-F275 PolarHBondContact O-N 3.26Å; F275-G278 PolarHBondContact O-N 3.05Å; F275-L279 WeakPolarHBondContact O-CG 3.32Å; F275-L279 PolarHBondContact O-N 3.4Å; F275-T337 HydrophobicContact CB-CG2 4.14Å; F275-T337 WeakPolarHBondContact CB-OG1 3.49Å; F275-T337 HydrophobicContact CD2-CG2 4.48Å; F275-T337 HydrophobicContact CG-CG2 4.49Å; F275-I339 HydrophobicContact CD2-CD1 4.12Å; F275-I339 HydrophobicContact CE2-CD1 4.05Å; F275-V379 HydrophobicContact CZ-CG2 4.34Å; F275-L386 HydrophobicContact CE1-CD2 4.05Å; F275-L386 HydrophobicContact CZ-CD2 4.32Å; F275-V388 HydrophobicContact CE1-CG2 4.37Å; F275-L458 HydrophobicContact CE2-CD2 3.94Å; F275-L458 HydrophobicContact CE2-CG 4.4Å; F275-L458 HydrophobicContact CZ-CD2 3.93Å
276	D	97.8	Very high	97.1	Very high	26 Å²	26	21.5 Å²	21.5	14%	0.139	11%	0.11	C	C	.	.	H	α-helix	trans	-67.3	-37.6	-177.7	-76.3	-3.4	0	0	0	112.6	L250 E272 Y273 G278 L279 Y280 T337	L250-D276 HydrophobicContact CD2-CB 3.7Å; E272-D276 WeakPolarHBondContact O-CB 3.2Å; E272-D276 PolarHBondContact O-N 3.32Å; Y273-D276 PolarHBondContact O-N 3.01Å; D276-G278 VanDerWaalsContact C-N 3.29Å; D276-G278 PolarHBondContact O-N 2.81Å; D276-L279 PolarHBondContact O-N 3.4Å; D276-Y280 WeakPolarHBondContact O-CB 3.3Å; D276-Y280 PolarHBondContact O-N 2.89Å; D276-T337 WeakPolarHBondContact OD1-CA 3.4Å; D276-T337 WeakPolarHBondContact OD1-CB 3.37Å; D276-T337 PolarHBondContact OD1-N 3.06Å; D276-T337 PolarHBondContact OD1-OG1 2.78Å
277	S	98	Very high	96.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.3	-37.9	174.1	61.1	0	0	0	0	111.6	F240 Y273 F274 S281	F240-S277 PolarHBondContact N-OG 3.31Å; F240-S277 VanDerWaalsContact N-OG 3.13Å; Y273-S277 VanDerWaalsContact O-CB 3.28Å; Y273-S277 WeakPolarHBondContact O-CB 3.31Å; Y273-S277 PolarHBondContact O-N 2.94Å; Y273-S277 PolarHBondContact O-OG 3.38Å; F274-S277 PolarHBondContact O-OG 2.86Å; F274-S277 VanDerWaalsContact O-OG 3.11Å; S277-S281 WeakPolarHBondContact O-CB 3.43Å; S277-S281 PolarHBondContact O-N 3.13Å; S277-S281 PolarHBondContact O-OG 3.27Å
278	G	96.6	Very high	96.7	Very high	6 Å²	6	26.7 Å²	26.7	6%	0.062	14%	0.135	C	C	.	.	H	α-helix	trans	-64.6	-51.7	174	0	0	0	0	0	112.5	F240 F275 D276 Y280 S281 Y282	F240-G278 VanDerWaalsContact CB-CA 3.47Å; F240-G278 VanDerWaalsContact CG-CA 3.46Å; F275-G278 PolarHBondContact O-N 3.05Å; D276-G278 VanDerWaalsContact C-N 3.29Å; D276-G278 PolarHBondContact O-N 2.81Å; G278-Y280 VanDerWaalsContact C-N 3.28Å; G278-Y280 PolarHBondContact O-N 2.77Å; G278-S281 PolarHBondContact O-N 3.34Å; G278-Y282 VanDerWaalsContact O-CD2 3.25Å; G278-Y282 WeakPolarHBondContact O-CD2 3.38Å; G278-Y282 PolarHBondContact O-N 3.31Å
279	L	97	Very high	96.4	Very high	38 Å²	38	32.5 Å²	32.5	20%	0.199	16%	0.162	C	C	.	.	H	α-helix	trans	-61.4	-37.8	178.5	-68.2	165.2	0	0	0	112	F275 D276 Y283 F288 P335 T337 V346	F275-L279 WeakPolarHBondContact O-CG 3.32Å; F275-L279 PolarHBondContact O-N 3.4Å; D276-L279 PolarHBondContact O-N 3.4Å; L279-Y283 WeakPolarHBondContact O-CB 3.19Å; L279-Y283 PolarHBondContact O-N 2.77Å; L279-F288 HydrophobicContact CD2-CZ 4.5Å; L279-P335 HydrophobicContact CB-CB 4.09Å; L279-P335 HydrophobicContact CB-CG 4.37Å; L279-P335 HydrophobicContact CD1-CB 4.04Å; L279-P335 HydrophobicContact CD2-CB 4.12Å; L279-P335 HydrophobicContact CD2-CG 4.29Å; L279-P335 HydrophobicContact CG-CB 4.3Å; L279-T337 WeakPolarHBondContact CD1-OG1 3.32Å; L279-V346 HydrophobicContact CD1-CG1 3.91Å; L279-V346 HydrophobicContact CD1-CG2 4.47Å
280	Y	97.7	Very high	95.9	Very high	40 Å²	40	36 Å²	36	16%	0.157	18%	0.179	C	C	.	.	H	α-helix	trans	-65.5	-47.1	174.9	-179.4	-94.6	0	0	0	112.1	N248 L250 D276 G278 Y282 Y283 K284 A334	N248-Y280 PolarHBondContact OD1-OH 2.88Å; L250-Y280 HydrophobicContact CB-CD1 4.08Å; L250-Y280 HydrophobicContact CB-CG 4.15Å; L250-Y280 HydrophobicContact CD1-CD2 4.17Å; L250-Y280 HydrophobicContact CD1-CE2 4.48Å; L250-Y280 HydrophobicContact CD1-CG 4.4Å; D276-Y280 WeakPolarHBondContact O-CB 3.3Å; D276-Y280 PolarHBondContact O-N 2.89Å; G278-Y280 VanDerWaalsContact C-N 3.28Å; G278-Y280 PolarHBondContact O-N 2.77Å; Y280-Y282 PolarHBondContact O-N 3.15Å; Y280-Y283 WeakPolarHBondContact O-CB 3.24Å; Y280-Y283 PolarHBondContact O-N 2.68Å; Y280-Y283 VanDerWaalsContact O-N 3.14Å; Y280-K284 HydrophobicContact CD1-CG 4.16Å; Y280-K284 HydrophobicContact CE1-CG 3.76Å; Y280-K284 HydrophobicContact CE2-CG 4.36Å; Y280-K284 WeakPolarHBondContact O-CG 3.46Å; Y280-K284 PolarHBondContact O-N 2.73Å; Y280-K284 WeakPolarHBondContact OH-CE 3.38Å; Y280-A334 HydrophobicContact CD2-CB 3.79Å
281	S	97.4	Very high	95.4	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.007	21%	0.208	C	C	.	.	H	α-helix	trans	-61.7	-44.9	-179.6	-60.7	0	0	0	0	111.7	F240 F241 S277 G278 Y283 K284 A285	F240-S281 VanDerWaalsContact C-OG 3.32Å; F240-S281 PolarHBondContact O-OG 2.82Å; F240-S281 VanDerWaalsContact O-OG 3.13Å; F241-S281 WeakPolarHBondContact CA-OG 3.03Å; F241-S281 PolarHBondContact N-OG 2.89Å; S277-S281 WeakPolarHBondContact O-CB 3.43Å; S277-S281 PolarHBondContact O-N 3.13Å; S277-S281 PolarHBondContact O-OG 3.27Å; G278-S281 PolarHBondContact O-N 3.34Å; S281-Y283 VanDerWaalsContact C-N 3.32Å; S281-Y283 PolarHBondContact O-N 2.83Å; S281-K284 PolarHBondContact O-N 2.92Å; S281-A285 WeakPolarHBondContact O-CB 3.08Å; S281-A285 PolarHBondContact O-N 2.82Å
282	Y	96.4	Very high	94.7	Very high	38 Å²	38	42 Å²	42	15%	0.149	21%	0.212	C	C	.	.	H	α-helix	trans	-65.6	-33.7	174.4	-78.7	-62.1	0	0	0	113.3	D212 V215 G278 Y280 G286 I287 F288	D212-Y282 VanDerWaalsContact OD2-CE1 3.3Å; D212-Y282 WeakPolarHBondContact OD2-CE1 3.43Å; D212-Y282 PolarHBondContact OD2-OH 3.4Å; V215-Y282 HydrophobicContact CB-CE1 4.33Å; V215-Y282 HydrophobicContact CG1-CD1 3.63Å; V215-Y282 HydrophobicContact CG1-CD2 4.27Å; V215-Y282 HydrophobicContact CG1-CE1 3.76Å; V215-Y282 HydrophobicContact CG1-CE2 4.37Å; V215-Y282 HydrophobicContact CG1-CG 3.93Å; V215-Y282 HydrophobicContact CG2-CD1 4.29Å; V215-Y282 HydrophobicContact CG2-CD2 4.35Å; V215-Y282 HydrophobicContact CG2-CE1 3.61Å; V215-Y282 HydrophobicContact CG2-CE2 3.66Å; V215-Y282 WeakPolarHBondContact CG2-OH 3.45Å; G278-Y282 VanDerWaalsContact O-CD2 3.25Å; G278-Y282 WeakPolarHBondContact O-CD2 3.38Å; G278-Y282 PolarHBondContact O-N 3.31Å; Y280-Y282 PolarHBondContact O-N 3.15Å; Y282-G286 PolarHBondContact O-N 3.14Å; Y282-I287 HydrophobicContact CD1-CD1 3.23Å; Y282-I287 HydrophobicContact CD1-CG1 3.85Å; Y282-I287 HydrophobicContact CE1-CD1 3.9Å; Y282-I287 HydrophobicContact CG-CD1 3.82Å; Y282-I287 HydrophobicContact CG-CG1 4.29Å; Y282-I287 VanDerWaalsContact O-CG1 3.29Å; Y282-I287 WeakPolarHBondContact O-CG1 3.33Å; Y282-I287 PolarHBondContact O-N 2.87Å; Y282-F288 VanDerWaalsContact CB-CE2 3.5Å; Y282-F288 HydrophobicContact CG-CZ 4.47Å
283	Y	96.7	Very high	93.9	Very high	65 Å²	65	41.9 Å²	41.9	26%	0.255	22%	0.217	S	C	.	.	H	α-helix	trans	-64.9	-42	173.3	169.9	-102	0	0	0	111.8	L279 Y280 S281 G286 L331 N332 A334	L279-Y283 WeakPolarHBondContact O-CB 3.19Å; L279-Y283 PolarHBondContact O-N 2.77Å; Y280-Y283 WeakPolarHBondContact O-CB 3.24Å; Y280-Y283 PolarHBondContact O-N 2.68Å; Y280-Y283 VanDerWaalsContact O-N 3.14Å; S281-Y283 VanDerWaalsContact C-N 3.32Å; S281-Y283 PolarHBondContact O-N 2.83Å; Y283-G286 PolarHBondContact O-N 3.43Å; Y283-G286 VanDerWaalsContact O-N 3.1Å; Y283-L331 HydrophobicContact CD2-CB 3.88Å; Y283-L331 HydrophobicContact CD2-CD1 4.33Å; Y283-L331 HydrophobicContact CE2-CB 3.91Å; Y283-N332 PolarHBondContact OH-O 3.37Å; Y283-A334 HydrophobicContact CD1-CB 3.77Å; Y283-A334 HydrophobicContact CE1-CB 4.4Å; Y283-A334 HydrophobicContact CG-CB 3.99Å
284	K	96.3	Very high	93	Very high	85 Å²	85	43 Å²	43	37%	0.37	22%	0.223	S	C	.	.	H	α-helix	trans	-68.6	-35.4	176.8	-67.8	-58.5	-168.2	176.1	0	113.3	E242 N248 Y280 S281 G286	E242-K284 VanDerWaalsContact OE2-CB 3.3Å; E242-K284 WeakPolarHBondContact OE2-CB 3.02Å; N248-K284 WeakPolarHBondContact ND2-CD 2.85Å; N248-K284 WeakPolarHBondContact ND2-CG 3.44Å; Y280-K284 HydrophobicContact CD1-CG 4.16Å; Y280-K284 HydrophobicContact CE1-CG 3.76Å; Y280-K284 HydrophobicContact CE2-CG 4.36Å; Y280-K284 WeakPolarHBondContact O-CG 3.46Å; Y280-K284 PolarHBondContact O-N 2.73Å; Y280-K284 WeakPolarHBondContact OH-CE 3.38Å; S281-K284 PolarHBondContact O-N 2.92Å; K284-G286 PolarHBondContact O-N 3.38Å
285	A	95.6	Very high	92	Very high	27 Å²	27	50.4 Å²	50.4	22%	0.223	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-6.2	170.1	0	0	0	0	0	114.1	Y214 E242 S281 I287	Y214-A285 HydrophobicContact CD1-CB 4.47Å; E242-A285 HydrophobicContact CG-CB 4.2Å; E242-A285 WeakPolarHBondContact OE1-CA 3.33Å; S281-A285 WeakPolarHBondContact O-CB 3.08Å; S281-A285 PolarHBondContact O-N 2.82Å; A285-I287 VanDerWaalsContact C-N 3.27Å; A285-I287 HydrophobicContact CB-CG2 4.13Å; A285-I287 PolarHBondContact O-N 3.24Å
286	G	93.8	Very high	90.9	Very high	34 Å²	34	58.9 Å²	58.9	35%	0.351	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	14.6	174.8	0	0	0	0	0	114.8	Y282 Y283 K284 F288	Y282-G286 PolarHBondContact O-N 3.14Å; Y283-G286 PolarHBondContact O-N 3.43Å; Y283-G286 VanDerWaalsContact O-N 3.1Å; K284-G286 PolarHBondContact O-N 3.38Å; G286-F288 VanDerWaalsContact C-N 3.35Å; G286-F288 PolarHBondContact O-N 3.11Å
287	I	93.1	Very high	89.9	Confident	50 Å²	50	58.1 Å²	58.1	26%	0.256	29%	0.285	S	S	.	.			trans	-79.1	-16.8	-172.6	67.1	146	0	0	0	113.9	Y214 Y282 A285 Q289	Y214-I287 HydrophobicContact CD1-CG2 3.66Å; Y214-I287 HydrophobicContact CD2-CG2 3.99Å; Y214-I287 HydrophobicContact CE1-CG2 3.61Å; Y214-I287 HydrophobicContact CE2-CG2 3.94Å; Y214-I287 HydrophobicContact CG-CG2 3.83Å; Y282-I287 HydrophobicContact CD1-CD1 3.23Å; Y282-I287 HydrophobicContact CD1-CG1 3.85Å; Y282-I287 HydrophobicContact CE1-CD1 3.9Å; Y282-I287 HydrophobicContact CG-CD1 3.82Å; Y282-I287 HydrophobicContact CG-CG1 4.29Å; Y282-I287 VanDerWaalsContact O-CG1 3.29Å; Y282-I287 WeakPolarHBondContact O-CG1 3.33Å; Y282-I287 PolarHBondContact O-N 2.87Å; A285-I287 VanDerWaalsContact C-N 3.27Å; A285-I287 HydrophobicContact CB-CG2 4.13Å; A285-I287 PolarHBondContact O-N 3.24Å; I287-Q289 PolarHBondContact O-N 2.89Å
288	F	92.5	Very high	89	Confident	67 Å²	67	60.7 Å²	60.7	29%	0.294	30%	0.302	S	S	.	.			trans	-85.1	59.4	-179.5	-60.7	-60.8	0	0	0	112.2	L279 Y282 G286 L331 P335	L279-F288 HydrophobicContact CD2-CZ 4.5Å; Y282-F288 VanDerWaalsContact CB-CE2 3.5Å; Y282-F288 HydrophobicContact CG-CZ 4.47Å; G286-F288 VanDerWaalsContact C-N 3.35Å; G286-F288 PolarHBondContact O-N 3.11Å; F288-L331 HydrophobicContact CB-CB 4.29Å; F288-L331 HydrophobicContact CB-CD1 3.43Å; F288-L331 VanDerWaalsContact CB-CD1 3.43Å; F288-L331 HydrophobicContact CB-CG 3.48Å; F288-L331 VanDerWaalsContact CB-CG 3.48Å; F288-L331 HydrophobicContact CD1-CD1 4.3Å; F288-L331 HydrophobicContact CD2-CD1 3.39Å; F288-L331 HydrophobicContact CD2-CG 4.39Å; F288-L331 HydrophobicContact CE2-CD1 4.16Å; F288-L331 HydrophobicContact CG-CD1 3.48Å; F288-L331 VanDerWaalsContact CG-CD1 3.48Å; F288-L331 HydrophobicContact CG-CG 4.12Å; F288-L331 PolarHBondContact O-N 2.91Å; F288-P335 HydrophobicContact CE2-CG 4.49Å
289	Q	91.2	Very high	88.2	Confident	125 Å²	125	68.6 Å²	68.6	58%	0.584	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.2	137.2	174.7	-61.9	-178.8	-0.9	0	0	109.3	I287 L329 E330	I287-Q289 PolarHBondContact O-N 2.89Å; Q289-L329 CarbonylContact C-O 3.55Å; Q289-L329 WeakPolarHBondContact CA-O 3.33Å; Q289-E330 HydrophobicContact CG-CB 4.11Å
290	M	87.5	Confident	87.1	Confident	73 Å²	73	72.4 Å²	72.4	36%	0.36	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	143.6	175.7	64.7	-175	124	0	0	111.5	R328 L329 I424	M290-R328 WeakPolarHBondContact O-CA 3.4Å; M290-L329 HydrophobicContact CE-CB 3.92Å; M290-L329 HydrophobicContact CE-CD1 3.72Å; M290-L329 HydrophobicContact CE-CG 4.45Å; M290-L329 HydrophobicContact CG-CB 3.72Å; M290-L329 HydrophobicContact CG-CD1 4.1Å; M290-L329 HydrophobicContact CG-CG 4.2Å; M290-L329 PolarHBondContact N-O 2.95Å; M290-L329 PolarHBondContact O-N 3.25Å; M290-L329 HydrophobicContact SD-CB 4.43Å; M290-L329 HydrophobicContact SD-CD1 3.89Å; M290-I424 HydrophobicContact CE-CD1 3.54Å; M290-I424 HydrophobicContact CE-CG1 4.09Å; M290-I424 HydrophobicContact CE-CG2 4.14Å; M290-I424 HydrophobicContact SD-CD1 3.61Å; M290-I424 HydrophobicContact SD-CG1 3.74Å
291	N	86.9	Confident	86.1	Confident	112 Å²	112	70.7 Å²	70.7	60%	0.599	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.4	121.5	170.9	-66.6	-37.4	0	0	0	109	L327 R328	N291-L327 CarbonylContact C-O 3.58Å; N291-L327 WeakPolarHBondContact CA-O 3.27Å; N291-R328 WeakPolarHBondContact OD1-CB 3.45Å; N291-R328 VanDerWaalsContact OD1-CG 3.23Å; N291-R328 WeakPolarHBondContact OD1-CG 3.41Å
292	I	83	Confident	85.2	Confident	15 Å²	15	72.4 Å²	72.4	8%	0.077	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	101.1	170.5	-58.2	161.2	0	0	0	106.3	M297 S326 L327 L329 M419	I292-M297 HydrophobicContact CG2-CB 4.47Å; I292-M297 HydrophobicContact CG2-CE 4.49Å; I292-S326 VanDerWaalsContact O-CA 3.31Å; I292-S326 WeakPolarHBondContact O-CA 3.4Å; I292-S326 WeakPolarHBondContact O-CB 3.37Å; I292-L327 HydrophobicContact CB-CB 4.23Å; I292-L327 HydrophobicContact CD1-CB 4.43Å; I292-L327 PolarHBondContact N-O 3.05Å; I292-L327 PolarHBondContact O-N 3.48Å; I292-L329 HydrophobicContact CD1-CD1 3.59Å; I292-L329 HydrophobicContact CD1-CG 4.17Å; I292-M419 HydrophobicContact CD1-CE 3.55Å; I292-M419 HydrophobicContact CD1-SD 4.16Å; I292-M419 HydrophobicContact CG1-CE 4.12Å; I292-M419 HydrophobicContact CG2-CE 3.99Å
293	A	81.6	Confident	84.3	Confident	36 Å²	36	76 Å²	76	30%	0.298	38%	0.376	S	S	.	.			trans	-70.3	160.2	174.1	0	0	0	0	0	111.2	E295 R296 M297	A293-E295 VanDerWaalsContact C-N 3.27Å; A293-E295 WeakPolarHBondContact CB-OE2 3.47Å; A293-E295 PolarHBondContact O-N 3.13Å; A293-R296 PolarHBondContact O-N 3.36Å; A293-R296 VanDerWaalsContact O-N 3.14Å; A293-M297 PolarHBondContact O-N 3.13Å
294	N	78.1	Confident	83.3	Confident	31 Å²	31	75.3 Å²	75.3	17%	0.166	38%	0.376	C	S	.	.	G	3₁₀ helix	trans	-56.5	-41	-174.9	-163.9	28.5	0	0	0	112.3	R296 M297 E302 P324 I325	N294-R296 PolarHBondContact O-N 2.84Å; N294-M297 WeakPolarHBondContact O-CB 3.15Å; N294-M297 PolarHBondContact O-N 3.38Å; N294-E302 VanDerWaalsContact OD1-CD 3.25Å; N294-E302 PolarHBondContact OD1-OE1 2.77Å; N294-E302 PolarHBondContact OD1-OE2 3.36Å; N294-P324 HydrophobicContact CB-CB 3.94Å; N294-I325 WeakPolarHBondContact CA-O 3.25Å; N294-I325 VanDerWaalsContact CB-O 3.26Å; N294-I325 WeakPolarHBondContact CB-O 3.36Å; N294-I325 PolarHBondContact N-O 2.98Å
295	E	77.1	Confident	82.4	Confident	159 Å²	159	71.4 Å²	71.4	74%	0.743	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-67.6	-22.6	-175	-53.4	75.4	-160.7	0	0	112.9	A293	A293-E295 VanDerWaalsContact C-N 3.27Å; A293-E295 WeakPolarHBondContact CB-OE2 3.47Å; A293-E295 PolarHBondContact O-N 3.13Å
296	R	73.8	Confident	81.4	Confident	208 Å²	208	72.5 Å²	72.5	79%	0.785	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-97.2	-3.2	177.2	-63.1	-174.6	-177.1	174.7	1.4	112.2	A293 N294	A293-R296 PolarHBondContact O-N 3.36Å; A293-R296 VanDerWaalsContact O-N 3.14Å; N294-R296 PolarHBondContact O-N 2.84Å
297	M	78.2	Confident	80.3	Confident	11 Å²	11	75.1 Å²	75.1	5%	0.054	37%	0.367	C	S	.	.	S	Bend	trans	-83.8	134.4	178.2	-164.8	177.9	-62.7	0	0	110.3	I292 A293 N294 K299 L301 E302 L305 L327	I292-M297 HydrophobicContact CG2-CB 4.47Å; I292-M297 HydrophobicContact CG2-CE 4.49Å; A293-M297 PolarHBondContact O-N 3.13Å; N294-M297 WeakPolarHBondContact O-CB 3.15Å; N294-M297 PolarHBondContact O-N 3.38Å; M297-K299 PolarHBondContact O-N 2.94Å; M297-L301 HydrophobicContact CG-CB 4.29Å; M297-L301 HydrophobicContact CG-CD2 3.97Å; M297-L301 HydrophobicContact CG-CG 4.21Å; M297-L301 HydrophobicContact SD-CD2 4.3Å; M297-L301 HydrophobicContact SD-CG 4.18Å; M297-E302 HydrophobicContact SD-CB 4.06Å; M297-L305 HydrophobicContact CE-CD1 4.22Å; M297-L305 HydrophobicContact SD-CD1 3.71Å; M297-L327 HydrophobicContact CE-CB 4.46Å; M297-L327 HydrophobicContact CE-CD1 3.69Å; M297-L327 HydrophobicContact CE-CG 3.58Å
298	P	79.1	Confident	78.9	Confident	54 Å²	54	74.7 Å²	74.7	35%	0.351	37%	0.367	S	S	.	.			trans	-58.9	133.9	170.5	-23.4	33.7	0	0	0	111.1	D300 L301 E302 M419	P298-D300 PolarHBondContact O-N 3.19Å; P298-L301 HydrophobicContact CB-CB 4.24Å; P298-L301 WeakPolarHBondContact O-CA 3.33Å; P298-L301 WeakPolarHBondContact O-CB 3.29Å; P298-L301 PolarHBondContact O-N 3.41Å; P298-E302 PolarHBondContact O-N 2.94Å; P298-M419 HydrophobicContact CG-CG 4.02Å
299	K	79.1	Confident	77.4	Confident	172 Å²	172	72.1 Å²	72.1	75%	0.748	36%	0.356	S	S	*	.	H	α-helix	trans	-56.5	-36.4	-179.1	-69	-172.3	176.5	-175.9	0	113.1	M297 L301 E302 M303	M297-K299 PolarHBondContact O-N 2.94Å; K299-L301 VanDerWaalsContact C-N 3.32Å; K299-L301 PolarHBondContact O-N 3.38Å; K299-E302 PolarHBondContact O-N 3.13Å; K299-M303 WeakPolarHBondContact O-CB 3.45Å; K299-M303 PolarHBondContact O-N 2.92Å
300	D	74.4	Confident	75.8	Confident	118 Å²	118	66.4 Å²	66.4	63%	0.631	33%	0.329	S	S	*	.	H	α-helix	trans	-64.5	-38.6	176.7	-59.5	-29.6	0	0	0	111.5	P298 L304	P298-D300 PolarHBondContact O-N 3.19Å; D300-L304 VanDerWaalsContact O-CB 3.29Å; D300-L304 WeakPolarHBondContact O-CB 3.42Å; D300-L304 WeakPolarHBondContact O-CG 3.46Å; D300-L304 PolarHBondContact O-N 3.19Å
301	L	77.2	Confident	74.4	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.016	33%	0.33	C	S	.	.	H	α-helix	trans	-70.5	-42.3	176.1	178.5	62	0	0	0	111.1	M297 P298 K299 M303 L304 L305 L412 L416 M419	M297-L301 HydrophobicContact CG-CB 4.29Å; M297-L301 HydrophobicContact CG-CD2 3.97Å; M297-L301 HydrophobicContact CG-CG 4.21Å; M297-L301 HydrophobicContact SD-CD2 4.3Å; M297-L301 HydrophobicContact SD-CG 4.18Å; P298-L301 HydrophobicContact CB-CB 4.24Å; P298-L301 WeakPolarHBondContact O-CA 3.33Å; P298-L301 WeakPolarHBondContact O-CB 3.29Å; P298-L301 PolarHBondContact O-N 3.41Å; K299-L301 VanDerWaalsContact C-N 3.32Å; K299-L301 PolarHBondContact O-N 3.38Å; L301-M303 VanDerWaalsContact C-N 3.34Å; L301-M303 PolarHBondContact O-N 3.32Å; L301-L304 PolarHBondContact O-N 3.39Å; L301-L305 HydrophobicContact CD1-CD1 4.28Å; L301-L305 HydrophobicContact CD1-CG 4.19Å; L301-L305 HydrophobicContact CG-CD1 4.07Å; L301-L305 HydrophobicContact CG-CG 4.43Å; L301-L305 WeakPolarHBondContact O-CB 3.28Å; L301-L305 VanDerWaalsContact O-CG 3.26Å; L301-L305 WeakPolarHBondContact O-CG 3.25Å; L301-L305 PolarHBondContact O-N 3.43Å; L301-L412 HydrophobicContact CD1-CD2 4.18Å; L301-L416 HydrophobicContact CD1-CD2 3.51Å; L301-L416 HydrophobicContact CD1-CG 3.81Å; L301-L416 HydrophobicContact CD2-CD2 3.74Å; L301-L416 HydrophobicContact CG-CD2 4.25Å; L301-M419 HydrophobicContact CD2-CB 4.28Å; L301-M419 HydrophobicContact CD2-CG 4.03Å
302	E	78	Confident	72.8	Confident	37 Å²	37	64.3 Å²	64.3	17%	0.173	33%	0.331	C	S	.	.	H	α-helix	trans	-58.3	-48.2	175	-168.6	-164.7	164.7	0	0	110.7	N294 M297 P298 K299 L305 R306	N294-E302 VanDerWaalsContact OD1-CD 3.25Å; N294-E302 PolarHBondContact OD1-OE1 2.77Å; N294-E302 PolarHBondContact OD1-OE2 3.36Å; M297-E302 HydrophobicContact SD-CB 4.06Å; P298-E302 PolarHBondContact O-N 2.94Å; K299-E302 PolarHBondContact O-N 3.13Å; E302-L305 PolarHBondContact O-N 3.12Å; E302-R306 WeakPolarHBondContact O-CB 3.24Å; E302-R306 VanDerWaalsContact O-CG 3.27Å; E302-R306 WeakPolarHBondContact O-CG 3.36Å; E302-R306 PolarHBondContact O-N 2.76Å; E302-R306 IonicContact OE1-CZ 3.42Å; E302-R306 IonicContact OE1-NE 2.98Å; E302-R306 PolarHBondContact OE1-NE 2.63Å; E302-R306 IonicContact OE1-NH2 2.99Å; E302-R306 PolarHBondContact OE1-NH2 3.03Å
303	M	77.1	Confident	71.5	Confident	115 Å²	115	65.3 Å²	65.3	57%	0.567	34%	0.337	S	S	*	.	H	α-helix	trans	-62.9	-43.9	177.7	-172.1	-161.4	-59.4	0	0	111.6	K299 L301 R306 T307	K299-M303 WeakPolarHBondContact O-CB 3.45Å; K299-M303 PolarHBondContact O-N 2.92Å; L301-M303 VanDerWaalsContact C-N 3.34Å; L301-M303 PolarHBondContact O-N 3.32Å; M303-R306 PolarHBondContact O-N 3.05Å; M303-T307 HydrophobicContact CG-CG2 4.34Å; M303-T307 WeakPolarHBondContact O-CB 3.46Å; M303-T307 WeakPolarHBondContact O-CG2 3.23Å; M303-T307 PolarHBondContact O-N 2.95Å; M303-T307 PolarHBondContact O-OG1 3.05Å
304	L	76	Confident	70.1	Confident	50 Å²	50	65.3 Å²	65.3	26%	0.262	33%	0.331	S	S	.	.	H	α-helix	trans	-64.5	-43.3	178.2	-76.4	170.4	0	0	0	111.6	D300 L301 R306 T307 T308 L412 P415	D300-L304 VanDerWaalsContact O-CB 3.29Å; D300-L304 WeakPolarHBondContact O-CB 3.42Å; D300-L304 WeakPolarHBondContact O-CG 3.46Å; D300-L304 PolarHBondContact O-N 3.19Å; L301-L304 PolarHBondContact O-N 3.39Å; L304-R306 PolarHBondContact O-N 3.12Å; L304-T307 WeakPolarHBondContact CA-OG1 3.31Å; L304-T307 PolarHBondContact O-N 2.77Å; L304-T307 PolarHBondContact O-OG1 3.39Å; L304-T308 WeakPolarHBondContact O-CB 3.45Å; L304-T308 PolarHBondContact O-N 3.17Å; L304-T308 PolarHBondContact O-OG1 3.12Å; L304-L412 HydrophobicContact CB-CD2 3.51Å; L304-L412 HydrophobicContact CD1-CD2 4.41Å; L304-P415 HydrophobicContact CD1-CB 3.95Å; L304-P415 HydrophobicContact CD1-CG 3.61Å
305	L	76.4	Confident	68.9	Low	3 Å²	3	71.7 Å²	71.7	2%	0.016	36%	0.362	C	S	.	.	H	α-helix	trans	-56	-53.3	173.1	-74	169.4	0	0	0	109.4	M297 L301 E302 T307 T308 Y309 F310 L327 L412	M297-L305 HydrophobicContact CE-CD1 4.22Å; M297-L305 HydrophobicContact SD-CD1 3.71Å; L301-L305 HydrophobicContact CD1-CD1 4.28Å; L301-L305 HydrophobicContact CD1-CG 4.19Å; L301-L305 HydrophobicContact CG-CD1 4.07Å; L301-L305 HydrophobicContact CG-CG 4.43Å; L301-L305 WeakPolarHBondContact O-CB 3.28Å; L301-L305 VanDerWaalsContact O-CG 3.26Å; L301-L305 WeakPolarHBondContact O-CG 3.25Å; L301-L305 PolarHBondContact O-N 3.43Å; E302-L305 PolarHBondContact O-N 3.12Å; L305-T307 VanDerWaalsContact C-N 3.31Å; L305-T307 PolarHBondContact O-N 2.66Å; L305-T308 PolarHBondContact O-N 3.43Å; L305-Y309 PolarHBondContact O-N 3.37Å; L305-F310 VanDerWaalsContact C-CD2 3.48Å; L305-F310 HydrophobicContact CB-CD2 4.49Å; L305-F310 HydrophobicContact CB-CE2 4.06Å; L305-F310 WeakPolarHBondContact O-CD2 3.25Å; L305-F310 PolarHBondContact O-N 2.86Å; L305-L327 HydrophobicContact CD1-CD1 4.2Å; L305-L327 HydrophobicContact CD1-CD2 4.3Å; L305-L412 HydrophobicContact CD2-CD1 3.95Å; L305-L412 HydrophobicContact CD2-CD2 4.41Å
306	R	74.7	Confident	67.9	Low	49 Å²	49	71.3 Å²	71.3	19%	0.185	36%	0.362	C	S	.	.	H	α-helix	trans	-57.3	-37	178.6	-72.1	175.8	-179.7	-77	-0.2	114	E302 M303 L304 F310 G311 M314 V321 Y323 I325	E302-R306 WeakPolarHBondContact O-CB 3.24Å; E302-R306 VanDerWaalsContact O-CG 3.27Å; E302-R306 WeakPolarHBondContact O-CG 3.36Å; E302-R306 PolarHBondContact O-N 2.76Å; E302-R306 IonicContact OE1-CZ 3.42Å; E302-R306 IonicContact OE1-NE 2.98Å; E302-R306 PolarHBondContact OE1-NE 2.63Å; E302-R306 IonicContact OE1-NH2 2.99Å; E302-R306 PolarHBondContact OE1-NH2 3.03Å; M303-R306 PolarHBondContact O-N 3.05Å; L304-R306 PolarHBondContact O-N 3.12Å; R306-F310 VanDerWaalsContact O-CB 3.27Å; R306-F310 WeakPolarHBondContact O-CB 3.49Å; R306-G311 PolarHBondContact O-N 2.86Å; R306-M314 HydrophobicContact CB-CE 4.19Å; R306-M314 HydrophobicContact CG-CE 4.02Å; R306-V321 PolarHBondContact NH1-O 2.78Å; R306-Y323 PolarHBondContact NH2-O 2.65Å; R306-I325 HydrophobicContact CG-CD1 3.64Å
307	T	70.7	Confident	67.5	Low	89 Å²	89	65 Å²	65	55%	0.546	34%	0.344	S	S	.	.	H	α-helix	trans	-86.9	-36	-175.9	49.6	0	0	0	0	113	M303 L304 L305	M303-T307 HydrophobicContact CG-CG2 4.34Å; M303-T307 WeakPolarHBondContact O-CB 3.46Å; M303-T307 WeakPolarHBondContact O-CG2 3.23Å; M303-T307 PolarHBondContact O-N 2.95Å; M303-T307 PolarHBondContact O-OG1 3.05Å; L304-T307 WeakPolarHBondContact CA-OG1 3.31Å; L304-T307 PolarHBondContact O-N 2.77Å; L304-T307 PolarHBondContact O-OG1 3.39Å; L305-T307 VanDerWaalsContact C-N 3.31Å; L305-T307 PolarHBondContact O-N 2.66Å
308	T	65.4	Low	67	Low	42 Å²	42	69 Å²	69	26%	0.258	37%	0.37	S	S	.	.	H	α-helix	trans	-89.3	-45.6	-175.8	56	0	0	0	0	113.4	L304 L305	L304-T308 WeakPolarHBondContact O-CB 3.45Å; L304-T308 PolarHBondContact O-N 3.17Å; L304-T308 PolarHBondContact O-OG1 3.12Å; L305-T308 PolarHBondContact O-N 3.43Å
309	Y	60.3	Low	66.5	Low	13 Å²	13	69 Å²	69	5%	0.051	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-33.3	-174.4	-153.7	-85.7	0	0	0	112.2	L305 I313 S367 M369 E405 L409	L305-Y309 PolarHBondContact O-N 3.37Å; Y309-I313 HydrophobicContact CD1-CD1 4.07Å; Y309-I313 HydrophobicContact CE1-CD1 3.71Å; Y309-S367 WeakPolarHBondContact CE1-OG 3.15Å; Y309-S367 WeakPolarHBondContact OH-CB 3.44Å; Y309-S367 PolarHBondContact OH-OG 2.93Å; Y309-M369 HydrophobicContact CD1-CE 4.19Å; Y309-M369 HydrophobicContact CD2-CE 3.43Å; Y309-M369 VanDerWaalsContact CD2-CE 3.43Å; Y309-M369 HydrophobicContact CE1-CE 4.24Å; Y309-M369 HydrophobicContact CE2-CE 3.45Å; Y309-M369 VanDerWaalsContact CE2-CE 3.45Å; Y309-M369 HydrophobicContact CG-CE 3.81Å; Y309-E405 VanDerWaalsContact OH-CD 3.26Å; Y309-E405 PolarHBondContact OH-OE1 3Å; Y309-E405 VanDerWaalsContact OH-OE1 3.1Å; Y309-L409 HydrophobicContact CD2-CD2 3.96Å; Y309-L409 HydrophobicContact CE2-CD2 4.26Å
310	F	57.7	Low	66	Low	5 Å²	5	62.5 Å²	62.5	2%	0.022	35%	0.349	C	S	.	.	H	α-helix	trans	-90.3	-10.7	-175.4	-65.1	-119.9	0	0	0	113.1	L305 R306 T312 I313 M314 I325 V354 V356 L366	L305-F310 VanDerWaalsContact C-CD2 3.48Å; L305-F310 HydrophobicContact CB-CD2 4.49Å; L305-F310 HydrophobicContact CB-CE2 4.06Å; L305-F310 WeakPolarHBondContact O-CD2 3.25Å; L305-F310 PolarHBondContact O-N 2.86Å; R306-F310 VanDerWaalsContact O-CB 3.27Å; R306-F310 WeakPolarHBondContact O-CB 3.49Å; F310-T312 PolarHBondContact O-N 2.84Å; F310-T312 VanDerWaalsContact O-N 3.14Å; F310-I313 PolarHBondContact O-N 2.78Å; F310-M314 HydrophobicContact CB-CE 3.78Å; F310-M314 HydrophobicContact CB-CG 3.77Å; F310-M314 HydrophobicContact CB-SD 3.57Å; F310-M314 VanDerWaalsContact CB-SD 3.57Å; F310-M314 HydrophobicContact CD1-CE 3.91Å; F310-M314 HydrophobicContact CD1-CG 4.35Å; F310-M314 HydrophobicContact CG-CE 4.15Å; F310-M314 WeakPolarHBondContact O-CA 3.02Å; F310-M314 WeakPolarHBondContact O-CB 3.34Å; F310-M314 VanDerWaalsContact O-CG 3.28Å; F310-M314 WeakPolarHBondContact O-CG 3.33Å; F310-M314 PolarHBondContact O-N 2.97Å; F310-I325 HydrophobicContact CD1-CD1 4.46Å; F310-I325 HydrophobicContact CE1-CD1 3.64Å; F310-I325 HydrophobicContact CE1-CG1 3.94Å; F310-I325 HydrophobicContact CE2-CD1 3.86Å; F310-I325 HydrophobicContact CZ-CD1 3.29Å; F310-I325 HydrophobicContact CZ-CG1 3.68Å; F310-I325 HydrophobicContact CZ-CG2 4.04Å; F310-V354 HydrophobicContact CE2-CG1 3.97Å; F310-V354 HydrophobicContact CZ-CG1 3.66Å; F310-V356 HydrophobicContact CE1-CG2 4.22Å; F310-L366 HydrophobicContact CD1-CD1 3.77Å; F310-L366 HydrophobicContact CE1-CD1 3.1Å; F310-L366 HydrophobicContact CZ-CD1 3.63Å
311	G	57	Low	65.6	Low	37 Å²	37	59.7 Å²	59.7	38%	0.381	34%	0.335	S	S	.	.	H	α-helix	trans	-55.6	-34.1	179.7	0	0	0	0	0	114	R306 M315	R306-G311 PolarHBondContact O-N 2.86Å; G311-M315 WeakPolarHBondContact O-CG 3.38Å
312	T	54.1	Low	65.4	Low	103 Å²	103	68 Å²	68	63%	0.632	37%	0.374	S	S	*	.	H	α-helix	trans	-94.1	-32.4	177.9	43.3	0	0	0	0	113.9	F310	F310-T312 PolarHBondContact O-N 2.84Å; F310-T312 VanDerWaalsContact O-N 3.14Å
313	I	54.6	Low	65.5	Low	36 Å²	36	69.4 Å²	69.4	19%	0.185	38%	0.378	C	S	.	.	H	α-helix	trans	-78.2	-35.7	177.4	-61.9	176.1	0	0	0	111.8	Y309 F310 M315 M316 N317 L366	Y309-I313 HydrophobicContact CD1-CD1 4.07Å; Y309-I313 HydrophobicContact CE1-CD1 3.71Å; F310-I313 PolarHBondContact O-N 2.78Å; I313-M315 PolarHBondContact O-N 2.82Å; I313-M316 HydrophobicContact CB-CE 4.36Å; I313-M316 HydrophobicContact CG1-CE 4.14Å; I313-M316 HydrophobicContact CG2-CE 4.39Å; I313-M316 PolarHBondContact O-N 3.43Å; I313-N317 PolarHBondContact O-N 2.8Å; I313-L366 HydrophobicContact CG2-CD2 4.45Å
314	M	52.9	Low	65.8	Low	37 Å²	37	66 Å²	66	18%	0.182	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-26.7	172.4	-77.8	168	166.6	0	0	112.6	R306 F310 M316 N317 V321	R306-M314 HydrophobicContact CB-CE 4.19Å; R306-M314 HydrophobicContact CG-CE 4.02Å; F310-M314 HydrophobicContact CB-CE 3.78Å; F310-M314 HydrophobicContact CB-CG 3.77Å; F310-M314 HydrophobicContact CB-SD 3.57Å; F310-M314 VanDerWaalsContact CB-SD 3.57Å; F310-M314 HydrophobicContact CD1-CE 3.91Å; F310-M314 HydrophobicContact CD1-CG 4.35Å; F310-M314 HydrophobicContact CG-CE 4.15Å; F310-M314 WeakPolarHBondContact O-CA 3.02Å; F310-M314 WeakPolarHBondContact O-CB 3.34Å; F310-M314 VanDerWaalsContact O-CG 3.28Å; F310-M314 WeakPolarHBondContact O-CG 3.33Å; F310-M314 PolarHBondContact O-N 2.97Å; M314-M316 PolarHBondContact O-N 2.84Å; M314-N317 CarbonylContact O-C 3.59Å; M314-V321 HydrophobicContact CB-CG2 3.98Å; M314-V321 HydrophobicContact CE-CB 4.34Å; M314-V321 HydrophobicContact CE-CG1 4.12Å; M314-V321 HydrophobicContact CE-CG2 4.19Å; M314-V321 HydrophobicContact CG-CG2 3.63Å; M314-V321 HydrophobicContact SD-CG2 4.03Å
315	M	52.7	Low	66.1	Low	165 Å²	165	63.7 Å²	63.7	81%	0.813	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-22	173.4	-77.4	-169.5	171.4	0	0	112.9	G311 I313	G311-M315 WeakPolarHBondContact O-CG 3.38Å; I313-M315 PolarHBondContact O-N 2.82Å
316	M	56.4	Low	66.6	Low	151 Å²	151	63.9 Å²	63.9	74%	0.744	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-30.5	178.2	-65	-169.5	-73.7	0	0	113.1	I313 M314	I313-M316 HydrophobicContact CB-CE 4.36Å; I313-M316 HydrophobicContact CG1-CE 4.14Å; I313-M316 HydrophobicContact CG2-CE 4.39Å; I313-M316 PolarHBondContact O-N 3.43Å; M314-M316 PolarHBondContact O-N 2.84Å
317	N	65.9	Low	67.2	Low	75 Å²	75	61.9 Å²	61.9	40%	0.401	35%	0.347	S	S	.	.			trans	-147.8	96.2	175.5	-167.8	-18.5	0	0	0	111.9	I313 M314 A319 L320	I313-N317 PolarHBondContact O-N 2.8Å; M314-N317 CarbonylContact O-C 3.59Å; N317-A319 PolarHBondContact O-N 3.22Å; N317-A319 WeakPolarHBondContact OD1-CB 3.13Å; N317-A319 PolarHBondContact OD1-N 3.1Å; N317-L320 HydrophobicContact CB-CD1 4.02Å; N317-L320 HydrophobicContact CB-CG 4.22Å; N317-L320 PolarHBondContact O-N 3.36Å
318	P	67.3	Low	68.2	Low	94 Å²	94	61.6 Å²	61.6	61%	0.61	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-62	-24.5	-178.3	-22.4	32.4	0	0	0	114.2	L320 V321	P318-L320 PolarHBondContact O-N 3.05Å; P318-V321 VanDerWaalsContact O-CB 3.3Å; P318-V321 WeakPolarHBondContact O-CB 3.42Å; P318-V321 WeakPolarHBondContact O-CG2 3.33Å; P318-V321 PolarHBondContact O-N 2.81Å; P318-V321 VanDerWaalsContact O-N 3.15Å
319	A	69	Low	69.4	Low	56 Å²	56	60 Å²	60	46%	0.463	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-66	-21.7	-179	0	0	0	0	0	112.7	N317 V321 Y323	N317-A319 PolarHBondContact O-N 3.22Å; N317-A319 WeakPolarHBondContact OD1-CB 3.13Å; N317-A319 PolarHBondContact OD1-N 3.1Å; A319-V321 VanDerWaalsContact C-N 3.27Å; A319-V321 PolarHBondContact O-N 2.97Å; A319-Y323 VanDerWaalsContact O-CE2 3.29Å; A319-Y323 WeakPolarHBondContact O-CE2 3.39Å
320	L	67.8	Low	71	Confident	35 Å²	35	61.5 Å²	61.5	18%	0.183	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-78.9	-8.5	178.4	-60.8	177.3	0	0	0	113.3	N317 P318 Y323 V356 L366	N317-L320 HydrophobicContact CB-CD1 4.02Å; N317-L320 HydrophobicContact CB-CG 4.22Å; N317-L320 PolarHBondContact O-N 3.36Å; P318-L320 PolarHBondContact O-N 3.05Å; L320-Y323 HydrophobicContact CD2-CD2 3.9Å; L320-Y323 HydrophobicContact CD2-CE2 4.02Å; L320-V356 HydrophobicContact CD2-CG1 4.39Å; L320-L366 HydrophobicContact CD1-CD2 4.22Å
321	V	66.7	Low	72.8	Confident	58 Å²	58	62.7 Å²	62.7	35%	0.352	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-66.6	-37.9	-176.5	174.9	0	0	0	0	111.9	R306 M314 P318 A319 Y323	R306-V321 PolarHBondContact NH1-O 2.78Å; M314-V321 HydrophobicContact CB-CG2 3.98Å; M314-V321 HydrophobicContact CE-CB 4.34Å; M314-V321 HydrophobicContact CE-CG1 4.12Å; M314-V321 HydrophobicContact CE-CG2 4.19Å; M314-V321 HydrophobicContact CG-CG2 3.63Å; M314-V321 HydrophobicContact SD-CG2 4.03Å; P318-V321 VanDerWaalsContact O-CB 3.3Å; P318-V321 WeakPolarHBondContact O-CB 3.42Å; P318-V321 WeakPolarHBondContact O-CG2 3.33Å; P318-V321 PolarHBondContact O-N 2.81Å; P318-V321 VanDerWaalsContact O-N 3.15Å; A319-V321 VanDerWaalsContact C-N 3.27Å; A319-V321 PolarHBondContact O-N 2.97Å; V321-Y323 VanDerWaalsContact C-N 3.34Å
322	E	71.9	Confident	74.6	Confident	177 Å²	177	65 Å²	65	83%	0.827	34%	0.344	S	S	*	.	S	Bend	trans	-84.4	-11.2	-172	-61.5	-171.3	165.9	0	0	113.4
323	Y	81.1	Confident	76.6	Confident	67 Å²	67	62.5 Å²	62.5	26%	0.263	33%	0.33	S	S	.	.	S	Bend	trans	-82.7	147	-175.5	-60.8	-31.8	0	0	0	112.5	R306 A319 L320 V321 V356 P358 P359	R306-Y323 PolarHBondContact NH2-O 2.65Å; A319-Y323 VanDerWaalsContact O-CE2 3.29Å; A319-Y323 WeakPolarHBondContact O-CE2 3.39Å; L320-Y323 HydrophobicContact CD2-CD2 3.9Å; L320-Y323 HydrophobicContact CD2-CE2 4.02Å; V321-Y323 VanDerWaalsContact C-N 3.34Å; Y323-V356 HydrophobicContact CD2-CG1 3.8Å; Y323-V356 HydrophobicContact CG-CG1 4.04Å; Y323-P358 HydrophobicContact CD2-CB 3.88Å; Y323-P358 HydrophobicContact CD2-CG 4.04Å; Y323-P358 HydrophobicContact CE2-CB 3.8Å; Y323-P358 HydrophobicContact CE2-CG 4.22Å; Y323-P358 HydrophobicContact CG-CB 4.31Å; Y323-P359 HydrophobicContact CE1-CG 4.05Å
324	P	83.4	Confident	78.6	Confident	45 Å²	45	61.8 Å²	61.8	29%	0.292	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-66.3	142.8	176.8	19.8	-25.6	0	0	0	111.8	N294 L357	N294-P324 HydrophobicContact CB-CB 3.94Å; P324-L357 WeakPolarHBondContact CD-O 3.38Å; P324-L357 HydrophobicContact CG-CB 4.16Å; P324-L357 PolarHBondContact O-N 3.39Å
325	I	82.3	Confident	80.7	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.005	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	141.5	179.3	-61.4	162.4	0	0	0	109.1	N294 R306 F310 V354 M355	N294-I325 WeakPolarHBondContact CA-O 3.25Å; N294-I325 VanDerWaalsContact CB-O 3.26Å; N294-I325 WeakPolarHBondContact CB-O 3.36Å; N294-I325 PolarHBondContact N-O 2.98Å; R306-I325 HydrophobicContact CG-CD1 3.64Å; F310-I325 HydrophobicContact CD1-CD1 4.46Å; F310-I325 HydrophobicContact CE1-CD1 3.64Å; F310-I325 HydrophobicContact CE1-CG1 3.94Å; F310-I325 HydrophobicContact CE2-CD1 3.86Å; F310-I325 HydrophobicContact CZ-CD1 3.29Å; F310-I325 HydrophobicContact CZ-CG1 3.68Å; F310-I325 HydrophobicContact CZ-CG2 4.04Å; I325-V354 HydrophobicContact CG2-CG1 3.91Å; I325-M355 CarbonylContact C-O 3.52Å; I325-M355 WeakPolarHBondContact CA-O 3.29Å
326	S	86.7	Confident	82.8	Confident	6 Å²	6	59.3 Å²	59.3	4%	0.042	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	149.4	169.3	60.5	0	0	0	0	110.9	I292 M355	I292-S326 VanDerWaalsContact O-CA 3.31Å; I292-S326 WeakPolarHBondContact O-CA 3.4Å; I292-S326 WeakPolarHBondContact O-CB 3.37Å; S326-M355 PolarHBondContact N-O 3.01Å; S326-M355 PolarHBondContact O-N 2.66Å; S326-M355 WeakPolarHBondContact OG-CE 3.19Å
327	L	87.2	Confident	84.7	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.042	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.2	173	-63.3	174.3	0	0	0	109.2	N291 I292 M297 L305 T353 V354	N291-L327 CarbonylContact C-O 3.58Å; N291-L327 WeakPolarHBondContact CA-O 3.27Å; I292-L327 HydrophobicContact CB-CB 4.23Å; I292-L327 HydrophobicContact CD1-CB 4.43Å; I292-L327 PolarHBondContact N-O 3.05Å; I292-L327 PolarHBondContact O-N 3.48Å; M297-L327 HydrophobicContact CE-CB 4.46Å; M297-L327 HydrophobicContact CE-CD1 3.69Å; M297-L327 HydrophobicContact CE-CG 3.58Å; L305-L327 HydrophobicContact CD1-CD1 4.2Å; L305-L327 HydrophobicContact CD1-CD2 4.3Å; L327-T353 WeakPolarHBondContact CA-O 2.9Å; L327-V354 HydrophobicContact CD2-CB 4.26Å; L327-V354 HydrophobicContact CD2-CG1 4.33Å; L327-V354 HydrophobicContact CD2-CG2 3.71Å
328	R	90.8	Very high	86.2	Confident	82 Å²	82	51.3 Å²	51.3	31%	0.309	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	121.4	166.7	-177.2	171.8	84.2	-159.1	5.2	109	M290 N291 E330 A352 T353 M355	M290-R328 WeakPolarHBondContact O-CA 3.4Å; N291-R328 WeakPolarHBondContact OD1-CB 3.45Å; N291-R328 VanDerWaalsContact OD1-CG 3.23Å; N291-R328 WeakPolarHBondContact OD1-CG 3.41Å; R328-E330 IonicContact CZ-OE1 3.27Å; R328-E330 IonicContact NE-OE1 2.95Å; R328-E330 IonicContact NH2-OE1 3.51Å; R328-E330 PolarHBondContact NH2-OE1 3.14Å; R328-A352 WeakPolarHBondContact O-CA 3.47Å; R328-T353 PolarHBondContact N-O 3.37Å; R328-T353 PolarHBondContact O-N 3.2Å; R328-M355 HydrophobicContact CB-CE 3.65Å; R328-M355 HydrophobicContact CB-SD 4.32Å
329	L	91.4	Very high	87.7	Confident	8 Å²	8	47 Å²	47	4%	0.042	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.2	175.3	-53	179	0	0	0	108.6	Q289 M290 I292 I351 A352 M371 L420 I424	Q289-L329 CarbonylContact C-O 3.55Å; Q289-L329 WeakPolarHBondContact CA-O 3.33Å; M290-L329 HydrophobicContact CE-CB 3.92Å; M290-L329 HydrophobicContact CE-CD1 3.72Å; M290-L329 HydrophobicContact CE-CG 4.45Å; M290-L329 HydrophobicContact CG-CB 3.72Å; M290-L329 HydrophobicContact CG-CD1 4.1Å; M290-L329 HydrophobicContact CG-CG 4.2Å; M290-L329 PolarHBondContact N-O 2.95Å; M290-L329 PolarHBondContact O-N 3.25Å; M290-L329 HydrophobicContact SD-CB 4.43Å; M290-L329 HydrophobicContact SD-CD1 3.89Å; I292-L329 HydrophobicContact CD1-CD1 3.59Å; I292-L329 HydrophobicContact CD1-CG 4.17Å; L329-I351 WeakPolarHBondContact CA-O 3.48Å; L329-A352 HydrophobicContact CD2-CB 3.46Å; L329-A352 VanDerWaalsContact CD2-CB 3.46Å; L329-M371 HydrophobicContact CD2-CE 3.95Å; L329-M371 HydrophobicContact CD2-SD 3.95Å; L329-L420 HydrophobicContact CD1-CD2 4.11Å; L329-I424 HydrophobicContact CD1-CD1 3.92Å
330	E	94.4	Very high	89.1	Confident	46 Å²	46	49.8 Å²	49.8	22%	0.215	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	144.7	178.3	62.9	-165.7	141.1	0	0	110.2	Q289 R328 A350 I351	Q289-E330 HydrophobicContact CG-CB 4.11Å; R328-E330 IonicContact CZ-OE1 3.27Å; R328-E330 IonicContact NE-OE1 2.95Å; R328-E330 IonicContact NH2-OE1 3.51Å; R328-E330 PolarHBondContact NH2-OE1 3.14Å; E330-A350 CarbonylContact O-C 3.59Å; E330-A350 VanDerWaalsContact O-CA 3.23Å; E330-A350 WeakPolarHBondContact O-CA 3.41Å; E330-A350 WeakPolarHBondContact O-CB 3.45Å; E330-I351 HydrophobicContact CG-CB 4.09Å; E330-I351 PolarHBondContact N-O 2.95Å; E330-I351 PolarHBondContact O-N 3.46Å
331	L	95.8	Very high	90.4	Very high	30 Å²	30	53 Å²	53	16%	0.157	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	134.3	176.5	-65.2	-169.7	0	0	0	111.7	Y283 F288 P335 V348 A350	Y283-L331 HydrophobicContact CD2-CB 3.88Å; Y283-L331 HydrophobicContact CD2-CD1 4.33Å; Y283-L331 HydrophobicContact CE2-CB 3.91Å; F288-L331 HydrophobicContact CB-CB 4.29Å; F288-L331 HydrophobicContact CB-CD1 3.43Å; F288-L331 VanDerWaalsContact CB-CD1 3.43Å; F288-L331 HydrophobicContact CB-CG 3.48Å; F288-L331 VanDerWaalsContact CB-CG 3.48Å; F288-L331 HydrophobicContact CD1-CD1 4.3Å; F288-L331 HydrophobicContact CD2-CD1 3.39Å; F288-L331 HydrophobicContact CD2-CG 4.39Å; F288-L331 HydrophobicContact CE2-CD1 4.16Å; F288-L331 HydrophobicContact CG-CD1 3.48Å; F288-L331 VanDerWaalsContact CG-CD1 3.48Å; F288-L331 HydrophobicContact CG-CG 4.12Å; F288-L331 PolarHBondContact O-N 2.91Å; L331-P335 HydrophobicContact CD1-CG 3.61Å; L331-V348 HydrophobicContact CD2-CG1 3.32Å; L331-A350 HydrophobicContact CD2-CB 3.83Å
332	N	94.4	Very high	91.8	Very high	86 Å²	86	55.1 Å²	55.1	46%	0.46	29%	0.289	S	S	.	.	S	Bend	trans	-75.1	-36.2	173.9	-173.2	50.8	0	0	0	111.4	Y283 T349 I351	Y283-N332 PolarHBondContact OH-O 3.37Å; N332-T349 HydrophobicContact CB-CG2 4.14Å; N332-T349 PolarHBondContact N-O 3.06Å; N332-I351 HydrophobicContact CB-CD1 4.35Å; N332-I351 HydrophobicContact CB-CG1 4.1Å
333	S	95.5	Very high	92.9	Very high	49 Å²	49	47.3 Å²	47.3	34%	0.343	26%	0.256	S	S	.	.	S	Bend	trans	-148.8	160.6	-178.3	64.3	0	0	0	0	110.8
334	A	96.6	Very high	93.7	Very high	21 Å²	21	44.4 Å²	44.4	17%	0.174	25%	0.245	C	C	.	.			trans	-53.4	132.7	172.6	0	0	0	0	0	111.1	Y280 Y283	Y280-A334 HydrophobicContact CD2-CB 3.79Å; Y283-A334 HydrophobicContact CD1-CB 3.77Å; Y283-A334 HydrophobicContact CE1-CB 4.4Å; Y283-A334 HydrophobicContact CG-CB 3.99Å
335	P	96.8	Very high	94.4	Very high	7 Å²	7	42.8 Å²	42.8	5%	0.045	23%	0.234	C	C	.	.			trans	-59.4	150.7	173.8	-24.8	35.3	0	0	0	112	L279 F288 L331 V346 A347 V348	L279-P335 HydrophobicContact CB-CB 4.09Å; L279-P335 HydrophobicContact CB-CG 4.37Å; L279-P335 HydrophobicContact CD1-CB 4.04Å; L279-P335 HydrophobicContact CD2-CB 4.12Å; L279-P335 HydrophobicContact CD2-CG 4.29Å; L279-P335 HydrophobicContact CG-CB 4.3Å; F288-P335 HydrophobicContact CE2-CG 4.49Å; L331-P335 HydrophobicContact CD1-CG 3.61Å; P335-V346 HydrophobicContact CB-CG1 3.91Å; P335-A347 WeakPolarHBondContact CA-O 3.48Å; P335-V348 HydrophobicContact CB-CG2 4.15Å; P335-V348 HydrophobicContact CG-CG2 4.36Å
336	K	96.7	Very high	95.1	Very high	144 Å²	144	43.8 Å²	43.8	63%	0.626	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-124	135.5	178.1	-68.9	-167.1	175.8	-170.5	0	112	V346 A347	K336-V346 CarbonylContact O-C 3.58Å; K336-V346 WeakPolarHBondContact O-CA 3.41Å; K336-A347 PolarHBondContact N-O 3.39Å; K336-A347 PolarHBondContact O-N 3.24Å
337	T	97.6	Very high	95.6	Very high	8 Å²	8	45.6 Å²	45.6	5%	0.049	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	145.7	176.7	-48.7	0	0	0	0	109.2	F275 D276 L279 I339 T345 V346	F275-T337 HydrophobicContact CB-CG2 4.14Å; F275-T337 WeakPolarHBondContact CB-OG1 3.49Å; F275-T337 HydrophobicContact CD2-CG2 4.48Å; F275-T337 HydrophobicContact CG-CG2 4.49Å; D276-T337 WeakPolarHBondContact OD1-CA 3.4Å; D276-T337 WeakPolarHBondContact OD1-CB 3.37Å; D276-T337 PolarHBondContact OD1-N 3.06Å; D276-T337 PolarHBondContact OD1-OG1 2.78Å; L279-T337 WeakPolarHBondContact CD1-OG1 3.32Å; T337-I339 HydrophobicContact CG2-CG1 4.02Å; T337-T345 CarbonylContact C-O 3.33Å; T337-T345 WeakPolarHBondContact CA-O 3.42Å; T337-V346 HydrophobicContact CG2-CG2 4.48Å
338	T	97.6	Very high	96.1	Very high	50 Å²	50	46.4 Å²	46.4	31%	0.307	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	120.8	168.8	-53.4	0	0	0	0	108.2	E272 K340 T345	E272-T338 VanDerWaalsContact OE1-CA 3.24Å; E272-T338 WeakPolarHBondContact OE1-CA 3.27Å; T338-K340 HydrophobicContact CG2-CG 4.25Å; T338-T345 PolarHBondContact N-O 3.24Å; T338-T345 PolarHBondContact O-N 2.84Å; T338-T345 PolarHBondContact O-OG1 2.95Å
339	I	98.3	Very high	96.4	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.8	179.4	-51.5	174.5	0	0	0	108.2	E272 F275 T337 A344 Y453 H454 G456 Y457 L458	E272-I339 HydrophobicContact CG-CB 4.16Å; E272-I339 HydrophobicContact CG-CD1 3.9Å; E272-I339 HydrophobicContact CG-CG1 3.74Å; E272-I339 PolarHBondContact OE1-N 3.17Å; F275-I339 HydrophobicContact CD2-CD1 4.12Å; F275-I339 HydrophobicContact CE2-CD1 4.05Å; T337-I339 HydrophobicContact CG2-CG1 4.02Å; I339-A344 HydrophobicContact CG1-CB 4.1Å; I339-Y453 HydrophobicContact CG2-CD1 3.88Å; I339-H454 CarbonylContact C-O 3.55Å; I339-H454 WeakPolarHBondContact CG2-O 3.5Å; I339-G456 PolarHBondContact O-N 3.23Å; I339-Y457 VanDerWaalsContact CG2-O 3.3Å; I339-Y457 WeakPolarHBondContact CG2-O 3.47Å; I339-L458 HydrophobicContact CD1-CD2 4.32Å; I339-L458 HydrophobicContact CD1-CG 4.48Å; I339-L458 HydrophobicContact CG2-CB 4.38Å
340	K	97.3	Very high	96.6	Very high	115 Å²	115	44.6 Å²	44.6	50%	0.5	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	166.8	174.5	-62.3	-172.7	177.6	-168.4	0	108.3	T338 S342 G343 Y453 H454	T338-K340 HydrophobicContact CG2-CG 4.25Å; K340-S342 PolarHBondContact O-N 3.02Å; K340-G343 PolarHBondContact N-O 2.88Å; K340-G343 CarbonylContact O-C 3.55Å; K340-G343 PolarHBondContact O-N 3.33Å; K340-Y453 VanDerWaalsContact O-CB 3.23Å; K340-Y453 WeakPolarHBondContact O-CB 3.3Å; K340-H454 CarbonylContact C-O 3.56Å; K340-H454 WeakPolarHBondContact CA-O 3.29Å; K340-H454 PolarHBondContact N-O 2.86Å
341	T	96.5	Very high	96.5	Very high	103 Å²	103	44.1 Å²	44.1	63%	0.632	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-25	174.5	56.4	0	0	0	0	114.4	G343 Y453	T341-G343 VanDerWaalsContact C-N 3.27Å; T341-G343 PolarHBondContact O-N 2.9Å; T341-Y453 WeakPolarHBondContact CA-O 3.35Å
342	S	94.8	Very high	96.3	Very high	103 Å²	103	42.8 Å²	42.8	72%	0.72	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-6.2	174.5	63	0	0	0	0	115.1	K340	K340-S342 PolarHBondContact O-N 3.02Å
343	G	96.1	Very high	96.1	Very high	13 Å²	13	38.8 Å²	38.8	13%	0.134	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	123.1	173.6	-175.3	0	0	0	0	0	114	K340 T341	K340-G343 PolarHBondContact N-O 2.88Å; K340-G343 CarbonylContact O-C 3.55Å; K340-G343 PolarHBondContact O-N 3.33Å; T341-G343 VanDerWaalsContact C-N 3.27Å; T341-G343 PolarHBondContact O-N 2.9Å
344	A	97.6	Very high	95.6	Very high	6 Å²	6	36.5 Å²	36.5	5%	0.05	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	142.7	178	0	0	0	0	0	112.2	I339 A377 Y453	I339-A344 HydrophobicContact CG1-CB 4.1Å; A344-A377 HydrophobicContact CB-CB 4.25Å; A344-A377 PolarHBondContact O-N 2.94Å; A344-Y453 HydrophobicContact CB-CD1 4.29Å; A344-Y453 HydrophobicContact CB-CE1 3.85Å
345	T	97.8	Very high	95.1	Very high	10 Å²	10	36.3 Å²	36.3	6%	0.061	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	145.8	176.1	61.7	0	0	0	0	111.5	T337 T338 K374 F375	T337-T345 CarbonylContact C-O 3.33Å; T337-T345 WeakPolarHBondContact CA-O 3.42Å; T338-T345 PolarHBondContact N-O 3.24Å; T338-T345 PolarHBondContact O-N 2.84Å; T338-T345 PolarHBondContact O-OG1 2.95Å; T345-K374 WeakPolarHBondContact OG1-CE 3.41Å; T345-K374 PolarHBondContact OG1-NZ 2.85Å; T345-F375 CarbonylContact C-O 3.6Å; T345-F375 WeakPolarHBondContact CA-O 3.32Å; T345-F375 WeakPolarHBondContact CB-O 3.25Å
346	V	97.9	Very high	94.6	Very high	22 Å²	22	36 Å²	36	13%	0.133	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	124.6	176.5	-177.8	0	0	0	0	108.9	L279 P335 K336 T337 V348 K374 F375 A377	L279-V346 HydrophobicContact CD1-CG1 3.91Å; L279-V346 HydrophobicContact CD1-CG2 4.47Å; P335-V346 HydrophobicContact CB-CG1 3.91Å; K336-V346 CarbonylContact O-C 3.58Å; K336-V346 WeakPolarHBondContact O-CA 3.41Å; T337-V346 HydrophobicContact CG2-CG2 4.48Å; V346-V348 HydrophobicContact CG1-CG2 4.13Å; V346-K374 CarbonylContact O-C 3.37Å; V346-K374 WeakPolarHBondContact O-CA 3.3Å; V346-F375 HydrophobicContact CB-CB 4.47Å; V346-F375 PolarHBondContact N-O 2.84Å; V346-F375 PolarHBondContact O-N 3.45Å; V346-A377 HydrophobicContact CG2-CB 4.33Å
347	A	97.8	Very high	94	Very high	45 Å²	45	31.9 Å²	31.9	37%	0.372	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	130.2	174.1	0	0	0	0	0	109.9	P335 K336	P335-A347 WeakPolarHBondContact CA-O 3.48Å; K336-A347 PolarHBondContact N-O 3.39Å; K336-A347 PolarHBondContact O-N 3.24Å
348	V	96.9	Very high	93.4	Very high	24 Å²	24	32.4 Å²	32.4	15%	0.145	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	128.7	-176.8	-179.4	0	0	0	0	108.3	L331 P335 V346 A373 F375	L331-V348 HydrophobicContact CD2-CG1 3.32Å; P335-V348 HydrophobicContact CB-CG2 4.15Å; P335-V348 HydrophobicContact CG-CG2 4.36Å; V346-V348 HydrophobicContact CG1-CG2 4.13Å; V348-A373 HydrophobicContact CB-CB 4.36Å; V348-A373 PolarHBondContact N-O 2.84Å; V348-A373 PolarHBondContact O-N 2.79Å; V348-F375 HydrophobicContact CB-CE2 4.19Å; V348-F375 HydrophobicContact CG2-CD2 3.84Å; V348-F375 HydrophobicContact CG2-CE2 3.75Å
349	T	96.4	Very high	92.7	Very high	39 Å²	39	35 Å²	35	24%	0.239	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	120	172.4	-50.5	0	0	0	0	108.3	N332 T370 M371	N332-T349 HydrophobicContact CB-CG2 4.14Å; N332-T349 PolarHBondContact N-O 3.06Å; T349-T370 HydrophobicContact CG2-CG2 3.93Å; T349-M371 CarbonylContact C-O 3.53Å; T349-M371 WeakPolarHBondContact CA-O 3.4Å
350	A	95.4	Very high	92	Very high	13 Å²	13	39.4 Å²	39.4	11%	0.107	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	154.2	-176.8	0	0	0	0	0	110.7	E330 L331 M371	E330-A350 CarbonylContact O-C 3.59Å; E330-A350 VanDerWaalsContact O-CA 3.23Å; E330-A350 WeakPolarHBondContact O-CA 3.41Å; E330-A350 WeakPolarHBondContact O-CB 3.45Å; L331-A350 HydrophobicContact CD2-CB 3.83Å; A350-M371 HydrophobicContact CB-CB 4.36Å; A350-M371 PolarHBondContact N-O 2.63Å; A350-M371 PolarHBondContact O-N 2.75Å
351	I	94	Very high	91.4	Very high	37 Å²	37	37 Å²	37	19%	0.19	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	130	168.4	-62.7	174.4	0	0	0	107.6	L329 E330 N332 S368 M369	L329-I351 WeakPolarHBondContact CA-O 3.48Å; E330-I351 HydrophobicContact CG-CB 4.09Å; E330-I351 PolarHBondContact N-O 2.95Å; E330-I351 PolarHBondContact O-N 3.46Å; N332-I351 HydrophobicContact CB-CD1 4.35Å; N332-I351 HydrophobicContact CB-CG1 4.1Å; I351-S368 WeakPolarHBondContact CG2-OG 3.11Å; I351-M369 CarbonylContact C-O 3.52Å; I351-M369 WeakPolarHBondContact CA-O 3.44Å
352	A	91.3	Very high	90.8	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.008	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	111.2	171.3	0	0	0	0	0	109.5	R328 L329 S368 M369 M371	R328-A352 WeakPolarHBondContact O-CA 3.47Å; L329-A352 HydrophobicContact CD2-CB 3.46Å; L329-A352 VanDerWaalsContact CD2-CB 3.46Å; A352-S368 WeakPolarHBondContact O-CA 3.32Å; A352-M369 HydrophobicContact CB-CB 4.46Å; A352-M369 PolarHBondContact N-O 2.93Å; A352-M369 PolarHBondContact O-N 2.82Å; A352-M371 HydrophobicContact CB-CE 3.25Å; A352-M371 HydrophobicContact CB-CG 4.07Å; A352-M371 HydrophobicContact CB-SD 3.75Å
353	T	89.8	Confident	90.4	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.012	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.4	179.2	-57.8	0	0	0	0	109.2	L327 R328 M355 Q365 S367	L327-T353 WeakPolarHBondContact CA-O 2.9Å; R328-T353 PolarHBondContact N-O 3.37Å; R328-T353 PolarHBondContact O-N 3.2Å; T353-M355 HydrophobicContact CG2-CG 4.02Å; T353-Q365 HydrophobicContact CG2-CB 4.34Å; T353-Q365 HydrophobicContact CG2-CG 3.59Å; T353-S367 WeakPolarHBondContact CA-O 3.31Å
354	V	84.8	Confident	89.9	Confident	1 Å²	1	36.9 Å²	36.9	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	121.7	175.5	-173.1	0	0	0	0	108.2	F310 I325 L327 L366 S367 M369	F310-V354 HydrophobicContact CE2-CG1 3.97Å; F310-V354 HydrophobicContact CZ-CG1 3.66Å; I325-V354 HydrophobicContact CG2-CG1 3.91Å; L327-V354 HydrophobicContact CD2-CB 4.26Å; L327-V354 HydrophobicContact CD2-CG1 4.33Å; L327-V354 HydrophobicContact CD2-CG2 3.71Å; V354-L366 PolarHBondContact O-N 2.85Å; V354-S367 PolarHBondContact N-O 2.81Å; V354-M369 HydrophobicContact CG2-CE 3.75Å; V354-M369 HydrophobicContact CG2-SD 4.47Å
355	M	86.3	Confident	89.4	Confident	18 Å²	18	42 Å²	42	9%	0.089	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	142.8	-179	-58.1	-179.1	-59.1	0	0	110.5	I325 S326 R328 T353 P363 V364	I325-M355 CarbonylContact C-O 3.52Å; I325-M355 WeakPolarHBondContact CA-O 3.29Å; S326-M355 PolarHBondContact N-O 3.01Å; S326-M355 PolarHBondContact O-N 2.66Å; S326-M355 WeakPolarHBondContact OG-CE 3.19Å; R328-M355 HydrophobicContact CB-CE 3.65Å; R328-M355 HydrophobicContact CB-SD 4.32Å; T353-M355 HydrophobicContact CG2-CG 4.02Å; M355-P363 HydrophobicContact SD-CB 4.34Å; M355-V364 CarbonylContact C-O 3.59Å; M355-V364 WeakPolarHBondContact CA-O 3.44Å
356	V	85.4	Confident	88.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	143.1	167.6	173.1	0	0	0	0	108.8	F310 L320 Y323 P358 P363 V364 L366	F310-V356 HydrophobicContact CE1-CG2 4.22Å; L320-V356 HydrophobicContact CD2-CG1 4.39Å; Y323-V356 HydrophobicContact CD2-CG1 3.8Å; Y323-V356 HydrophobicContact CG-CG1 4.04Å; V356-P358 WeakPolarHBondContact O-CD 3.42Å; V356-P363 CarbonylContact O-C 3.46Å; V356-P363 WeakPolarHBondContact O-CA 3.39Å; V356-V364 PolarHBondContact N-O 3.13Å; V356-V364 PolarHBondContact O-N 3.08Å; V356-L366 HydrophobicContact CG2-CD1 3.33Å; V356-L366 HydrophobicContact CG2-CD2 4.14Å; V356-L366 HydrophobicContact CG2-CG 3.73Å
357	L	84.8	Confident	87.6	Confident	58 Å²	58	42.6 Å²	42.6	30%	0.304	29%	0.29	S	S	.	.			trans	-115.3	86.7	-177.5	-58.3	175.7	0	0	0	110.2	P324 P363	P324-L357 WeakPolarHBondContact CD-O 3.38Å; P324-L357 HydrophobicContact CG-CB 4.16Å; P324-L357 PolarHBondContact O-N 3.39Å; L357-P363 HydrophobicContact CD2-CB 3.66Å; L357-P363 HydrophobicContact CD2-CG 3.61Å
358	P	84.6	Confident	87	Confident	19 Å²	19	42.1 Å²	42.1	12%	0.123	28%	0.283	C	S	.	.			trans	-68.9	146.5	175.7	-11.3	26.1	0	0	0	111.2	Y323 V356 G360 A361 V364	Y323-P358 HydrophobicContact CD2-CB 3.88Å; Y323-P358 HydrophobicContact CD2-CG 4.04Å; Y323-P358 HydrophobicContact CE2-CB 3.8Å; Y323-P358 HydrophobicContact CE2-CG 4.22Å; Y323-P358 HydrophobicContact CG-CB 4.31Å; V356-P358 WeakPolarHBondContact O-CD 3.42Å; P358-G360 PolarHBondContact O-N 3.19Å; P358-A361 HydrophobicContact CB-CB 4.12Å; P358-A361 HydrophobicContact CG-CB 4.46Å; P358-A361 PolarHBondContact O-N 3.41Å; P358-V364 HydrophobicContact CG-CG2 4.19Å
359	P	82.6	Confident	86.7	Confident	103 Å²	103	41.1 Å²	41.1	67%	0.669	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	126.3	179.5	26.4	-32.7	0	0	0	110.8	Y323 A361	Y323-P359 HydrophobicContact CE1-CG 4.05Å; P359-A361 PolarHBondContact O-N 3.08Å
360	G	83.4	Confident	86.5	Confident	96 Å²	96	40 Å²	40	99%	0.99	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	8.3	177	0	0	0	0	0	115.4	P358	P358-G360 PolarHBondContact O-N 3.19Å
361	A	84.5	Confident	86.5	Confident	64 Å²	64	40 Å²	40	53%	0.529	27%	0.268	S	S	.	.	S	Bend	trans	-124.5	167.8	177.1	0	0	0	0	0	112	P358 P359	P358-A361 HydrophobicContact CB-CB 4.12Å; P358-A361 HydrophobicContact CG-CB 4.46Å; P358-A361 PolarHBondContact O-N 3.41Å; P359-A361 PolarHBondContact O-N 3.08Å
362	A	85.6	Confident	86.6	Confident	76 Å²	76	42 Å²	42	63%	0.628	28%	0.277	S	S	*	.			trans	-68.5	150.2	176.7	0	0	0	0	0	111.7	V364	A362-V364 PolarHBondContact O-N 3.05Å
363	P	86.4	Confident	86.8	Confident	77 Å²	77	42.7 Å²	42.7	50%	0.5	28%	0.282	S	S	.	.			trans	-54.4	133.4	172.5	-25.3	34.3	0	0	0	112.1	M355 V356 L357	M355-P363 HydrophobicContact SD-CB 4.34Å; V356-P363 CarbonylContact O-C 3.46Å; V356-P363 WeakPolarHBondContact O-CA 3.39Å; L357-P363 HydrophobicContact CD2-CB 3.66Å; L357-P363 HydrophobicContact CD2-CG 3.61Å
364	V	85	Confident	87.1	Confident	64 Å²	64	45.7 Å²	45.7	39%	0.388	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.9	177.5	-178	0	0	0	0	108.9	M355 V356 P358 A362 L366	M355-V364 CarbonylContact C-O 3.59Å; M355-V364 WeakPolarHBondContact CA-O 3.44Å; V356-V364 PolarHBondContact N-O 3.13Å; V356-V364 PolarHBondContact O-N 3.08Å; P358-V364 HydrophobicContact CG-CG2 4.19Å; A362-V364 PolarHBondContact O-N 3.05Å; V364-L366 PolarHBondContact O-N 2.79Å
365	Q	86.1	Confident	87.7	Confident	112 Å²	112	46.9 Å²	46.9	52%	0.523	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	127.2	174.2	174.3	173.6	-15.8	0	0	110.1	T353	T353-Q365 HydrophobicContact CG2-CB 4.34Å; T353-Q365 HydrophobicContact CG2-CG 3.59Å
366	L	78.4	Confident	88.2	Confident	35 Å²	35	48.2 Å²	48.2	18%	0.183	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-40.2	175	-63.7	-172.8	0	0	0	112.7	F310 I313 L320 V354 V356 V364	F310-L366 HydrophobicContact CD1-CD1 3.77Å; F310-L366 HydrophobicContact CE1-CD1 3.1Å; F310-L366 HydrophobicContact CZ-CD1 3.63Å; I313-L366 HydrophobicContact CG2-CD2 4.45Å; L320-L366 HydrophobicContact CD1-CD2 4.22Å; V354-L366 PolarHBondContact O-N 2.85Å; V356-L366 HydrophobicContact CG2-CD1 3.33Å; V356-L366 HydrophobicContact CG2-CD2 4.14Å; V356-L366 HydrophobicContact CG2-CG 3.73Å; V364-L366 PolarHBondContact O-N 2.79Å
367	S	79.4	Confident	88.7	Confident	11 Å²	11	48.8 Å²	48.8	8%	0.077	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	161.5	-174.4	170.6	0	0	0	0	112.2	Y309 T353 V354	Y309-S367 WeakPolarHBondContact CE1-OG 3.15Å; Y309-S367 WeakPolarHBondContact OH-CB 3.44Å; Y309-S367 PolarHBondContact OH-OG 2.93Å; T353-S367 WeakPolarHBondContact CA-O 3.31Å; V354-S367 PolarHBondContact N-O 2.81Å
368	S	86.9	Confident	89.3	Confident	34 Å²	34	52.8 Å²	52.8	24%	0.238	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	127.8	174.8	-172.5	0	0	0	0	110.1	I351 A352	I351-S368 WeakPolarHBondContact CG2-OG 3.11Å; A352-S368 WeakPolarHBondContact O-CA 3.32Å
369	M	89.2	Confident	89.8	Confident	4 Å²	4	52.5 Å²	52.5	2%	0.02	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	147.3	-178.6	-55.9	161.5	-169.3	0	0	109.7	Y309 I351 A352 V354 I397 L409	Y309-M369 HydrophobicContact CD1-CE 4.19Å; Y309-M369 HydrophobicContact CD2-CE 3.43Å; Y309-M369 VanDerWaalsContact CD2-CE 3.43Å; Y309-M369 HydrophobicContact CE1-CE 4.24Å; Y309-M369 HydrophobicContact CE2-CE 3.45Å; Y309-M369 VanDerWaalsContact CE2-CE 3.45Å; Y309-M369 HydrophobicContact CG-CE 3.81Å; I351-M369 CarbonylContact C-O 3.52Å; I351-M369 WeakPolarHBondContact CA-O 3.44Å; A352-M369 HydrophobicContact CB-CB 4.46Å; A352-M369 PolarHBondContact N-O 2.93Å; A352-M369 PolarHBondContact O-N 2.82Å; V354-M369 HydrophobicContact CG2-CE 3.75Å; V354-M369 HydrophobicContact CG2-SD 4.47Å; M369-I397 HydrophobicContact CB-CD1 3.9Å; M369-I397 HydrophobicContact CB-CG1 3.9Å; M369-I397 HydrophobicContact CG-CD1 4.33Å; M369-I397 HydrophobicContact SD-CD1 3.58Å; M369-I397 VanDerWaalsContact SD-CD1 3.58Å; M369-I397 HydrophobicContact SD-CG1 4.38Å; M369-L409 HydrophobicContact CE-CD2 3.84Å; M369-L409 HydrophobicContact CG-CD1 4.17Å; M369-L409 HydrophobicContact CG-CD2 4.47Å; M369-L409 HydrophobicContact SD-CD1 4.35Å; M369-L409 HydrophobicContact SD-CD2 3.66Å
370	T	93.3	Very high	90.3	Very high	15 Å²	15	49.9 Å²	49.9	9%	0.092	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	128.2	171.8	-60.7	0	0	0	0	109.6	T349 I397 F398 N400	T349-T370 HydrophobicContact CG2-CG2 3.93Å; T370-I397 CarbonylContact O-C 3.6Å; T370-I397 WeakPolarHBondContact O-CA 3.46Å; T370-F398 HydrophobicContact CG2-CE1 4.27Å; T370-F398 HydrophobicContact CG2-CE2 4.12Å; T370-F398 HydrophobicContact CG2-CZ 3.78Å; T370-F398 PolarHBondContact N-O 3.44Å; T370-F398 PolarHBondContact O-N 2.73Å; T370-N400 PolarHBondContact OG1-ND2 3.4Å
371	M	93.9	Very high	90.8	Very high	12 Å²	12	46.1 Å²	46.1	6%	0.059	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.6	173.5	-68.8	-177.9	175.5	0	0	109.6	L329 T349 A350 A352 F395 K396 I397 L416	L329-M371 HydrophobicContact CD2-CE 3.95Å; L329-M371 HydrophobicContact CD2-SD 3.95Å; T349-M371 CarbonylContact C-O 3.53Å; T349-M371 WeakPolarHBondContact CA-O 3.4Å; A350-M371 HydrophobicContact CB-CB 4.36Å; A350-M371 PolarHBondContact N-O 2.63Å; A350-M371 PolarHBondContact O-N 2.75Å; A352-M371 HydrophobicContact CB-CE 3.25Å; A352-M371 HydrophobicContact CB-CG 4.07Å; A352-M371 HydrophobicContact CB-SD 3.75Å; M371-F395 HydrophobicContact CB-CE2 4.09Å; M371-F395 HydrophobicContact CE-CZ 4.35Å; M371-F395 HydrophobicContact CG-CE2 3.97Å; M371-F395 HydrophobicContact CG-CZ 4.17Å; M371-F395 HydrophobicContact SD-CE2 4Å; M371-F395 HydrophobicContact SD-CZ 4.24Å; M371-K396 CarbonylContact C-O 3.59Å; M371-K396 WeakPolarHBondContact CA-O 3.34Å; M371-I397 HydrophobicContact CE-CD1 3.58Å; M371-I397 HydrophobicContact CG-CB 4.29Å; M371-I397 HydrophobicContact CG-CD1 3.97Å; M371-I397 HydrophobicContact CG-CG1 3.92Å; M371-L416 HydrophobicContact CE-CD1 4.38Å
372	E	95.9	Very high	91.1	Very high	80 Å²	80	50.9 Å²	50.9	37%	0.374	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	117.7	168.7	-69.5	179.9	173.6	0	0	109.2	F395 K396 F398	E372-F395 CarbonylContact O-C 3.56Å; E372-F395 WeakPolarHBondContact O-CA 3.48Å; E372-K396 HydrophobicContact CB-CB 4.34Å; E372-K396 PolarHBondContact N-O 3.07Å; E372-K396 PolarHBondContact O-N 3.47Å; E372-F398 HydrophobicContact CG-CE1 3.83Å; E372-F398 HydrophobicContact CG-CZ 4.19Å
373	A	95.8	Very high	91.3	Very high	15 Å²	15	48.6 Å²	48.6	12%	0.124	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	142.7	176	0	0	0	0	0	110.3	V348 F375 L392 R394	V348-A373 HydrophobicContact CB-CB 4.36Å; V348-A373 PolarHBondContact N-O 2.84Å; V348-A373 PolarHBondContact O-N 2.79Å; A373-F375 HydrophobicContact CB-CD2 4.42Å; A373-F375 HydrophobicContact CB-CE2 3.67Å; A373-F375 HydrophobicContact CB-CZ 4.2Å; A373-L392 HydrophobicContact CB-CD1 3.82Å; A373-R394 CarbonylContact C-O 3.58Å; A373-R394 WeakPolarHBondContact CA-O 3.44Å
374	K	97.1	Very high	91.4	Very high	66 Å²	66	47.5 Å²	47.5	29%	0.287	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	119	171.8	-169.3	167.5	-177.1	162.3	0	109.4	T345 V346 R393 R394	T345-K374 WeakPolarHBondContact OG1-CE 3.41Å; T345-K374 PolarHBondContact OG1-NZ 2.85Å; V346-K374 CarbonylContact O-C 3.37Å; V346-K374 WeakPolarHBondContact O-CA 3.3Å; K374-R393 WeakPolarHBondContact O-CA 3.41Å; K374-R393 WeakPolarHBondContact O-CB 3.43Å; K374-R393 PolarHBondContact O-N 3.42Å; K374-R394 HydrophobicContact CB-CB 4.07Å; K374-R394 PolarHBondContact N-O 3.28Å; K374-R394 PolarHBondContact O-N 3.01Å; K374-R394 VanDerWaalsContact O-N 3.08Å
375	F	97.3	Very high	91.8	Very high	25 Å²	25	51.3 Å²	51.3	11%	0.11	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	140.8	177.1	-62.1	-95.3	0	0	0	109.9	T345 V346 V348 A373 A390 D391 L392 V425 I428	T345-F375 CarbonylContact C-O 3.6Å; T345-F375 WeakPolarHBondContact CA-O 3.32Å; T345-F375 WeakPolarHBondContact CB-O 3.25Å; V346-F375 HydrophobicContact CB-CB 4.47Å; V346-F375 PolarHBondContact N-O 2.84Å; V346-F375 PolarHBondContact O-N 3.45Å; V348-F375 HydrophobicContact CB-CE2 4.19Å; V348-F375 HydrophobicContact CG2-CD2 3.84Å; V348-F375 HydrophobicContact CG2-CE2 3.75Å; A373-F375 HydrophobicContact CB-CD2 4.42Å; A373-F375 HydrophobicContact CB-CE2 3.67Å; A373-F375 HydrophobicContact CB-CZ 4.2Å; F375-A390 HydrophobicContact CD1-CB 4.37Å; F375-D391 CarbonylContact C-O 3.51Å; F375-D391 WeakPolarHBondContact CA-O 3.39Å; F375-L392 HydrophobicContact CD1-CB 4.03Å; F375-L392 HydrophobicContact CD1-CD1 4.31Å; F375-L392 HydrophobicContact CE1-CB 3.81Å; F375-L392 HydrophobicContact CE1-CD1 3.92Å; F375-L392 HydrophobicContact CE1-CG 4.42Å; F375-L392 HydrophobicContact CE2-CD1 4.27Å; F375-L392 HydrophobicContact CZ-CD1 3.9Å; F375-V425 HydrophobicContact CE1-CG2 4Å; F375-I428 HydrophobicContact CE1-CD1 4.18Å; F375-I428 HydrophobicContact CZ-CD1 4.23Å
376	N	97.3	Very high	92.2	Very high	47 Å²	47	46.2 Å²	46.2	25%	0.251	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	138.7	158	-71.6	-29.5	0	0	0	107.8	A390 D391 R393	N376-A390 CarbonylContact O-C 3.6Å; N376-A390 VanDerWaalsContact O-CA 3.31Å; N376-A390 WeakPolarHBondContact O-CA 3.37Å; N376-D391 PolarHBondContact N-O 3.1Å; N376-D391 PolarHBondContact O-N 3.05Å; N376-R393 WeakPolarHBondContact OD1-CD 3.43Å; N376-R393 PolarHBondContact OD1-NH1 3.33Å
377	A	96.3	Very high	93.1	Very high	11 Å²	11	44.9 Å²	44.9	9%	0.091	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	116.5	177.4	0	0	0	0	0	109.3	A344 V346 V388	A344-A377 HydrophobicContact CB-CB 4.25Å; A344-A377 PolarHBondContact O-N 2.94Å; V346-A377 HydrophobicContact CG2-CB 4.33Å; A377-V388 HydrophobicContact CB-CG1 3.87Å
378	K	95.9	Very high	93.9	Very high	142 Å²	142	45.7 Å²	45.7	62%	0.617	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	130.9	171.7	-67.1	-174.8	178.6	-176.7	0	108.8	V388 L389	K378-V388 CarbonylContact O-C 3.44Å; K378-V388 WeakPolarHBondContact O-CA 3.35Å; K378-L389 HydrophobicContact CB-CB 4.4Å; K378-L389 PolarHBondContact N-O 3.12Å; K378-L389 PolarHBondContact O-N 3.43Å
379	V	95.4	Very high	94.3	Very high	14 Å²	14	47.7 Å²	47.7	9%	0.085	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	142.1	-177.3	-178.8	0	0	0	0	108.3	F275 L386 V388 L458 I460	F275-V379 HydrophobicContact CZ-CG2 4.34Å; V379-L386 HydrophobicContact CG1-CD1 3.31Å; V379-L386 HydrophobicContact CG1-CG 4.05Å; V379-V388 HydrophobicContact CG2-CG2 4.3Å; V379-L458 HydrophobicContact CB-CD2 4.29Å; V379-L458 HydrophobicContact CG2-CD2 3.76Å; V379-I460 HydrophobicContact CG1-CD1 3.78Å
380	S	94.4	Very high	94.6	Very high	48 Å²	48	48 Å²	48	34%	0.336	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	158.7	178.3	57.2	0	0	0	0	110.4	A387	S380-A387 PolarHBondContact N-O 3.43Å; S380-A387 PolarHBondContact O-N 3.43Å
381	M	93.1	Very high	94.7	Very high	16 Å²	16	50.8 Å²	50.8	8%	0.079	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	143.9	174.2	-64.8	-56.6	-68.3	0	0	110.9	L386 I438 F446 E449 I460	M381-L386 HydrophobicContact SD-CB 4.11Å; M381-L386 HydrophobicContact SD-CD1 3.54Å; M381-L386 VanDerWaalsContact SD-CD1 3.54Å; M381-L386 HydrophobicContact SD-CG 4.45Å; M381-I438 HydrophobicContact CE-CG1 3.76Å; M381-F446 HydrophobicContact CB-CB 4.44Å; M381-F446 HydrophobicContact CE-CD2 3.39Å; M381-F446 HydrophobicContact CE-CE2 3.58Å; M381-F446 HydrophobicContact CE-CG 4.09Å; M381-F446 HydrophobicContact CE-CZ 4.42Å; M381-E449 HydrophobicContact CB-CB 4.34Å; M381-E449 HydrophobicContact CB-CG 4.09Å; M381-E449 HydrophobicContact CG-CB 4.27Å; M381-E449 HydrophobicContact CG-CG 4.24Å; M381-I460 HydrophobicContact CG-CD1 4.42Å; M381-I460 HydrophobicContact CG-CG2 4.02Å; M381-I460 HydrophobicContact SD-CD1 4.13Å
382	K	90	Very high	94.8	Very high	164 Å²	164	50.4 Å²	50.4	71%	0.713	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133	95.6	170.2	-172.7	-179.5	-179.7	-178.4	0	108.8	K384 R385	K382-K384 PolarHBondContact O-N 2.92Å; K382-R385 PolarHBondContact N-O 2.58Å; K382-R385 PolarHBondContact O-N 3.04Å; K382-R385 VanDerWaalsContact O-N 3.1Å
383	G	89.4	Confident	94.7	Very high	28 Å²	28	52 Å²	52	29%	0.289	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	-130.9	-164.4	0	0	0	0	0	109.4	R385 D445	G383-R385 VanDerWaalsContact C-N 3.3Å; G383-R385 PolarHBondContact O-N 3.25Å; G383-D445 VanDerWaalsContact CA-OD1 3.29Å; G383-D445 WeakPolarHBondContact CA-OD1 3.29Å
384	K	89.9	Confident	94.6	Very high	55 Å²	55	58.6 Å²	58.6	24%	0.239	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	2.4	173.5	70.7	179.1	-176.4	173.8	0	117.1	K382 I438 D442 D445	K382-K384 PolarHBondContact O-N 2.92Å; K384-I438 PolarHBondContact O-N 2.91Å; K384-D442 IonicContact NZ-OD1 3.85Å; K384-D442 PolarHBondContact NZ-OD1 2.94Å; K384-D445 PolarHBondContact N-OD1 2.91Å
385	R	93.1	Very high	94.5	Very high	144 Å²	144	56.4 Å²	56.4	54%	0.543	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	129.9	-176.3	-64.6	-171.3	175.4	124.1	-4.3	113	K382 G383 R434 V436	K382-R385 PolarHBondContact N-O 2.58Å; K382-R385 PolarHBondContact O-N 3.04Å; K382-R385 VanDerWaalsContact O-N 3.1Å; G383-R385 VanDerWaalsContact C-N 3.3Å; G383-R385 PolarHBondContact O-N 3.25Å; R385-R434 VanDerWaalsContact CD-O 3.32Å; R385-R434 WeakPolarHBondContact CD-O 3.41Å; R385-V436 CarbonylContact C-O 3.53Å; R385-V436 VanDerWaalsContact CA-O 3.27Å; R385-V436 WeakPolarHBondContact CA-O 3.23Å
386	L	95.3	Very high	94.4	Very high	4 Å²	4	61.1 Å²	61.1	2%	0.021	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	115.1	169.8	-174.4	79.3	0	0	0	109.7	L270 F274 F275 V379 M381 G435 V436 I438 I460	L270-L386 HydrophobicContact CD1-CD1 3.87Å; L270-L386 HydrophobicContact CD1-CD2 3.49Å; L270-L386 VanDerWaalsContact CD1-CD2 3.49Å; L270-L386 HydrophobicContact CD1-CG 4.33Å; F274-L386 HydrophobicContact CE1-CD2 3.58Å; F274-L386 HydrophobicContact CZ-CD2 4.12Å; F275-L386 HydrophobicContact CE1-CD2 4.05Å; F275-L386 HydrophobicContact CZ-CD2 4.32Å; V379-L386 HydrophobicContact CG1-CD1 3.31Å; V379-L386 HydrophobicContact CG1-CG 4.05Å; M381-L386 HydrophobicContact SD-CB 4.11Å; M381-L386 HydrophobicContact SD-CD1 3.54Å; M381-L386 VanDerWaalsContact SD-CD1 3.54Å; M381-L386 HydrophobicContact SD-CG 4.45Å; L386-G435 CarbonylContact O-C 3.54Å; L386-G435 WeakPolarHBondContact O-CA 3.3Å; L386-V436 HydrophobicContact CB-CG2 3.93Å; L386-V436 HydrophobicContact CD2-CG2 4.18Å; L386-V436 PolarHBondContact N-O 2.8Å; L386-V436 PolarHBondContact O-N 3.16Å; L386-I438 HydrophobicContact CB-CD1 4.05Å; L386-I438 HydrophobicContact CB-CG1 4.36Å; L386-I460 HydrophobicContact CD1-CD1 3.48Å; L386-I460 VanDerWaalsContact CD1-CD1 3.48Å
387	A	95.7	Very high	94.1	Very high	8 Å²	8	59 Å²	59	7%	0.066	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	148.6	176.3	0	0	0	0	0	110.9	S380	S380-A387 PolarHBondContact N-O 3.43Å; S380-A387 PolarHBondContact O-N 3.43Å
388	V	95.9	Very high	93.8	Very high	28 Å²	28	61.2 Å²	61.2	17%	0.17	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	134.7	175.8	-175.8	0	0	0	0	109.9	F275 A377 K378 V379 T432	F275-V388 HydrophobicContact CE1-CG2 4.37Å; A377-V388 HydrophobicContact CB-CG1 3.87Å; K378-V388 CarbonylContact O-C 3.44Å; K378-V388 WeakPolarHBondContact O-CA 3.35Å; V379-V388 HydrophobicContact CG2-CG2 4.3Å; V388-T432 PolarHBondContact N-O 3.42Å; V388-T432 VanDerWaalsContact N-O 3.07Å; V388-T432 CarbonylContact O-C 3.56Å; V388-T432 WeakPolarHBondContact O-CB 3.43Å; V388-T432 PolarHBondContact O-OG1 3.13Å
389	L	96.3	Very high	93.4	Very high	75 Å²	75	54.8 Å²	54.8	39%	0.393	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	115.2	170.8	-170.8	76.7	0	0	0	109.2	K378 N429 K433	K378-L389 HydrophobicContact CB-CB 4.4Å; K378-L389 PolarHBondContact N-O 3.12Å; K378-L389 PolarHBondContact O-N 3.43Å; L389-N429 HydrophobicContact CD1-CB 4.23Å; L389-K433 VanDerWaalsContact CD1-CE 3.49Å
390	A	95.7	Very high	92.8	Very high	11 Å²	11	59.6 Å²	59.6	9%	0.091	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	142.7	177.6	0	0	0	0	0	111.7	F375 N376 V425 I428 N429	F375-A390 HydrophobicContact CD1-CB 4.37Å; N376-A390 CarbonylContact O-C 3.6Å; N376-A390 VanDerWaalsContact O-CA 3.31Å; N376-A390 WeakPolarHBondContact O-CA 3.37Å; A390-V425 WeakPolarHBondContact O-CG1 3.47Å; A390-I428 HydrophobicContact CB-CG2 4.02Å; A390-N429 PolarHBondContact N-OD1 2.79Å; A390-N429 PolarHBondContact O-ND2 3.09Å; A390-N429 PolarHBondContact O-OD1 2.99Å
391	D	95.6	Very high	92.1	Very high	74 Å²	74	65 Å²	65	40%	0.396	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	132.2	173.5	178.7	40.2	0	0	0	110.9	F375 N376 R393 Q421	F375-D391 CarbonylContact C-O 3.51Å; F375-D391 WeakPolarHBondContact CA-O 3.39Å; N376-D391 PolarHBondContact N-O 3.1Å; N376-D391 PolarHBondContact O-N 3.05Å; D391-R393 PolarHBondContact O-N 2.75Å; D391-R393 VanDerWaalsContact O-N 3.13Å; D391-Q421 PolarHBondContact OD1-NE2 3.26Å
392	L	96.1	Very high	91.4	Very high	4 Å²	4	66.2 Å²	66.2	2%	0.021	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	101.7	-174.7	174.1	66.6	0	0	0	111	A373 F375 R394 K417 L420 Q421 V425	A373-L392 HydrophobicContact CB-CD1 3.82Å; F375-L392 HydrophobicContact CD1-CB 4.03Å; F375-L392 HydrophobicContact CD1-CD1 4.31Å; F375-L392 HydrophobicContact CE1-CB 3.81Å; F375-L392 HydrophobicContact CE1-CD1 3.92Å; F375-L392 HydrophobicContact CE1-CG 4.42Å; F375-L392 HydrophobicContact CE2-CD1 4.27Å; F375-L392 HydrophobicContact CZ-CD1 3.9Å; L392-R394 WeakPolarHBondContact CD1-O 3.49Å; L392-K417 HydrophobicContact CD2-CG 3.85Å; L392-K417 HydrophobicContact CG-CG 4.44Å; L392-L420 HydrophobicContact CD2-CB 3.93Å; L392-L420 HydrophobicContact CD2-CD1 4.44Å; L392-Q421 PolarHBondContact O-OE1 3.09Å; L392-V425 HydrophobicContact CB-CG2 3.94Å
393	R	92.9	Very high	90.9	Very high	113 Å²	113	62.1 Å²	62.1	43%	0.426	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-56	-176.9	-170.8	-166.2	-169.9	160.6	-6.1	112.1	K374 N376 D391 K417	K374-R393 WeakPolarHBondContact O-CA 3.41Å; K374-R393 WeakPolarHBondContact O-CB 3.43Å; K374-R393 PolarHBondContact O-N 3.42Å; N376-R393 WeakPolarHBondContact OD1-CD 3.43Å; N376-R393 PolarHBondContact OD1-NH1 3.33Å; D391-R393 PolarHBondContact O-N 2.75Å; D391-R393 VanDerWaalsContact O-N 3.13Å; R393-K417 PolarHBondContact O-NZ 3.35Å
394	R	94.1	Very high	90.3	Very high	154 Å²	154	67.4 Å²	67.4	58%	0.581	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.8	143.9	-177.2	-59.3	-176.6	176.6	175.7	-2.6	109.7	A373 K374 L392	A373-R394 CarbonylContact C-O 3.58Å; A373-R394 WeakPolarHBondContact CA-O 3.44Å; K374-R394 HydrophobicContact CB-CB 4.07Å; K374-R394 PolarHBondContact N-O 3.28Å; K374-R394 PolarHBondContact O-N 3.01Å; K374-R394 VanDerWaalsContact O-N 3.08Å; L392-R394 WeakPolarHBondContact CD1-O 3.49Å
395	F	95.3	Very high	89.5	Confident	20 Å²	20	67.1 Å²	67.1	9%	0.088	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	138	175.7	173.3	-103.9	0	0	0	107.8	M371 E372 I397 Q413 L416 K417 L420	M371-F395 HydrophobicContact CB-CE2 4.09Å; M371-F395 HydrophobicContact CE-CZ 4.35Å; M371-F395 HydrophobicContact CG-CE2 3.97Å; M371-F395 HydrophobicContact CG-CZ 4.17Å; M371-F395 HydrophobicContact SD-CE2 4Å; M371-F395 HydrophobicContact SD-CZ 4.24Å; E372-F395 CarbonylContact O-C 3.56Å; E372-F395 WeakPolarHBondContact O-CA 3.48Å; F395-I397 HydrophobicContact CE1-CB 4.12Å; F395-I397 HydrophobicContact CE1-CG2 4Å; F395-I397 HydrophobicContact CZ-CB 3.86Å; F395-I397 HydrophobicContact CZ-CG2 4.2Å; F395-Q413 WeakPolarHBondContact CD1-O 3.4Å; F395-L416 HydrophobicContact CE1-CB 3.67Å; F395-L416 HydrophobicContact CE1-CD1 4.39Å; F395-L416 HydrophobicContact CZ-CB 3.88Å; F395-L416 HydrophobicContact CZ-CD1 4.3Å; F395-K417 HydrophobicContact CB-CB 4.02Å; F395-K417 HydrophobicContact CB-CD 4.15Å; F395-K417 HydrophobicContact CB-CG 3.89Å; F395-K417 HydrophobicContact CD1-CB 3.86Å; F395-K417 HydrophobicContact CG-CB 4.14Å; F395-K417 HydrophobicContact CG-CG 4.49Å; F395-L420 HydrophobicContact CD2-CD1 3.52Å; F395-L420 HydrophobicContact CE2-CD1 3.3Å; F395-L420 HydrophobicContact CG-CD1 4.34Å; F395-L420 HydrophobicContact CZ-CD1 3.98Å
396	K	94.2	Very high	89	Confident	123 Å²	123	61.6 Å²	61.6	54%	0.535	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	139.1	171.2	-65.6	-177.9	178.5	-178.3	0	108.6	M371 E372 Q413	M371-K396 CarbonylContact C-O 3.59Å; M371-K396 WeakPolarHBondContact CA-O 3.34Å; E372-K396 HydrophobicContact CB-CB 4.34Å; E372-K396 PolarHBondContact N-O 3.07Å; E372-K396 PolarHBondContact O-N 3.47Å; K396-Q413 VanDerWaalsContact CA-OE1 3.24Å
397	I	91.3	Very high	88.2	Confident	4 Å²	4	67 Å²	67	2%	0.021	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.6	167.7	-170.9	172.9	0	0	0	110.8	M369 T370 M371 F395 L409 Q413 L416	M369-I397 HydrophobicContact CB-CD1 3.9Å; M369-I397 HydrophobicContact CB-CG1 3.9Å; M369-I397 HydrophobicContact CG-CD1 4.33Å; M369-I397 HydrophobicContact SD-CD1 3.58Å; M369-I397 VanDerWaalsContact SD-CD1 3.58Å; M369-I397 HydrophobicContact SD-CG1 4.38Å; T370-I397 CarbonylContact O-C 3.6Å; T370-I397 WeakPolarHBondContact O-CA 3.46Å; M371-I397 HydrophobicContact CE-CD1 3.58Å; M371-I397 HydrophobicContact CG-CB 4.29Å; M371-I397 HydrophobicContact CG-CD1 3.97Å; M371-I397 HydrophobicContact CG-CG1 3.92Å; F395-I397 HydrophobicContact CE1-CB 4.12Å; F395-I397 HydrophobicContact CE1-CG2 4Å; F395-I397 HydrophobicContact CZ-CB 3.86Å; F395-I397 HydrophobicContact CZ-CG2 4.2Å; I397-L409 HydrophobicContact CG1-CD1 4.29Å; I397-L409 HydrophobicContact CG2-CB 4.24Å; I397-Q413 HydrophobicContact CG2-CG 4.43Å; I397-Q413 PolarHBondContact O-NE2 2.74Å; I397-L416 HydrophobicContact CD1-CD1 3.65Å; I397-L416 HydrophobicContact CG2-CD1 4.09Å
398	F	90.2	Very high	87.3	Confident	56 Å²	56	68.4 Å²	68.4	25%	0.246	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	163.6	178.4	55	-84.7	0	0	0	111.3	T370 E372 N400	T370-F398 HydrophobicContact CG2-CE1 4.27Å; T370-F398 HydrophobicContact CG2-CE2 4.12Å; T370-F398 HydrophobicContact CG2-CZ 3.78Å; T370-F398 PolarHBondContact N-O 3.44Å; T370-F398 PolarHBondContact O-N 2.73Å; E372-F398 HydrophobicContact CG-CE1 3.83Å; E372-F398 HydrophobicContact CG-CZ 4.19Å; F398-N400 WeakPolarHBondContact CD2-OD1 3.42Å; F398-N400 WeakPolarHBondContact CE2-OD1 3.44Å
399	S	86.9	Confident	86.6	Confident	7 Å²	7	67 Å²	67	5%	0.049	34%	0.344	C	S	.	.			trans	-100.5	128.9	172.7	174.3	0	0	0	0	109.7	Q401 S402 E405 S406	S399-Q401 PolarHBondContact O-N 3.37Å; S399-Q401 PolarHBondContact OG-N 3.28Å; S399-Q401 VanDerWaalsContact OG-N 3.16Å; S399-S402 PolarHBondContact OG-N 2.93Å; S399-E405 VanDerWaalsContact CB-OE2 3.29Å; S399-E405 WeakPolarHBondContact CB-OE2 3.08Å; S399-E405 PolarHBondContact OG-OE2 2.89Å; S399-S406 PolarHBondContact N-OG 3.49Å; S399-S406 PolarHBondContact O-OG 2.82Å
400	N	82.8	Confident	86	Confident	116 Å²	116	68.3 Å²	68.3	62%	0.62	35%	0.35	S	S	*	.	S	Bend	trans	-76.3	-12.5	173.1	-68.6	-21.6	0	0	0	112.5	T370 F398	T370-N400 PolarHBondContact OG1-ND2 3.4Å; F398-N400 WeakPolarHBondContact CD2-OD1 3.42Å; F398-N400 WeakPolarHBondContact CE2-OD1 3.44Å
401	Q	80.5	Confident	85.4	Confident	162 Å²	162	71.4 Å²	71.4	76%	0.757	37%	0.369	S	S	*	.	S	Bend	trans	-94	-29.7	-174.2	-60.8	-176.3	-3.3	0	0	112.1	S399	S399-Q401 PolarHBondContact O-N 3.37Å; S399-Q401 PolarHBondContact OG-N 3.28Å; S399-Q401 VanDerWaalsContact OG-N 3.16Å
402	S	78.7	Confident	84.8	Confident	40 Å²	40	67.9 Å²	67.9	28%	0.28	35%	0.35	S	S	.	.			trans	-148.7	131.1	-175.5	173.6	0	0	0	0	113.1	S399 L404 E405 S406	S399-S402 PolarHBondContact OG-N 2.93Å; S402-L404 VanDerWaalsContact C-N 3.3Å; S402-L404 PolarHBondContact OG-N 3.28Å; S402-E405 PolarHBondContact O-N 2.99Å; S402-E405 PolarHBondContact OG-N 3.12Å; S402-S406 PolarHBondContact O-N 2.94Å; S402-S406 PolarHBondContact O-OG 2.93Å; S402-S406 VanDerWaalsContact O-OG 3.12Å
403	A	79.1	Confident	84.4	Confident	79 Å²	79	69.9 Å²	69.9	65%	0.653	36%	0.36	S	S	*	.	H	α-helix	trans	-66.3	-34.2	171.6	0	0	0	0	0	111.7	S406 L407	A403-S406 WeakPolarHBondContact O-CB 3.11Å; A403-S406 PolarHBondContact O-N 3.22Å; A403-L407 WeakPolarHBondContact O-CG 3.34Å; A403-L407 PolarHBondContact O-N 2.78Å
404	L	76.3	Confident	84.2	Confident	138 Å²	138	66.5 Å²	66.5	72%	0.723	36%	0.359	S	S	*	.	H	α-helix	trans	-70.4	-38.6	178.9	-167.9	131.6	0	0	0	111.3	S402 S406 L407 A408	S402-L404 VanDerWaalsContact C-N 3.3Å; S402-L404 PolarHBondContact OG-N 3.28Å; L404-S406 VanDerWaalsContact C-N 3.34Å; L404-L407 PolarHBondContact O-N 3.31Å; L404-A408 PolarHBondContact O-N 2.88Å; L404-A408 VanDerWaalsContact O-N 3.12Å
405	E	74.4	Confident	83.7	Confident	50 Å²	50	61.4 Å²	61.4	23%	0.234	35%	0.347	C	S	.	.	H	α-helix	trans	-62.3	-42.6	170.2	-69.8	-179.5	158.7	0	0	111.1	Y309 S399 S402 L407 A408 L409	Y309-E405 VanDerWaalsContact OH-CD 3.26Å; Y309-E405 PolarHBondContact OH-OE1 3Å; Y309-E405 VanDerWaalsContact OH-OE1 3.1Å; S399-E405 VanDerWaalsContact CB-OE2 3.29Å; S399-E405 WeakPolarHBondContact CB-OE2 3.08Å; S399-E405 PolarHBondContact OG-OE2 2.89Å; S402-E405 PolarHBondContact O-N 2.99Å; S402-E405 PolarHBondContact OG-N 3.12Å; E405-L407 VanDerWaalsContact C-N 3.3Å; E405-L407 PolarHBondContact O-N 3.18Å; E405-A408 WeakPolarHBondContact O-CB 3.34Å; E405-A408 PolarHBondContact O-N 3.08Å; E405-A408 VanDerWaalsContact O-N 3.09Å; E405-L409 WeakPolarHBondContact O-CG 3.45Å; E405-L409 PolarHBondContact O-N 2.96Å; E405-L409 VanDerWaalsContact O-N 3.14Å
406	S	81.3	Confident	83.3	Confident	28 Å²	28	60.7 Å²	60.7	20%	0.196	34%	0.343	C	S	.	.	H	α-helix	trans	-60.2	-37.7	176.7	-65.6	0	0	0	0	113.1	S399 S402 A403 L404 L409	S399-S406 PolarHBondContact N-OG 3.49Å; S399-S406 PolarHBondContact O-OG 2.82Å; S402-S406 PolarHBondContact O-N 2.94Å; S402-S406 PolarHBondContact O-OG 2.93Å; S402-S406 VanDerWaalsContact O-OG 3.12Å; A403-S406 WeakPolarHBondContact O-CB 3.11Å; A403-S406 PolarHBondContact O-N 3.22Å; L404-S406 VanDerWaalsContact C-N 3.34Å; S406-L409 PolarHBondContact O-N 3.06Å
407	L	79.8	Confident	83.1	Confident	118 Å²	118	58.2 Å²	58.2	62%	0.618	33%	0.333	S	S	*	.	H	α-helix	trans	-65.8	-38.9	173.8	-69.7	173.8	0	0	0	111.9	A403 L404 E405 L409 I410	A403-L407 WeakPolarHBondContact O-CG 3.34Å; A403-L407 PolarHBondContact O-N 2.78Å; L404-L407 PolarHBondContact O-N 3.31Å; E405-L407 VanDerWaalsContact C-N 3.3Å; E405-L407 PolarHBondContact O-N 3.18Å; L407-L409 PolarHBondContact O-N 3.23Å; L407-I410 HydrophobicContact CD2-CD1 3.89Å; L407-I410 WeakPolarHBondContact O-CB 3.34Å; L407-I410 WeakPolarHBondContact O-CG1 3.42Å; L407-I410 PolarHBondContact O-N 3.4Å
408	A	76.3	Confident	83	Confident	36 Å²	36	62 Å²	62	30%	0.298	36%	0.356	S	S	.	.	H	α-helix	trans	-66.1	-20	175.9	0	0	0	0	0	113.3	L404 E405 P411	L404-A408 PolarHBondContact O-N 2.88Å; L404-A408 VanDerWaalsContact O-N 3.12Å; E405-A408 WeakPolarHBondContact O-CB 3.34Å; E405-A408 PolarHBondContact O-N 3.08Å; E405-A408 VanDerWaalsContact O-N 3.09Å; A408-P411 WeakPolarHBondContact O-CD 3.49Å
409	L	81.9	Confident	82.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-9.5	178	-64.7	171.7	0	0	0	113.8	Y309 M369 I397 E405 S406 L407 L412 Q413	Y309-L409 HydrophobicContact CD2-CD2 3.96Å; Y309-L409 HydrophobicContact CE2-CD2 4.26Å; M369-L409 HydrophobicContact CE-CD2 3.84Å; M369-L409 HydrophobicContact CG-CD1 4.17Å; M369-L409 HydrophobicContact CG-CD2 4.47Å; M369-L409 HydrophobicContact SD-CD1 4.35Å; M369-L409 HydrophobicContact SD-CD2 3.66Å; I397-L409 HydrophobicContact CG1-CD1 4.29Å; I397-L409 HydrophobicContact CG2-CB 4.24Å; E405-L409 WeakPolarHBondContact O-CG 3.45Å; E405-L409 PolarHBondContact O-N 2.96Å; E405-L409 VanDerWaalsContact O-N 3.14Å; S406-L409 PolarHBondContact O-N 3.06Å; L407-L409 PolarHBondContact O-N 3.23Å; L409-L412 HydrophobicContact CD2-CD1 3.76Å; L409-L412 WeakPolarHBondContact O-CB 3.23Å; L409-L412 PolarHBondContact O-N 2.6Å; L409-L412 VanDerWaalsContact O-N 3.09Å; L409-Q413 PolarHBondContact O-N 3.39Å
410	I	83.1	Confident	82.8	Confident	102 Å²	102	60.3 Å²	60.3	52%	0.523	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-58.5	-45.9	-179.5	-65	172.4	0	0	0	112.5	L407 L412 Q413	L407-I410 HydrophobicContact CD2-CD1 3.89Å; L407-I410 WeakPolarHBondContact O-CB 3.34Å; L407-I410 WeakPolarHBondContact O-CG1 3.42Å; L407-I410 PolarHBondContact O-N 3.4Å; I410-L412 PolarHBondContact O-N 3.16Å; I410-Q413 WeakPolarHBondContact O-CB 3.29Å; I410-Q413 VanDerWaalsContact O-CG 3.23Å; I410-Q413 WeakPolarHBondContact O-CG 3.39Å; I410-Q413 PolarHBondContact O-N 3.46Å
411	P	83.6	Confident	83.2	Confident	75 Å²	75	57.6 Å²	57.6	49%	0.487	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-63.1	-24.2	176.9	-22.1	35	0	0	0	113.6	A408 P415	A408-P411 WeakPolarHBondContact O-CD 3.49Å; P411-P415 VanDerWaalsContact O-CD 3.3Å; P411-P415 WeakPolarHBondContact O-CD 3.41Å
412	L	82.1	Confident	83.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-81.2	-17.4	-179.3	-69.4	173.3	0	0	0	113.6	L301 L304 L305 L409 I410 G414 L416	L301-L412 HydrophobicContact CD1-CD2 4.18Å; L304-L412 HydrophobicContact CB-CD2 3.51Å; L304-L412 HydrophobicContact CD1-CD2 4.41Å; L305-L412 HydrophobicContact CD2-CD1 3.95Å; L305-L412 HydrophobicContact CD2-CD2 4.41Å; L409-L412 HydrophobicContact CD2-CD1 3.76Å; L409-L412 WeakPolarHBondContact O-CB 3.23Å; L409-L412 PolarHBondContact O-N 2.6Å; L409-L412 VanDerWaalsContact O-N 3.09Å; I410-L412 PolarHBondContact O-N 3.16Å; L412-G414 PolarHBondContact O-N 3.27Å; L412-L416 HydrophobicContact CB-CD1 3.86Å; L412-L416 HydrophobicContact CB-CG 4.39Å; L412-L416 WeakPolarHBondContact O-CB 3.05Å; L412-L416 VanDerWaalsContact O-CG 3.32Å; L412-L416 WeakPolarHBondContact O-CG 3.23Å; L412-L416 PolarHBondContact O-N 2.81Å
413	Q	87.4	Confident	83.7	Confident	47 Å²	47	55.8 Å²	55.8	22%	0.22	33%	0.327	C	S	.	.	H	α-helix	trans	-54.8	-50.2	-175.9	-62.3	-73.2	-12	0	0	112.7	F395 K396 I397 L409 I410 K417	F395-Q413 WeakPolarHBondContact CD1-O 3.4Å; K396-Q413 VanDerWaalsContact CA-OE1 3.24Å; I397-Q413 HydrophobicContact CG2-CG 4.43Å; I397-Q413 PolarHBondContact O-NE2 2.74Å; L409-Q413 PolarHBondContact O-N 3.39Å; I410-Q413 WeakPolarHBondContact O-CB 3.29Å; I410-Q413 VanDerWaalsContact O-CG 3.23Å; I410-Q413 WeakPolarHBondContact O-CG 3.39Å; I410-Q413 PolarHBondContact O-N 3.46Å; Q413-K417 VanDerWaalsContact O-CB 3.25Å; Q413-K417 WeakPolarHBondContact O-CB 3.45Å; Q413-K417 PolarHBondContact O-N 3.01Å
414	G	88.2	Confident	84.1	Confident	41 Å²	41	53 Å²	53	42%	0.423	30%	0.301	S	S	.	.	H	α-helix	trans	-67.3	-57	-177.3	0	0	0	0	0	112.7	L412 L416 K417 T418	L412-G414 PolarHBondContact O-N 3.27Å; G414-L416 PolarHBondContact O-N 3.27Å; G414-K417 PolarHBondContact O-N 2.97Å; G414-T418 PolarHBondContact O-N 3.24Å; G414-T418 PolarHBondContact O-OG1 3.3Å
415	P	85.4	Confident	84.9	Confident	48 Å²	48	46.9 Å²	46.9	31%	0.312	27%	0.269	S	S	.	.	H	α-helix	trans	-56.8	-43.6	177.9	-28.7	37.4	0	0	0	113.4	L304 P411 T418 M419	L304-P415 HydrophobicContact CD1-CB 3.95Å; L304-P415 HydrophobicContact CD1-CG 3.61Å; P411-P415 VanDerWaalsContact O-CD 3.3Å; P411-P415 WeakPolarHBondContact O-CD 3.41Å; P415-T418 PolarHBondContact O-N 3.36Å; P415-M419 WeakPolarHBondContact O-CB 3.4Å; P415-M419 PolarHBondContact O-N 3.22Å
416	L	85.6	Confident	85.8	Confident	4 Å²	4	47.7 Å²	47.7	2%	0.021	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-47.2	175.9	-76.4	171.2	0	0	0	111.3	L301 M371 F395 I397 L412 G414 T418 M419 L420	L301-L416 HydrophobicContact CD1-CD2 3.51Å; L301-L416 HydrophobicContact CD1-CG 3.81Å; L301-L416 HydrophobicContact CD2-CD2 3.74Å; L301-L416 HydrophobicContact CG-CD2 4.25Å; M371-L416 HydrophobicContact CE-CD1 4.38Å; F395-L416 HydrophobicContact CE1-CB 3.67Å; F395-L416 HydrophobicContact CE1-CD1 4.39Å; F395-L416 HydrophobicContact CZ-CB 3.88Å; F395-L416 HydrophobicContact CZ-CD1 4.3Å; I397-L416 HydrophobicContact CD1-CD1 3.65Å; I397-L416 HydrophobicContact CG2-CD1 4.09Å; L412-L416 HydrophobicContact CB-CD1 3.86Å; L412-L416 HydrophobicContact CB-CG 4.39Å; L412-L416 WeakPolarHBondContact O-CB 3.05Å; L412-L416 VanDerWaalsContact O-CG 3.32Å; L412-L416 WeakPolarHBondContact O-CG 3.23Å; L412-L416 PolarHBondContact O-N 2.81Å; G414-L416 PolarHBondContact O-N 3.27Å; L416-T418 VanDerWaalsContact C-N 3.28Å; L416-T418 PolarHBondContact O-N 3.2Å; L416-M419 WeakPolarHBondContact O-CB 3.49Å; L416-M419 PolarHBondContact O-N 3.46Å; L416-M419 VanDerWaalsContact O-N 3.1Å; L416-L420 VanDerWaalsContact O-CG 3.3Å; L416-L420 WeakPolarHBondContact O-CG 3.45Å; L416-L420 PolarHBondContact O-N 3.28Å
417	K	90.6	Very high	86.2	Confident	72 Å²	72	51.2 Å²	51.2	31%	0.313	29%	0.294	S	S	.	.	H	α-helix	trans	-54	-46.9	176.2	-176.5	-177.7	174.5	-176.3	0	111.3	L392 R393 F395 Q413 G414 M419 L420 Q421	L392-K417 HydrophobicContact CD2-CG 3.85Å; L392-K417 HydrophobicContact CG-CG 4.44Å; R393-K417 PolarHBondContact O-NZ 3.35Å; F395-K417 HydrophobicContact CB-CB 4.02Å; F395-K417 HydrophobicContact CB-CD 4.15Å; F395-K417 HydrophobicContact CB-CG 3.89Å; F395-K417 HydrophobicContact CD1-CB 3.86Å; F395-K417 HydrophobicContact CG-CB 4.14Å; F395-K417 HydrophobicContact CG-CG 4.49Å; Q413-K417 VanDerWaalsContact O-CB 3.25Å; Q413-K417 WeakPolarHBondContact O-CB 3.45Å; Q413-K417 PolarHBondContact O-N 3.01Å; G414-K417 PolarHBondContact O-N 2.97Å; K417-M419 PolarHBondContact O-N 3.22Å; K417-L420 PolarHBondContact O-N 3.29Å; K417-Q421 WeakPolarHBondContact O-CB 3.32Å; K417-Q421 PolarHBondContact O-N 3.09Å
418	T	88	Confident	86.9	Confident	82 Å²	82	48.1 Å²	48.1	50%	0.503	28%	0.278	S	S	.	.	H	α-helix	trans	-61.9	-42.2	178.1	-60.2	0	0	0	0	111.8	G414 P415 L416 Q421 I422	G414-T418 PolarHBondContact O-N 3.24Å; G414-T418 PolarHBondContact O-OG1 3.3Å; P415-T418 PolarHBondContact O-N 3.36Å; L416-T418 VanDerWaalsContact C-N 3.28Å; L416-T418 PolarHBondContact O-N 3.2Å; T418-Q421 WeakPolarHBondContact O-CB 3.2Å; T418-Q421 PolarHBondContact O-N 2.99Å; T418-I422 HydrophobicContact CG2-CD1 3.79Å; T418-I422 WeakPolarHBondContact O-CG1 3.25Å; T418-I422 PolarHBondContact O-N 3.36Å
419	M	85.2	Confident	87.8	Confident	11 Å²	11	47.3 Å²	47.3	5%	0.054	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-48.8	176	-177.4	-83.4	166.5	0	0	111.5	I292 P298 L301 P415 L416 K417 Q421 I422 S423	I292-M419 HydrophobicContact CD1-CE 3.55Å; I292-M419 HydrophobicContact CD1-SD 4.16Å; I292-M419 HydrophobicContact CG1-CE 4.12Å; I292-M419 HydrophobicContact CG2-CE 3.99Å; P298-M419 HydrophobicContact CG-CG 4.02Å; L301-M419 HydrophobicContact CD2-CB 4.28Å; L301-M419 HydrophobicContact CD2-CG 4.03Å; P415-M419 WeakPolarHBondContact O-CB 3.4Å; P415-M419 PolarHBondContact O-N 3.22Å; L416-M419 WeakPolarHBondContact O-CB 3.49Å; L416-M419 PolarHBondContact O-N 3.46Å; L416-M419 VanDerWaalsContact O-N 3.1Å; K417-M419 PolarHBondContact O-N 3.22Å; M419-Q421 VanDerWaalsContact C-N 3.26Å; M419-Q421 PolarHBondContact O-N 3.12Å; M419-I422 PolarHBondContact O-N 3.39Å; M419-S423 WeakPolarHBondContact O-CB 3.37Å; M419-S423 PolarHBondContact O-N 3.4Å; M419-S423 PolarHBondContact O-OG 3.03Å
420	L	88.6	Confident	88.3	Confident	17 Å²	17	52 Å²	52	9%	0.089	29%	0.294	C	S	.	.	H	α-helix	trans	-60.6	-38.2	177.2	-56.9	175.4	0	0	0	111.2	L329 L392 F395 L416 K417 I424 V425	L329-L420 HydrophobicContact CD1-CD2 4.11Å; L392-L420 HydrophobicContact CD2-CB 3.93Å; L392-L420 HydrophobicContact CD2-CD1 4.44Å; F395-L420 HydrophobicContact CD2-CD1 3.52Å; F395-L420 HydrophobicContact CE2-CD1 3.3Å; F395-L420 HydrophobicContact CG-CD1 4.34Å; F395-L420 HydrophobicContact CZ-CD1 3.98Å; L416-L420 VanDerWaalsContact O-CG 3.3Å; L416-L420 WeakPolarHBondContact O-CG 3.45Å; L416-L420 PolarHBondContact O-N 3.28Å; K417-L420 PolarHBondContact O-N 3.29Å; L420-I424 HydrophobicContact CB-CD1 4.22Å; L420-I424 HydrophobicContact CD2-CD1 3.19Å; L420-I424 HydrophobicContact CD2-CG1 4.46Å; L420-I424 HydrophobicContact CG-CD1 4.23Å; L420-I424 WeakPolarHBondContact O-CA 3.37Å; L420-I424 WeakPolarHBondContact O-CB 3.35Å; L420-I424 PolarHBondContact O-N 3.28Å; L420-V425 PolarHBondContact O-N 3.14Å; L420-V425 VanDerWaalsContact O-N 3.09Å
421	Q	91	Very high	88.7	Confident	59 Å²	59	52 Å²	52	28%	0.276	29%	0.287	S	S	.	.	H	α-helix	trans	-62.7	-40.1	177.1	-168.1	86.2	35.2	0	0	112.6	D391 L392 K417 T418 M419 V425 P426	D391-Q421 PolarHBondContact OD1-NE2 3.26Å; L392-Q421 PolarHBondContact O-OE1 3.09Å; K417-Q421 WeakPolarHBondContact O-CB 3.32Å; K417-Q421 PolarHBondContact O-N 3.09Å; T418-Q421 WeakPolarHBondContact O-CB 3.2Å; T418-Q421 PolarHBondContact O-N 2.99Å; M419-Q421 VanDerWaalsContact C-N 3.26Å; M419-Q421 PolarHBondContact O-N 3.12Å; Q421-V425 WeakPolarHBondContact O-CB 3.5Å; Q421-P426 WeakPolarHBondContact O-CD 3.43Å
422	I	86.7	Confident	89.1	Confident	119 Å²	119	50.5 Å²	50.5	61%	0.61	28%	0.277	S	S	*	.	H	α-helix	trans	-85.7	-34.7	-176.2	-64.4	169.6	0	0	0	111.4	T418 M419 P426	T418-I422 HydrophobicContact CG2-CD1 3.79Å; T418-I422 WeakPolarHBondContact O-CG1 3.25Å; T418-I422 PolarHBondContact O-N 3.36Å; M419-I422 PolarHBondContact O-N 3.39Å; I422-P426 WeakPolarHBondContact O-CD 3.32Å; I422-P426 VanDerWaalsContact O-CG 3.31Å; I422-P426 WeakPolarHBondContact O-CG 3.36Å
423	S	83.6	Confident	89.6	Confident	46 Å²	46	56.5 Å²	56.5	32%	0.322	30%	0.303	S	S	.	.	H	α-helix	trans	-98.7	-39.8	-171.4	-56.9	0	0	0	0	113.8	M419 I427	M419-S423 WeakPolarHBondContact O-CB 3.37Å; M419-S423 PolarHBondContact O-N 3.4Å; M419-S423 PolarHBondContact O-OG 3.03Å; S423-I427 VanDerWaalsContact O-CD1 3.23Å; S423-I427 WeakPolarHBondContact O-CD1 3.23Å; S423-I427 WeakPolarHBondContact O-CG1 3.3Å
424	I	87.4	Confident	89.8	Confident	20 Å²	20	61.9 Å²	61.9	10%	0.103	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-43.5	-170.3	-61.1	167.3	0	0	0	111.7	M290 L329 L420 P426 I427 I428	M290-I424 HydrophobicContact CE-CD1 3.54Å; M290-I424 HydrophobicContact CE-CG1 4.09Å; M290-I424 HydrophobicContact CE-CG2 4.14Å; M290-I424 HydrophobicContact SD-CD1 3.61Å; M290-I424 HydrophobicContact SD-CG1 3.74Å; L329-I424 HydrophobicContact CD1-CD1 3.92Å; L420-I424 HydrophobicContact CB-CD1 4.22Å; L420-I424 HydrophobicContact CD2-CD1 3.19Å; L420-I424 HydrophobicContact CD2-CG1 4.46Å; L420-I424 HydrophobicContact CG-CD1 4.23Å; L420-I424 WeakPolarHBondContact O-CA 3.37Å; L420-I424 WeakPolarHBondContact O-CB 3.35Å; L420-I424 PolarHBondContact O-N 3.28Å; I424-P426 VanDerWaalsContact C-N 3.3Å; I424-I427 WeakPolarHBondContact O-CA 3.48Å; I424-I427 WeakPolarHBondContact O-CB 3.42Å; I424-I427 PolarHBondContact O-N 3.01Å; I424-I428 HydrophobicContact CG2-CD1 3.75Å; I424-I428 HydrophobicContact CG2-CG1 4.1Å; I424-I428 PolarHBondContact O-N 3.09Å
425	V	92.5	Very high	89.9	Confident	9 Å²	9	60.8 Å²	60.8	6%	0.055	31%	0.31	C	S	.	.	H	α-helix	trans	-54.5	-41.6	179.6	172.8	0	0	0	0	112.1	F375 A390 L392 L420 Q421 I427 I428 N429	F375-V425 HydrophobicContact CE1-CG2 4Å; A390-V425 WeakPolarHBondContact O-CG1 3.47Å; L392-V425 HydrophobicContact CB-CG2 3.94Å; L420-V425 PolarHBondContact O-N 3.14Å; L420-V425 VanDerWaalsContact O-N 3.09Å; Q421-V425 WeakPolarHBondContact O-CB 3.5Å; V425-I427 VanDerWaalsContact C-N 3.34Å; V425-I427 PolarHBondContact O-N 2.96Å; V425-I428 PolarHBondContact O-N 3.1Å; V425-N429 WeakPolarHBondContact CG1-ND2 3.49Å; V425-N429 WeakPolarHBondContact O-CB 3.37Å; V425-N429 PolarHBondContact O-N 2.89Å; V425-N429 PolarHBondContact O-ND2 3.19Å
426	P	93.1	Very high	90.3	Very high	68 Å²	68	59.4 Å²	59.4	44%	0.442	30%	0.301	S	S	.	.	H	α-helix	trans	-64.8	-35	175.5	-25.6	38.2	0	0	0	113.6	Q421 I422 I424 N429 N430	Q421-P426 WeakPolarHBondContact O-CD 3.43Å; I422-P426 WeakPolarHBondContact O-CD 3.32Å; I422-P426 VanDerWaalsContact O-CG 3.31Å; I422-P426 WeakPolarHBondContact O-CG 3.36Å; I424-P426 VanDerWaalsContact C-N 3.3Å; P426-N429 PolarHBondContact O-N 3.32Å; P426-N430 WeakPolarHBondContact O-CB 3.31Å; P426-N430 PolarHBondContact O-N 2.94Å
427	I	91.3	Very high	90.6	Very high	101 Å²	101	60.7 Å²	60.7	52%	0.518	31%	0.31	S	S	.	.	H	α-helix	trans	-65.3	-49.6	176.2	-60.9	172.6	0	0	0	109.4	S423 I424 V425 N429 N430 W431	S423-I427 VanDerWaalsContact O-CD1 3.23Å; S423-I427 WeakPolarHBondContact O-CD1 3.23Å; S423-I427 WeakPolarHBondContact O-CG1 3.3Å; I424-I427 WeakPolarHBondContact O-CA 3.48Å; I424-I427 WeakPolarHBondContact O-CB 3.42Å; I424-I427 PolarHBondContact O-N 3.01Å; V425-I427 VanDerWaalsContact C-N 3.34Å; V425-I427 PolarHBondContact O-N 2.96Å; I427-N429 VanDerWaalsContact C-N 3.32Å; I427-N429 PolarHBondContact O-N 2.88Å; I427-N430 PolarHBondContact O-N 2.88Å; I427-W431 VanDerWaalsContact O-CD1 3.3Å; I427-W431 PolarHBondContact O-N 2.95Å
428	I	92.8	Very high	90.8	Very high	54 Å²	54	57.2 Å²	57.2	28%	0.277	30%	0.295	S	S	.	.	H	α-helix	trans	-54.9	-51.3	175.7	-65.1	172.1	0	0	0	109.6	F375 A390 I424 V425 N430 W431 T432	F375-I428 HydrophobicContact CE1-CD1 4.18Å; F375-I428 HydrophobicContact CZ-CD1 4.23Å; A390-I428 HydrophobicContact CB-CG2 4.02Å; I424-I428 HydrophobicContact CG2-CD1 3.75Å; I424-I428 HydrophobicContact CG2-CG1 4.1Å; I424-I428 PolarHBondContact O-N 3.09Å; V425-I428 PolarHBondContact O-N 3.1Å; I428-N430 VanDerWaalsContact C-N 3.29Å; I428-N430 PolarHBondContact O-N 3.46Å; I428-W431 WeakPolarHBondContact O-CB 3.5Å; I428-W431 PolarHBondContact O-N 3.37Å; I428-W431 VanDerWaalsContact O-N 3.08Å; I428-T432 HydrophobicContact CG2-CG2 4.05Å; I428-T432 WeakPolarHBondContact O-CG2 3.39Å; I428-T432 PolarHBondContact O-N 3.34Å; I428-T432 PolarHBondContact O-OG1 3.21Å; I428-T432 VanDerWaalsContact O-OG1 3.12Å
429	N	95.5	Very high	91	Very high	19 Å²	19	53.6 Å²	53.6	10%	0.102	27%	0.273	C	S	.	.	H	α-helix	trans	-63.5	-31.8	-178.9	-78.3	-29.3	0	0	0	113.5	L389 A390 V425 P426 I427 W431 T432 K433	L389-N429 HydrophobicContact CD1-CB 4.23Å; A390-N429 PolarHBondContact N-OD1 2.79Å; A390-N429 PolarHBondContact O-ND2 3.09Å; A390-N429 PolarHBondContact O-OD1 2.99Å; V425-N429 WeakPolarHBondContact CG1-ND2 3.49Å; V425-N429 WeakPolarHBondContact O-CB 3.37Å; V425-N429 PolarHBondContact O-N 2.89Å; V425-N429 PolarHBondContact O-ND2 3.19Å; P426-N429 PolarHBondContact O-N 3.32Å; I427-N429 VanDerWaalsContact C-N 3.32Å; I427-N429 PolarHBondContact O-N 2.88Å; N429-W431 VanDerWaalsContact C-N 3.3Å; N429-T432 WeakPolarHBondContact CA-OG1 3.43Å; N429-K433 WeakPolarHBondContact O-CB 3.35Å; N429-K433 WeakPolarHBondContact O-CD 3.46Å; N429-K433 WeakPolarHBondContact O-CG 3.47Å; N429-K433 PolarHBondContact O-N 3.49Å
430	N	93.8	Very high	91.1	Very high	98 Å²	98	53.9 Å²	53.9	52%	0.524	28%	0.275	S	S	.	.	H	α-helix	trans	-66.3	-35.6	175.3	-169.2	34.7	0	0	0	111.7	P426 I427 I428	P426-N430 WeakPolarHBondContact O-CB 3.31Å; P426-N430 PolarHBondContact O-N 2.94Å; I427-N430 PolarHBondContact O-N 2.88Å; I428-N430 VanDerWaalsContact C-N 3.29Å; I428-N430 PolarHBondContact O-N 3.46Å
431	W	91	Very high	90.9	Very high	101 Å²	101	53.6 Å²	53.6	38%	0.383	27%	0.274	S	S	.	.	H	α-helix	trans	-74.3	-53	174.5	-79.6	71.5	0	0	0	111.5	Y214 I427 I428 N429 K433 R434	Y214-W431 HydrophobicContact CE2-CH2 4.12Å; I427-W431 VanDerWaalsContact O-CD1 3.3Å; I427-W431 PolarHBondContact O-N 2.95Å; I428-W431 WeakPolarHBondContact O-CB 3.5Å; I428-W431 PolarHBondContact O-N 3.37Å; I428-W431 VanDerWaalsContact O-N 3.08Å; N429-W431 VanDerWaalsContact C-N 3.3Å; W431-K433 VanDerWaalsContact C-N 3.26Å; W431-K433 PolarHBondContact O-N 2.98Å; W431-R434 WeakPolarHBondContact O-CB 3.37Å; W431-R434 PolarHBondContact O-N 2.66Å
432	T	91.9	Very high	90.5	Very high	45 Å²	45	54.7 Å²	54.7	28%	0.276	28%	0.282	S	S	.	.	H	α-helix	trans	-70.4	-19.7	-174.4	59.7	0	0	0	0	113.7	V388 I428 N429 G435	V388-T432 PolarHBondContact N-O 3.42Å; V388-T432 VanDerWaalsContact N-O 3.07Å; V388-T432 CarbonylContact O-C 3.56Å; V388-T432 WeakPolarHBondContact O-CB 3.43Å; V388-T432 PolarHBondContact O-OG1 3.13Å; I428-T432 HydrophobicContact CG2-CG2 4.05Å; I428-T432 WeakPolarHBondContact O-CG2 3.39Å; I428-T432 PolarHBondContact O-N 3.34Å; I428-T432 PolarHBondContact O-OG1 3.21Å; I428-T432 VanDerWaalsContact O-OG1 3.12Å; N429-T432 WeakPolarHBondContact CA-OG1 3.43Å; T432-G435 PolarHBondContact O-N 2.85Å
433	K	91.1	Very high	90.3	Very high	125 Å²	125	49.6 Å²	49.6	54%	0.543	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-23.1	170.1	-79.5	176.8	179.7	-176.9	0	114.1	L389 N429 W431 G435	L389-K433 VanDerWaalsContact CD1-CE 3.49Å; N429-K433 WeakPolarHBondContact O-CB 3.35Å; N429-K433 WeakPolarHBondContact O-CD 3.46Å; N429-K433 WeakPolarHBondContact O-CG 3.47Å; N429-K433 PolarHBondContact O-N 3.49Å; W431-K433 VanDerWaalsContact C-N 3.26Å; W431-K433 PolarHBondContact O-N 2.98Å; K433-G435 PolarHBondContact O-N 3.1Å
434	R	91.7	Very high	90.5	Very high	160 Å²	160	48.4 Å²	48.4	60%	0.604	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-38.1	171.4	-65.5	177.3	-178.1	-175.6	-2.2	109.7	R385 W431	R385-R434 VanDerWaalsContact CD-O 3.32Å; R385-R434 WeakPolarHBondContact CD-O 3.41Å; W431-R434 WeakPolarHBondContact O-CB 3.37Å; W431-R434 PolarHBondContact O-N 2.66Å
435	G	91.4	Very high	90.6	Very high	18 Å²	18	50 Å²	50	19%	0.186	26%	0.258	C	S	.	.			trans	70.8	-176.9	172	0	0	0	0	0	113.4	L386 T432 K433	L386-G435 CarbonylContact O-C 3.54Å; L386-G435 WeakPolarHBondContact O-CA 3.3Å; T432-G435 PolarHBondContact O-N 2.85Å; K433-G435 PolarHBondContact O-N 3.1Å
436	V	93.8	Very high	90.7	Very high	20 Å²	20	50.1 Å²	50.1	12%	0.121	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	140.6	-178.9	-61	0	0	0	0	109.8	V211 F240 F274 R385 L386	V211-V436 HydrophobicContact CG1-CG1 3.8Å; V211-V436 HydrophobicContact CG2-CG1 4.34Å; F240-V436 HydrophobicContact CE1-CG1 3.81Å; F240-V436 HydrophobicContact CZ-CB 4.37Å; F240-V436 HydrophobicContact CZ-CG1 3.85Å; F240-V436 HydrophobicContact CZ-CG2 4.22Å; F274-V436 HydrophobicContact CE1-CG2 4.41Å; F274-V436 HydrophobicContact CZ-CG2 4Å; R385-V436 CarbonylContact C-O 3.53Å; R385-V436 VanDerWaalsContact CA-O 3.27Å; R385-V436 WeakPolarHBondContact CA-O 3.23Å; L386-V436 HydrophobicContact CB-CG2 3.93Å; L386-V436 HydrophobicContact CD2-CG2 4.18Å; L386-V436 PolarHBondContact N-O 2.8Å; L386-V436 PolarHBondContact O-N 3.16Å
437	S	92.5	Very high	90.7	Very high	30 Å²	30	50 Å²	50	21%	0.21	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	136.7	178.7	-160.8	0	0	0	0	110.1	Y219	Y219-S437 VanDerWaalsContact CE2-O 3.24Å; Y219-S437 WeakPolarHBondContact CE2-O 3.4Å; Y219-S437 PolarHBondContact OH-O 2.84Å
438	I	94.1	Very high	90.8	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.256	C	S	.	.			trans	-84.1	146.1	167.9	-60.1	-54.9	0	0	0	108.2	I26 L268 M381 K384 L386 L440 F446	I26-I438 HydrophobicContact CD1-CG2 4.09Å; L268-I438 HydrophobicContact CD1-CG2 4.12Å; L268-I438 HydrophobicContact CD2-CD1 3.67Å; L268-I438 HydrophobicContact CD2-CG1 3.87Å; L268-I438 HydrophobicContact CD2-CG2 4.21Å; M381-I438 HydrophobicContact CE-CG1 3.76Å; K384-I438 PolarHBondContact O-N 2.91Å; L386-I438 HydrophobicContact CB-CD1 4.05Å; L386-I438 HydrophobicContact CB-CG1 4.36Å; I438-L440 VanDerWaalsContact C-N 3.25Å; I438-L440 PolarHBondContact O-N 2.88Å; I438-F446 HydrophobicContact CB-CE2 4.03Å; I438-F446 HydrophobicContact CB-CZ 4.4Å; I438-F446 HydrophobicContact CG1-CE2 4.42Å; I438-F446 HydrophobicContact CG2-CE2 4Å; I438-F446 HydrophobicContact CG2-CZ 3.85Å
439	P	91.3	Very high	90.9	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.032	26%	0.259	C	S	.	.	S	Bend	trans	-73.5	77.9	-176.7	31.5	-38.2	0	0	0	111	I26 I205 Y219 F236	I26-P439 HydrophobicContact CD1-CG 3.93Å; I205-P439 HydrophobicContact CG2-CB 3.82Å; Y219-P439 HydrophobicContact CD1-CG 3.73Å; Y219-P439 HydrophobicContact CD2-CB 4.11Å; Y219-P439 HydrophobicContact CD2-CG 4.12Å; Y219-P439 HydrophobicContact CE1-CG 4.14Å; Y219-P439 HydrophobicContact CE2-CG 4.48Å; Y219-P439 HydrophobicContact CG-CB 4.02Å; Y219-P439 HydrophobicContact CG-CG 3.71Å; F236-P439 HydrophobicContact CE1-CG 4.46Å; F236-P439 HydrophobicContact CZ-CG 4.44Å
440	L	88.1	Confident	90.9	Very high	18 Å²	18	53.8 Å²	53.8	9%	0.094	27%	0.27	C	S	.	.			trans	-114.1	151.4	169.4	-71.9	-172.1	0	0	0	110.3	I438 L444 F446 L464	I438-L440 VanDerWaalsContact C-N 3.25Å; I438-L440 PolarHBondContact O-N 2.88Å; L440-L444 HydrophobicContact CD1-CB 4.46Å; L440-F446 HydrophobicContact CD1-CD1 4.49Å; L440-F446 HydrophobicContact CD1-CD2 3.76Å; L440-F446 HydrophobicContact CD1-CE1 4Å; L440-F446 HydrophobicContact CD1-CE2 3.15Å; L440-F446 HydrophobicContact CD1-CG 4.41Å; L440-F446 HydrophobicContact CD1-CZ 3.3Å; L440-F446 HydrophobicContact CD2-CZ 4.24Å; L440-F446 HydrophobicContact CG-CE2 3.86Å; L440-F446 HydrophobicContact CG-CZ 3.81Å; L440-L464 HydrophobicContact CD1-CD2 4.12Å
441	A	85.1	Confident	91	Very high	10 Å²	10	50.9 Å²	50.9	8%	0.083	26%	0.255	C	S	.	.			trans	-62.9	147.1	174.6	0	0	0	0	0	111.4	L201 I205 G443 L444 M473	L201-A441 HydrophobicContact CD1-CB 4.33Å; I205-A441 HydrophobicContact CD1-CB 4.43Å; I205-A441 HydrophobicContact CG1-CB 4.06Å; A441-G443 PolarHBondContact O-N 2.57Å; A441-L444 HydrophobicContact CB-CD1 4.38Å; A441-L444 PolarHBondContact O-N 2.78Å; A441-M473 HydrophobicContact CB-CE 3.99Å
442	D	82	Confident	91.3	Very high	83 Å²	83	50.3 Å²	50.3	44%	0.444	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	124	-179.1	-83.8	-23.1	0	0	0	112	K384 M473	K384-D442 IonicContact NZ-OD1 3.85Å; K384-D442 PolarHBondContact NZ-OD1 2.94Å; D442-M473 WeakPolarHBondContact O-CE 3.35Å; D442-M473 WeakPolarHBondContact O-CG 3.49Å
443	G	82.9	Confident	91.5	Very high	12 Å²	12	50.6 Å²	50.6	12%	0.124	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	112.4	-7.6	-175.7	0	0	0	0	0	113.4	A441 S467	A441-G443 PolarHBondContact O-N 2.57Å; G443-S467 VanDerWaalsContact C-OG 3.24Å; G443-S467 VanDerWaalsContact CA-OG 3.25Å; G443-S467 WeakPolarHBondContact CA-OG 3.35Å; G443-S467 PolarHBondContact O-N 3.41Å; G443-S467 PolarHBondContact O-OG 2.97Å
444	L	87.2	Confident	91.8	Very high	21 Å²	21	46.8 Å²	46.8	11%	0.11	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.5	173.4	-73.5	167.2	0	0	0	111.9	L440 A441 F466	L440-L444 HydrophobicContact CD1-CB 4.46Å; A441-L444 HydrophobicContact CB-CD1 4.38Å; A441-L444 PolarHBondContact O-N 2.78Å; L444-F466 HydrophobicContact CD1-CE1 4.39Å; L444-F466 HydrophobicContact CD2-CD1 3.54Å; L444-F466 HydrophobicContact CD2-CD2 4.26Å; L444-F466 HydrophobicContact CD2-CE1 3.49Å; L444-F466 VanDerWaalsContact CD2-CE1 3.49Å; L444-F466 HydrophobicContact CD2-CE2 4.15Å; L444-F466 HydrophobicContact CD2-CG 3.94Å; L444-F466 HydrophobicContact CD2-CZ 3.79Å; L444-F466 HydrophobicContact CG-CD1 4.15Å; L444-F466 HydrophobicContact CG-CE1 3.95Å
445	D	90.6	Very high	92.1	Very high	53 Å²	53	44.2 Å²	44.2	28%	0.283	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	148.4	173.6	-77.1	-51	0	0	0	111.6	G383 K384 L464 H465	G383-D445 VanDerWaalsContact CA-OD1 3.29Å; G383-D445 WeakPolarHBondContact CA-OD1 3.29Å; K384-D445 PolarHBondContact N-OD1 2.91Å; D445-L464 WeakPolarHBondContact O-CA 3.12Å; D445-H465 PolarHBondContact N-O 2.96Å; D445-H465 PolarHBondContact O-N 3.48Å
446	F	92.6	Very high	92.3	Very high	12 Å²	12	43.6 Å²	43.6	5%	0.053	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	136.1	169.1	-62.5	-85.5	0	0	0	110.2	V266 M381 I438 L440 A462 L464	V266-F446 HydrophobicContact CG1-CD1 3.7Å; V266-F446 HydrophobicContact CG1-CE1 3.53Å; V266-F446 HydrophobicContact CG2-CE1 4.22Å; M381-F446 HydrophobicContact CB-CB 4.44Å; M381-F446 HydrophobicContact CE-CD2 3.39Å; M381-F446 HydrophobicContact CE-CE2 3.58Å; M381-F446 HydrophobicContact CE-CG 4.09Å; M381-F446 HydrophobicContact CE-CZ 4.42Å; I438-F446 HydrophobicContact CB-CE2 4.03Å; I438-F446 HydrophobicContact CB-CZ 4.4Å; I438-F446 HydrophobicContact CG1-CE2 4.42Å; I438-F446 HydrophobicContact CG2-CE2 4Å; I438-F446 HydrophobicContact CG2-CZ 3.85Å; L440-F446 HydrophobicContact CD1-CD1 4.49Å; L440-F446 HydrophobicContact CD1-CD2 3.76Å; L440-F446 HydrophobicContact CD1-CE1 4Å; L440-F446 HydrophobicContact CD1-CE2 3.15Å; L440-F446 HydrophobicContact CD1-CG 4.41Å; L440-F446 HydrophobicContact CD1-CZ 3.3Å; L440-F446 HydrophobicContact CD2-CZ 4.24Å; L440-F446 HydrophobicContact CG-CE2 3.86Å; L440-F446 HydrophobicContact CG-CZ 3.81Å; F446-A462 HydrophobicContact CB-CB 4.22Å; F446-A462 HydrophobicContact CD1-CB 3.76Å; F446-A462 HydrophobicContact CG-CB 4.46Å; F446-L464 HydrophobicContact CD1-CD2 4.11Å; F446-L464 HydrophobicContact CE1-CD2 4.31Å
447	I	93.3	Very high	92.5	Very high	66 Å²	66	43.8 Å²	43.8	34%	0.338	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	154.6	173.2	64.1	168.6	0	0	0	109.9	E449 N463 H465	I447-E449 PolarHBondContact O-N 2.94Å; I447-N463 HydrophobicContact CD1-CB 4.19Å; I447-N463 HydrophobicContact CG1-CB 3.73Å; I447-N463 PolarHBondContact N-O 2.87Å; I447-N463 PolarHBondContact O-N 3.49Å; I447-H465 HydrophobicContact CD1-CB 4.19Å; I447-H465 HydrophobicContact CG2-CB 3.94Å
448	E	93.5	Very high	92.8	Very high	125 Å²	125	42.4 Å²	42.4	58%	0.584	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	52.6	52.8	175.6	-55.6	178.5	160.2	0	0	112.6	R264 N463	R264-E448 PolarHBondContact NH1-O 2.96Å; E448-N463 PolarHBondContact OE2-ND2 3.36Å
449	E	94.6	Very high	92.9	Very high	73 Å²	73	42.5 Å²	42.5	34%	0.341	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	143.9	-178.3	82.3	-74.3	-171.7	0	0	112.3	M381 I447 I460 G461 A462	M381-E449 HydrophobicContact CB-CB 4.34Å; M381-E449 HydrophobicContact CB-CG 4.09Å; M381-E449 HydrophobicContact CG-CB 4.27Å; M381-E449 HydrophobicContact CG-CG 4.24Å; I447-E449 PolarHBondContact O-N 2.94Å; E449-I460 HydrophobicContact CB-CG2 3.95Å; E449-I460 HydrophobicContact CG-CG2 4.47Å; E449-G461 CarbonylContact C-O 3.59Å; E449-G461 WeakPolarHBondContact CA-O 3.42Å; E449-A462 HydrophobicContact CB-CB 4.2Å
450	V	96.2	Very high	93.2	Very high	55 Å²	55	42.4 Å²	42.4	33%	0.333	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	126	170.1	176.1	0	0	0	0	108.2	R264 E452 I460 G461	R264-V450 VanDerWaalsContact CZ-CG2 3.46Å; R264-V450 VanDerWaalsContact NH2-CG2 3.26Å; V450-E452 HydrophobicContact CG1-CG 4.32Å; V450-I460 CarbonylContact O-C 3.57Å; V450-I460 WeakPolarHBondContact O-CA 3.26Å; V450-G461 PolarHBondContact N-O 2.88Å; V450-G461 PolarHBondContact O-N 3.49Å
451	V	96.4	Very high	93.7	Very high	36 Å²	36	41.7 Å²	41.7	22%	0.218	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.8	-179.6	-176	0	0	0	0	109.5	Y453 L458 I459 I460	V451-Y453 HydrophobicContact CG1-CE1 4.23Å; V451-Y453 HydrophobicContact CG1-CE2 3.99Å; V451-L458 HydrophobicContact CG1-CD1 4.48Å; V451-I459 CarbonylContact C-O 3.54Å; V451-I459 WeakPolarHBondContact CA-O 3.29Å; V451-I460 HydrophobicContact CG1-CG1 4.48Å; V451-I460 HydrophobicContact CG2-CD1 4.37Å; V451-I460 HydrophobicContact CG2-CG1 4.13Å; V451-I460 HydrophobicContact CG2-CG2 4.23Å
452	E	96.8	Very high	94.2	Very high	90 Å²	90	41.2 Å²	41.2	42%	0.421	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	135.9	175.7	-63.3	-171.7	-177.9	0	0	110.1	V450 L458 I459	V450-E452 HydrophobicContact CG1-CG 4.32Å; E452-L458 CarbonylContact O-C 3.56Å; E452-L458 VanDerWaalsContact O-CA 3.29Å; E452-L458 WeakPolarHBondContact O-CA 3.49Å; E452-L458 WeakPolarHBondContact O-CB 3.36Å; E452-I459 PolarHBondContact N-O 2.85Å; E452-I459 PolarHBondContact O-N 2.88Å
453	Y	97.1	Very high	94.9	Very high	51 Å²	51	38.3 Å²	38.3	20%	0.2	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	133.4	-177.2	-61.9	-85.8	0	0	0	110.5	I339 K340 T341 A344 V451 L458	I339-Y453 HydrophobicContact CG2-CD1 3.88Å; K340-Y453 VanDerWaalsContact O-CB 3.23Å; K340-Y453 WeakPolarHBondContact O-CB 3.3Å; T341-Y453 WeakPolarHBondContact CA-O 3.35Å; A344-Y453 HydrophobicContact CB-CD1 4.29Å; A344-Y453 HydrophobicContact CB-CE1 3.85Å; V451-Y453 HydrophobicContact CG1-CE1 4.23Å; V451-Y453 HydrophobicContact CG1-CE2 3.99Å; Y453-L458 HydrophobicContact CD1-CB 3.94Å; Y453-L458 HydrophobicContact CD1-CD2 4.27Å; Y453-L458 HydrophobicContact CE1-CB 4.38Å; Y453-L458 HydrophobicContact CE1-CD2 3.95Å
454	H	96.9	Very high	95.3	Very high	44 Å²	44	38.5 Å²	38.5	20%	0.204	19%	0.194	C	C	.	.			trans	-120	-177.9	176.2	-58.8	-94.6	0	0	0	109.9	I339 K340 G456 Y457 I459	I339-H454 CarbonylContact C-O 3.55Å; I339-H454 WeakPolarHBondContact CG2-O 3.5Å; K340-H454 CarbonylContact C-O 3.56Å; K340-H454 WeakPolarHBondContact CA-O 3.29Å; K340-H454 PolarHBondContact N-O 2.86Å; H454-G456 PolarHBondContact O-N 3.47Å; H454-Y457 CarbonylContact C-O 3.51Å; H454-Y457 WeakPolarHBondContact CA-O 3.49Å; H454-Y457 HydrophobicContact CB-CD1 4.13Å; H454-Y457 HydrophobicContact CB-CD2 4.05Å; H454-Y457 HydrophobicContact CB-CE1 3.78Å; H454-Y457 HydrophobicContact CB-CE2 3.7Å; H454-Y457 HydrophobicContact CB-CG 4.25Å; H454-Y457 WeakPolarHBondContact CB-O 3.48Å; H454-Y457 AromaticContact CD2-CE2 3.61Å; H454-Y457 AromaticContact CG-CE2 3.61Å; H454-Y457 AromaticContact CG-CZ 3.71Å; H454-Y457 PolarHBondContact N-O 2.89Å; H454-I459 WeakPolarHBondContact NE2-CD1 3.37Å
455	N	97.1	Very high	95.4	Very high	107 Å²	107	42 Å²	42	57%	0.572	21%	0.209	S	C	*	.	S	Bend	trans	-82.3	110	174.4	-66.9	-30.4	0	0	0	109.1
456	G	96.8	Very high	95.1	Very high	5 Å²	5	40.9 Å²	40.9	5%	0.052	20%	0.202	C	C	.	.	S	Bend	trans	93.1	-7.9	177.6	0	0	0	0	0	116	E272 I339 H454	E272-G456 WeakPolarHBondContact CG-O 3.48Å; E272-G456 PolarHBondContact N-O 2.76Å; I339-G456 PolarHBondContact O-N 3.23Å; H454-G456 PolarHBondContact O-N 3.47Å
457	Y	97.8	Very high	94.6	Very high	24 Å²	24	43.4 Å²	43.4	9%	0.094	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	165.7	179	66.5	-85.9	0	0	0	111.3	V255 P257 I258 L270 I339 H454 I459	V255-Y457 HydrophobicContact CG1-CD1 4.3Å; V255-Y457 HydrophobicContact CG1-CE1 4.45Å; P257-Y457 HydrophobicContact CB-CD2 3.9Å; P257-Y457 HydrophobicContact CB-CE2 4.47Å; P257-Y457 HydrophobicContact CB-CG 4.1Å; P257-Y457 HydrophobicContact CG-CG 4.45Å; I258-Y457 PolarHBondContact O-OH 3.21Å; L270-Y457 CarbonylContact O-C 3.5Å; L270-Y457 VanDerWaalsContact O-CA 3.24Å; L270-Y457 WeakPolarHBondContact O-CA 3.4Å; L270-Y457 WeakPolarHBondContact O-CB 3.42Å; I339-Y457 VanDerWaalsContact CG2-O 3.3Å; I339-Y457 WeakPolarHBondContact CG2-O 3.47Å; H454-Y457 CarbonylContact C-O 3.51Å; H454-Y457 WeakPolarHBondContact CA-O 3.49Å; H454-Y457 HydrophobicContact CB-CD1 4.13Å; H454-Y457 HydrophobicContact CB-CD2 4.05Å; H454-Y457 HydrophobicContact CB-CE1 3.78Å; H454-Y457 HydrophobicContact CB-CE2 3.7Å; H454-Y457 HydrophobicContact CB-CG 4.25Å; H454-Y457 WeakPolarHBondContact CB-O 3.48Å; H454-Y457 AromaticContact CD2-CE2 3.61Å; H454-Y457 AromaticContact CG-CE2 3.61Å; H454-Y457 AromaticContact CG-CZ 3.71Å; H454-Y457 PolarHBondContact N-O 2.89Å; Y457-I459 HydrophobicContact CD2-CG1 4.08Å; Y457-I459 HydrophobicContact CE2-CD1 3.98Å; Y457-I459 HydrophobicContact CE2-CG1 3.83Å
458	L	97.6	Very high	94	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	156.8	169.4	63.9	82	0	0	0	110.5	G269 L270 F275 I339 V379 V451 E452 Y453 I460	G269-L458 CarbonylContact C-O 3.6Å; G269-L458 WeakPolarHBondContact CA-O 3.34Å; L270-L458 HydrophobicContact CB-CD1 3.98Å; L270-L458 HydrophobicContact CB-CG 4.21Å; L270-L458 HydrophobicContact CD1-CD1 4.14Å; L270-L458 HydrophobicContact CG-CD1 4.25Å; L270-L458 PolarHBondContact N-O 3.49Å; L270-L458 PolarHBondContact O-N 3.3Å; F275-L458 HydrophobicContact CE2-CD2 3.94Å; F275-L458 HydrophobicContact CE2-CG 4.4Å; F275-L458 HydrophobicContact CZ-CD2 3.93Å; I339-L458 HydrophobicContact CD1-CD2 4.32Å; I339-L458 HydrophobicContact CD1-CG 4.48Å; I339-L458 HydrophobicContact CG2-CB 4.38Å; V379-L458 HydrophobicContact CB-CD2 4.29Å; V379-L458 HydrophobicContact CG2-CD2 3.76Å; V451-L458 HydrophobicContact CG1-CD1 4.48Å; E452-L458 CarbonylContact O-C 3.56Å; E452-L458 VanDerWaalsContact O-CA 3.29Å; E452-L458 WeakPolarHBondContact O-CA 3.49Å; E452-L458 WeakPolarHBondContact O-CB 3.36Å; Y453-L458 HydrophobicContact CD1-CB 3.94Å; Y453-L458 HydrophobicContact CD1-CD2 4.27Å; Y453-L458 HydrophobicContact CE1-CB 4.38Å; Y453-L458 HydrophobicContact CE1-CD2 3.95Å; L458-I460 HydrophobicContact CD1-CD1 3.98Å; L458-I460 HydrophobicContact CD1-CG1 3.59Å
459	I	97.8	Very high	93.5	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.8	174.7	-60.5	179.1	0	0	0	108	I258 V259 Y267 L268 V451 E452 H454 Y457	I258-I459 WeakPolarHBondContact O-CD1 3.39Å; V259-I459 HydrophobicContact CG2-CD1 4.27Å; V259-I459 HydrophobicContact CG2-CG1 4.49Å; Y267-I459 HydrophobicContact CD1-CG2 3.78Å; L268-I459 CarbonylContact O-C 3.57Å; L268-I459 WeakPolarHBondContact O-CA 3.16Å; V451-I459 CarbonylContact C-O 3.54Å; V451-I459 WeakPolarHBondContact CA-O 3.29Å; E452-I459 PolarHBondContact N-O 2.85Å; E452-I459 PolarHBondContact O-N 2.88Å; H454-I459 WeakPolarHBondContact NE2-CD1 3.37Å; Y457-I459 HydrophobicContact CD2-CG1 4.08Å; Y457-I459 HydrophobicContact CE2-CD1 3.98Å; Y457-I459 HydrophobicContact CE2-CG1 3.83Å
460	I	97.6	Very high	92.9	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.015	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	106.5	169.6	-47.6	-173.6	0	0	0	107.5	Y267 L268 L270 V379 M381 L386 E449 V450 V451 L458	Y267-I460 CarbonylContact C-O 3.52Å; Y267-I460 WeakPolarHBondContact CA-O 3.48Å; L268-I460 HydrophobicContact CB-CB 4.27Å; L268-I460 HydrophobicContact CD2-CD1 4.34Å; L268-I460 PolarHBondContact N-O 3.34Å; L268-I460 PolarHBondContact O-N 3.31Å; L270-I460 HydrophobicContact CD1-CD1 4.47Å; V379-I460 HydrophobicContact CG1-CD1 3.78Å; M381-I460 HydrophobicContact CG-CD1 4.42Å; M381-I460 HydrophobicContact CG-CG2 4.02Å; M381-I460 HydrophobicContact SD-CD1 4.13Å; L386-I460 HydrophobicContact CD1-CD1 3.48Å; L386-I460 VanDerWaalsContact CD1-CD1 3.48Å; E449-I460 HydrophobicContact CB-CG2 3.95Å; E449-I460 HydrophobicContact CG-CG2 4.47Å; V450-I460 CarbonylContact O-C 3.57Å; V450-I460 WeakPolarHBondContact O-CA 3.26Å; V451-I460 HydrophobicContact CG1-CG1 4.48Å; V451-I460 HydrophobicContact CG2-CD1 4.37Å; V451-I460 HydrophobicContact CG2-CG1 4.13Å; V451-I460 HydrophobicContact CG2-CG2 4.23Å; L458-I460 HydrophobicContact CD1-CD1 3.98Å; L458-I460 HydrophobicContact CD1-CG1 3.59Å
461	G	97.4	Very high	92.4	Very high	4 Å²	4	36.2 Å²	36.2	4%	0.041	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	133	171.8	0	0	0	0	0	110.1	R264 Y267 E449 V450	R264-G461 WeakPolarHBondContact CD-O 3.43Å; Y267-G461 VanDerWaalsContact CD1-CA 3.49Å; E449-G461 CarbonylContact C-O 3.59Å; E449-G461 WeakPolarHBondContact CA-O 3.42Å; V450-G461 PolarHBondContact N-O 2.88Å; V450-G461 PolarHBondContact O-N 3.49Å
462	A	97	Very high	91.9	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	162.2	-177	0	0	0	0	0	112.4	R264 M265 V266 F446 E449	R264-A462 WeakPolarHBondContact CB-O 3.37Å; M265-A462 PolarHBondContact N-O 3.27Å; V266-A462 HydrophobicContact CG1-CB 4.22Å; V266-A462 WeakPolarHBondContact CG1-O 3.27Å; V266-A462 PolarHBondContact N-O 2.73Å; V266-A462 PolarHBondContact O-N 2.89Å; F446-A462 HydrophobicContact CB-CB 4.22Å; F446-A462 HydrophobicContact CD1-CB 3.76Å; F446-A462 HydrophobicContact CG-CB 4.46Å; E449-A462 HydrophobicContact CB-CB 4.2Å
463	N	95.6	Very high	91.3	Very high	22 Å²	22	34.1 Å²	34.1	12%	0.118	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	158.9	165.8	-69.4	-31.7	0	0	0	109.5	M265 I447 E448	M265-N463 HydrophobicContact CG-CB 4.36Å; M265-N463 PolarHBondContact N-OD1 2.97Å; M265-N463 HydrophobicContact SD-CB 4.16Å; I447-N463 HydrophobicContact CD1-CB 4.19Å; I447-N463 HydrophobicContact CG1-CB 3.73Å; I447-N463 PolarHBondContact N-O 2.87Å; I447-N463 PolarHBondContact O-N 3.49Å; E448-N463 PolarHBondContact OE2-ND2 3.36Å
464	L	92.1	Very high	90.6	Very high	16 Å²	16	31.8 Å²	31.8	8%	0.084	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	149.9	177.7	-69.6	174.7	0	0	0	110.1	M35 M265 V266 L440 D445 F446	M35-L464 VanDerWaalsContact CE-C 3.48Å; M35-L464 HydrophobicContact CE-CB 4.2Å; M35-L464 WeakPolarHBondContact CE-O 3.27Å; M35-L464 HydrophobicContact SD-CB 3.65Å; M265-L464 HydrophobicContact CB-CG 4.44Å; M265-L464 HydrophobicContact SD-CB 4.09Å; M265-L464 PolarHBondContact SD-N 2.85Å; V266-L464 HydrophobicContact CB-CD1 4.27Å; V266-L464 HydrophobicContact CB-CG 4.28Å; V266-L464 HydrophobicContact CG1-CD1 4.31Å; V266-L464 HydrophobicContact CG1-CD2 3.77Å; V266-L464 HydrophobicContact CG1-CG 3.79Å; L440-L464 HydrophobicContact CD1-CD2 4.12Å; D445-L464 WeakPolarHBondContact O-CA 3.12Å; F446-L464 HydrophobicContact CD1-CD2 4.11Å; F446-L464 HydrophobicContact CE1-CD2 4.31Å
465	H	88.6	Confident	90.2	Very high	94 Å²	94	34.2 Å²	34.2	44%	0.435	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	130.1	173.4	179.7	-94.3	0	0	0	110.6	M35 D445 I447 S467	M35-H465 VanDerWaalsContact CE-CA 3.47Å; D445-H465 PolarHBondContact N-O 2.96Å; D445-H465 PolarHBondContact O-N 3.48Å; I447-H465 HydrophobicContact CD1-CB 4.19Å; I447-H465 HydrophobicContact CG2-CB 3.94Å; H465-S467 PolarHBondContact O-N 3.21Å
466	F	84.1	Confident	89.6	Confident	30 Å²	30	35 Å²	35	13%	0.132	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	107.5	171.6	-82	-73.2	0	0	0	109.1	M35 L36 E39 L444 K468 M473	M35-F466 HydrophobicContact CE-CB 4.24Å; M35-F466 HydrophobicContact CE-CD2 3.21Å; M35-F466 HydrophobicContact CE-CE2 3.75Å; M35-F466 HydrophobicContact CE-CG 3.96Å; M35-F466 VanDerWaalsContact CE-N 3.28Å; M35-F466 HydrophobicContact CG-CD2 4.41Å; M35-F466 HydrophobicContact CG-CE2 4.34Å; M35-F466 HydrophobicContact SD-CD2 4.01Å; M35-F466 HydrophobicContact SD-CE2 3.91Å; L36-F466 HydrophobicContact CD2-CE2 3.8Å; L36-F466 HydrophobicContact CD2-CZ 3.47Å; L36-F466 VanDerWaalsContact CD2-CZ 3.47Å; E39-F466 HydrophobicContact CB-CE2 4.32Å; E39-F466 HydrophobicContact CB-CZ 4.49Å; E39-F466 HydrophobicContact CG-CD2 3.71Å; E39-F466 HydrophobicContact CG-CE2 3.69Å; E39-F466 HydrophobicContact CG-CG 4.3Å; E39-F466 HydrophobicContact CG-CZ 4.17Å; L444-F466 HydrophobicContact CD1-CE1 4.39Å; L444-F466 HydrophobicContact CD2-CD1 3.54Å; L444-F466 HydrophobicContact CD2-CD2 4.26Å; L444-F466 HydrophobicContact CD2-CE1 3.49Å; L444-F466 VanDerWaalsContact CD2-CE1 3.49Å; L444-F466 HydrophobicContact CD2-CE2 4.15Å; L444-F466 HydrophobicContact CD2-CG 3.94Å; L444-F466 HydrophobicContact CD2-CZ 3.79Å; L444-F466 HydrophobicContact CG-CD1 4.15Å; L444-F466 HydrophobicContact CG-CE1 3.95Å; F466-K468 VanDerWaalsContact C-N 3.26Å; F466-K468 WeakPolarHBondContact CD1-O 3.45Å; F466-M473 HydrophobicContact CD1-SD 4.15Å; F466-M473 HydrophobicContact CE1-SD 4.13Å
467	S	82	Confident	89	Confident	64 Å²	64	36.8 Å²	36.8	45%	0.448	18%	0.176	S	C	.	.	S	Bend	trans	-74.4	-19.9	167.8	64.5	0	0	0	0	112.7	G443 H465	G443-S467 VanDerWaalsContact C-OG 3.24Å; G443-S467 VanDerWaalsContact CA-OG 3.25Å; G443-S467 WeakPolarHBondContact CA-OG 3.35Å; G443-S467 PolarHBondContact O-N 3.41Å; G443-S467 PolarHBondContact O-OG 2.97Å; H465-S467 PolarHBondContact O-N 3.21Å
468	K	82	Confident	88.3	Confident	63 Å²	63	39.5 Å²	39.5	27%	0.274	19%	0.191	S	C	.	.	S	Bend	trans	-142.4	149.2	177.9	-64.3	178.1	-172.1	165.7	0	109.7	F466 M473 R476	F466-K468 VanDerWaalsContact C-N 3.26Å; F466-K468 WeakPolarHBondContact CD1-O 3.45Å; K468-M473 HydrophobicContact CB-CG 4.02Å; K468-R476 VanDerWaalsContact CE-CZ 3.49Å
469	G	82.1	Confident	87.7	Confident	19 Å²	19	45.1 Å²	45.1	20%	0.196	22%	0.217	C	C	.	.			trans	-74.2	158.3	177.7	0	0	0	0	0	112.6	R471 E472 M473	G469-R471 VanDerWaalsContact C-N 3.33Å; G469-R471 PolarHBondContact O-N 3.27Å; G469-E472 WeakPolarHBondContact O-CB 3.44Å; G469-E472 PolarHBondContact O-N 3.34Å; G469-E472 VanDerWaalsContact O-N 3.15Å; G469-M473 WeakPolarHBondContact O-CG 3.36Å; G469-M473 PolarHBondContact O-N 3.14Å; G469-M473 VanDerWaalsContact O-N 3.14Å
470	L	82.3	Confident	86.9	Confident	19 Å²	19	46.8 Å²	46.8	10%	0.099	23%	0.232	C	C	.	.	H	α-helix	trans	-56.6	-43.7	-174.7	-173.4	65	0	0	0	113	E39 F43 I198 L201 M473 I474	E39-L470 HydrophobicContact CB-CB 4.38Å; E39-L470 PolarHBondContact OE2-N 3.33Å; F43-L470 HydrophobicContact CB-CD2 3.81Å; F43-L470 HydrophobicContact CD1-CD2 4.03Å; F43-L470 HydrophobicContact CD2-CD2 4.38Å; F43-L470 HydrophobicContact CG-CD2 3.82Å; I198-L470 HydrophobicContact CD1-CD2 4.06Å; L201-L470 HydrophobicContact CD2-CD1 3.31Å; L470-M473 PolarHBondContact O-N 3.49Å; L470-I474 HydrophobicContact CG-CD1 4.22Å; L470-I474 WeakPolarHBondContact O-CG1 3.28Å; L470-I474 PolarHBondContact O-N 3.28Å
471	R	84.8	Confident	86.1	Confident	67 Å²	67	49.8 Å²	49.8	25%	0.253	25%	0.248	S	C	.	.	H	α-helix	trans	-60.4	-46	177.8	-177.6	67.9	-175.9	-167.2	0.6	112.6	E46 E47 G469 M473 I474 E475	E46-R471 WeakPolarHBondContact OE2-CB 3.07Å; E46-R471 WeakPolarHBondContact OE2-CG 3.46Å; E47-R471 IonicContact OE1-CZ 3.3Å; E47-R471 IonicContact OE1-NH1 3.86Å; E47-R471 PolarHBondContact OE1-NH1 3.06Å; G469-R471 VanDerWaalsContact C-N 3.33Å; G469-R471 PolarHBondContact O-N 3.27Å; R471-M473 VanDerWaalsContact C-N 3.27Å; R471-M473 PolarHBondContact O-N 3.14Å; R471-I474 PolarHBondContact O-N 2.76Å; R471-E475 HydrophobicContact CG-CG 4.43Å; R471-E475 IonicContact CZ-OE1 3.56Å; R471-E475 IonicContact NE-OE1 2.71Å; R471-E475 PolarHBondContact NE-OE1 2.95Å; R471-E475 IonicContact NH2-OE1 2.71Å; R471-E475 PolarHBondContact NH2-OE1 3.4Å; R471-E475 WeakPolarHBondContact O-CG 3.35Å; R471-E475 PolarHBondContact O-N 3.3Å
472	E	85.9	Confident	85.3	Confident	73 Å²	73	52.2 Å²	52.2	34%	0.341	27%	0.267	S	S	.	.	H	α-helix	trans	-63	-37.5	-179.1	-169.9	-165.8	157.3	0	0	111.3	G469 R476	G469-E472 WeakPolarHBondContact O-CB 3.44Å; G469-E472 PolarHBondContact O-N 3.34Å; G469-E472 VanDerWaalsContact O-N 3.15Å; E472-R476 WeakPolarHBondContact O-CB 3.31Å; E472-R476 WeakPolarHBondContact O-CD 3.26Å; E472-R476 VanDerWaalsContact O-CG 3.23Å; E472-R476 WeakPolarHBondContact O-CG 3.35Å; E472-R476 PolarHBondContact O-N 2.82Å; E472-R476 VanDerWaalsContact O-N 3.13Å; E472-R476 IonicContact OE1-CZ 2.98Å; E472-R476 IonicContact OE1-NE 2.66Å; E472-R476 PolarHBondContact OE1-NE 3.01Å; E472-R476 IonicContact OE1-NH2 3.26Å; E472-R476 PolarHBondContact OE1-NH2 3.07Å
473	M	83.7	Confident	84.6	Confident	10 Å²	10	57.8 Å²	57.8	5%	0.049	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-42.7	176.7	-63.4	163.8	60.9	0	0	111.3	L201 A441 D442 F466 K468 G469 L470 R471 K477	L201-M473 HydrophobicContact CD1-CB 3.71Å; L201-M473 HydrophobicContact CD1-CE 3.66Å; L201-M473 HydrophobicContact CD2-CE 4.21Å; L201-M473 HydrophobicContact CG-CE 4.49Å; A441-M473 HydrophobicContact CB-CE 3.99Å; D442-M473 WeakPolarHBondContact O-CE 3.35Å; D442-M473 WeakPolarHBondContact O-CG 3.49Å; F466-M473 HydrophobicContact CD1-SD 4.15Å; F466-M473 HydrophobicContact CE1-SD 4.13Å; K468-M473 HydrophobicContact CB-CG 4.02Å; G469-M473 WeakPolarHBondContact O-CG 3.36Å; G469-M473 PolarHBondContact O-N 3.14Å; G469-M473 VanDerWaalsContact O-N 3.14Å; L470-M473 PolarHBondContact O-N 3.49Å; R471-M473 VanDerWaalsContact C-N 3.27Å; R471-M473 PolarHBondContact O-N 3.14Å; M473-K477 PolarHBondContact O-N 3.19Å
474	I	83.8	Confident	83.6	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-66.1	-49.7	178	-66.5	161.8	0	0	0	110.9	F43 L197 I198 L201 L470 R471 R476 K477 I478	F43-I474 HydrophobicContact CD2-CD1 4.27Å; F43-I474 HydrophobicContact CE2-CD1 3.64Å; F43-I474 HydrophobicContact CZ-CD1 4.03Å; L197-I474 HydrophobicContact CB-CD1 4.22Å; L197-I474 HydrophobicContact CB-CG2 4.13Å; L197-I474 HydrophobicContact CD2-CG2 4.22Å; I198-I474 HydrophobicContact CD1-CD1 4.36Å; L201-I474 HydrophobicContact CB-CG1 4.01Å; L470-I474 HydrophobicContact CG-CD1 4.22Å; L470-I474 WeakPolarHBondContact O-CG1 3.28Å; L470-I474 PolarHBondContact O-N 3.28Å; R471-I474 PolarHBondContact O-N 2.76Å; I474-R476 VanDerWaalsContact C-N 3.34Å; I474-R476 PolarHBondContact O-N 3.36Å; I474-K477 PolarHBondContact O-N 3.46Å; I474-K477 VanDerWaalsContact O-N 3.12Å; I474-I478 HydrophobicContact CG2-CD1 3.76Å; I474-I478 HydrophobicContact CG2-CG1 4.45Å; I474-I478 WeakPolarHBondContact O-CG1 3.17Å; I474-I478 PolarHBondContact O-N 2.95Å
475	E	87.1	Confident	82.5	Confident	95 Å²	95	66.5 Å²	66.5	44%	0.444	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-40.1	-176.9	-73.7	177.9	168.6	0	0	112.5	R471 K477 I478 Q479	R471-E475 HydrophobicContact CG-CG 4.43Å; R471-E475 IonicContact CZ-OE1 3.56Å; R471-E475 IonicContact NE-OE1 2.71Å; R471-E475 PolarHBondContact NE-OE1 2.95Å; R471-E475 IonicContact NH2-OE1 2.71Å; R471-E475 PolarHBondContact NH2-OE1 3.4Å; R471-E475 WeakPolarHBondContact O-CG 3.35Å; R471-E475 PolarHBondContact O-N 3.3Å; E475-K477 VanDerWaalsContact C-N 3.29Å; E475-K477 PolarHBondContact O-N 2.86Å; E475-I478 PolarHBondContact O-N 2.99Å; E475-Q479 WeakPolarHBondContact O-CB 3.37Å; E475-Q479 PolarHBondContact O-N 3.35Å
476	R	85.9	Confident	81	Confident	124 Å²	124	71.5 Å²	71.5	47%	0.468	38%	0.38	S	S	.	.	H	α-helix	trans	-59.8	-39.6	175.1	-77.4	170.6	179.8	-112.3	5.3	112.2	K468 E472 I474 A480	K468-R476 VanDerWaalsContact CE-CZ 3.49Å; E472-R476 WeakPolarHBondContact O-CB 3.31Å; E472-R476 WeakPolarHBondContact O-CD 3.26Å; E472-R476 VanDerWaalsContact O-CG 3.23Å; E472-R476 WeakPolarHBondContact O-CG 3.35Å; E472-R476 PolarHBondContact O-N 2.82Å; E472-R476 VanDerWaalsContact O-N 3.13Å; E472-R476 IonicContact OE1-CZ 2.98Å; E472-R476 IonicContact OE1-NE 2.66Å; E472-R476 PolarHBondContact OE1-NE 3.01Å; E472-R476 IonicContact OE1-NH2 3.26Å; E472-R476 PolarHBondContact OE1-NH2 3.07Å; I474-R476 VanDerWaalsContact C-N 3.34Å; I474-R476 PolarHBondContact O-N 3.36Å; R476-A480 WeakPolarHBondContact O-CB 3.3Å; R476-A480 PolarHBondContact O-N 3.25Å
477	K	84.1	Confident	80.9	Confident	42 Å²	42	73.6 Å²	73.6	18%	0.183	39%	0.392	C	S	.	.	H	α-helix	trans	-68.2	-46.2	177.7	179.3	55.8	163.8	83.5	0	111.2	T204 M473 I474 E475 Q479 A480 D481	T204-K477 HydrophobicContact CG2-CB 4.06Å; T204-K477 HydrophobicContact CG2-CD 3.91Å; T204-K477 HydrophobicContact CG2-CG 3.91Å; M473-K477 PolarHBondContact O-N 3.19Å; I474-K477 PolarHBondContact O-N 3.46Å; I474-K477 VanDerWaalsContact O-N 3.12Å; E475-K477 VanDerWaalsContact C-N 3.29Å; E475-K477 PolarHBondContact O-N 2.86Å; K477-Q479 VanDerWaalsContact C-N 3.27Å; K477-Q479 PolarHBondContact O-N 3.44Å; K477-A480 PolarHBondContact O-N 2.95Å; K477-D481 IonicContact NZ-OD1 3.19Å; K477-D481 PolarHBondContact NZ-OD1 3.25Å; K477-D481 IonicContact NZ-OD2 2.93Å; K477-D481 PolarHBondContact NZ-OD2 3.42Å; K477-D481 PolarHBondContact O-N 2.88Å
478	I	83.2	Confident	80.8	Confident	82 Å²	82	74.1 Å²	74.1	42%	0.421	39%	0.39	S	S	.	.	H	α-helix	trans	-58.4	-42.8	177.4	-66.5	170.5	0	0	0	110.6	L197 I474 E475 D481 A482	L197-I478 HydrophobicContact CD2-CD1 4.21Å; I474-I478 HydrophobicContact CG2-CD1 3.76Å; I474-I478 HydrophobicContact CG2-CG1 4.45Å; I474-I478 WeakPolarHBondContact O-CG1 3.17Å; I474-I478 PolarHBondContact O-N 2.95Å; E475-I478 PolarHBondContact O-N 2.99Å; I478-D481 PolarHBondContact O-N 3.49Å; I478-A482 PolarHBondContact O-N 3.46Å
479	Q	84.2	Confident	80.7	Confident	118 Å²	118	74.7 Å²	74.7	55%	0.551	40%	0.396	S	S	*	.	H	α-helix	trans	-64.2	-45.2	177	-174.6	178	-7.2	0	0	111.9	E475 K477 D481 A482 E483	E475-Q479 WeakPolarHBondContact O-CB 3.37Å; E475-Q479 PolarHBondContact O-N 3.35Å; K477-Q479 VanDerWaalsContact C-N 3.27Å; K477-Q479 PolarHBondContact O-N 3.44Å; Q479-D481 VanDerWaalsContact C-N 3.28Å; Q479-D481 PolarHBondContact O-N 3.2Å; Q479-A482 PolarHBondContact O-N 3.45Å; Q479-E483 PolarHBondContact NE2-OE1 2.76Å; Q479-E483 WeakPolarHBondContact O-CG 3.39Å; Q479-E483 PolarHBondContact O-N 3.15Å
480	A	81.3	Confident	80.6	Confident	37 Å²	37	78 Å²	78	31%	0.306	41%	0.408	S	S	.	.	H	α-helix	trans	-60.9	-37.4	177.4	0	0	0	0	0	112.3	R476 K477 E483 N484	R476-A480 WeakPolarHBondContact O-CB 3.3Å; R476-A480 PolarHBondContact O-N 3.25Å; K477-A480 PolarHBondContact O-N 2.95Å; A480-E483 PolarHBondContact O-N 3.22Å; A480-N484 VanDerWaalsContact O-CG 3.28Å; A480-N484 PolarHBondContact O-N 3.21Å; A480-N484 VanDerWaalsContact O-N 3.08Å; A480-N484 PolarHBondContact O-ND2 3.35Å
481	D	80.7	Confident	80.5	Confident	66 Å²	66	81.7 Å²	81.7	35%	0.353	43%	0.427	S	S	.	.	H	α-helix	trans	-68.3	-38.8	176.1	-69.1	-20.7	0	0	0	112.3	K477 I478 Q479 N484 A485	K477-D481 IonicContact NZ-OD1 3.19Å; K477-D481 PolarHBondContact NZ-OD1 3.25Å; K477-D481 IonicContact NZ-OD2 2.93Å; K477-D481 PolarHBondContact NZ-OD2 3.42Å; K477-D481 PolarHBondContact O-N 2.88Å; I478-D481 PolarHBondContact O-N 3.49Å; Q479-D481 VanDerWaalsContact C-N 3.28Å; Q479-D481 PolarHBondContact O-N 3.2Å; D481-N484 PolarHBondContact O-N 3.31Å; D481-A485 WeakPolarHBondContact O-CB 3.29Å; D481-A485 PolarHBondContact O-N 3.2Å
482	A	80	Confident	80.3	Confident	55 Å²	55	82.7 Å²	82.7	46%	0.455	44%	0.439	S	S	.	.	H	α-helix	trans	-65.2	-39.4	175.2	0	0	0	0	0	111.9	I478 Q479 A485 I486	I478-A482 PolarHBondContact O-N 3.46Å; Q479-A482 PolarHBondContact O-N 3.45Å; A482-A485 PolarHBondContact O-N 3.27Å; A482-I486 WeakPolarHBondContact O-CG1 3.39Å
483	E	82.1	Confident	79.8	Confident	116 Å²	116	83.4 Å²	83.4	54%	0.542	45%	0.446	S	S	.	.	H	α-helix	trans	-67	-35.7	176.6	-73.2	174.4	-169.4	0	0	112.4	Q479 A480 A485	Q479-E483 PolarHBondContact NE2-OE1 2.76Å; Q479-E483 WeakPolarHBondContact O-CG 3.39Å; Q479-E483 PolarHBondContact O-N 3.15Å; A480-E483 PolarHBondContact O-N 3.22Å; E483-A485 VanDerWaalsContact C-N 3.32Å
484	N	75.4	Confident	79.6	Confident	134 Å²	134	89 Å²	89	72%	0.717	48%	0.476	S	S	*	.	H	α-helix	trans	-77.7	-14.5	177.8	-71.1	-35.7	0	0	0	114.1	A480 D481	A480-N484 VanDerWaalsContact O-CG 3.28Å; A480-N484 PolarHBondContact O-N 3.21Å; A480-N484 VanDerWaalsContact O-N 3.08Å; A480-N484 PolarHBondContact O-ND2 3.35Å; D481-N484 PolarHBondContact O-N 3.31Å
485	A	68.9	Low	79.2	Confident	87 Å²	87	96.3 Å²	96.3	72%	0.719	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-7.7	178.7	0	0	0	0	0	113.5	D481 A482 E483	D481-A485 WeakPolarHBondContact O-CB 3.29Å; D481-A485 PolarHBondContact O-N 3.2Å; A482-A485 PolarHBondContact O-N 3.27Å; E483-A485 VanDerWaalsContact C-N 3.32Å
486	I	57.4	Low	78.5	Confident	200 Å²	200	96.5 Å²	96.5	100%	1.026	52%	0.522	S	S	*	.			trans	-96.6	0	175.3	-58.7	167.2	0	0	0	108.6	A482	A482-I486 WeakPolarHBondContact O-CG1 3.39Å

Retrieved 486 of 486 residues in 151.4 ms (Link to these results)

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