A0A087Y3B0_POEFO Loading...

Mediator of RNA polymerase II transcription subunit 25

Component of the Mediator complex, a coactivator involved in the regulated transcription of nearly all RNA polymerase II-dependent genes. Mediator functions as a bridge to convey information from gene-specific regulatory proteins to the basal RNA polymerase II transcription machinery. Mediator is recruited to promoters by direct interactions with regulatory proteins and serves as a scaffold for the assembly of a functional preinitiation complex with RNA polymerase II and the general transcription factors.

AlphaFold DB , UniProt , Accession A0A087Y3B0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 680 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	31.4	Very low	39.4	Very low	252 Å²	252	128.6 Å²	128.6	100%	1.241	74%	0.739	S	S	*	*				0	113.2	0	-101.3	169	165.9	0	0	106.6
2	E	26.1	Very low	43.2	Very low	190 Å²	190	120.8 Å²	120.8	89%	0.888	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-94.5	139.2	-178.1	-162.9	164.3	95.4	0	0	109.1	S4	E2-S4 PolarHBondContact O-N 3.4Å
3	P	31.4	Very low	46.9	Very low	111 Å²	111	111.6 Å²	111.6	72%	0.721	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-71.3	124.9	-179	28.3	-33.4	0	0	0	110.9	T5	P3-T5 PolarHBondContact O-N 3.21Å
4	S	28.4	Very low	50.3	Low	95 Å²	95	103.7 Å²	103.7	66%	0.664	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-53.3	119	177.3	156.1	0	0	0	0	111.9	E2 K6	E2-S4 PolarHBondContact O-N 3.4Å; S4-K6 PolarHBondContact O-N 2.9Å; S4-K6 PolarHBondContact OG-N 3Å
5	T	39.3	Very low	53.4	Low	137 Å²	137	96.8 Å²	96.8	84%	0.84	56%	0.557	S	S	*	*	S	Bend	trans	-70.3	14.2	178.7	40.5	0	0	0	0	115.5	P3 P7	P3-T5 PolarHBondContact O-N 3.21Å; T5-P7 WeakPolarHBondContact O-CD 3.44Å
6	K	35.3	Very low	56.2	Low	176 Å²	176	90.8 Å²	90.8	77%	0.765	52%	0.522	S	S	*	.	S	Bend	trans	-81.4	117	164.7	-70.2	-174.1	175.5	-176.5	0	109.4	S4 G8	S4-K6 PolarHBondContact O-N 2.9Å; S4-K6 PolarHBondContact OG-N 3Å; K6-G8 PolarHBondContact O-N 3.48Å
7	P	38.8	Very low	58.7	Low	51 Å²	51	85.5 Å²	85.5	33%	0.331	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-61	131.9	169.4	27.7	-34.3	0	0	0	108.9	T5 Q11 Y43	T5-P7 WeakPolarHBondContact O-CD 3.44Å; P7-Q11 VanDerWaalsContact CB-OE1 3.26Å; P7-Y43 WeakPolarHBondContact CG-OH 3.34Å
8	G	34.8	Very low	60.9	Low	45 Å²	45	80.7 Å²	80.7	46%	0.464	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-69.5	159.7	177.2	0	0	0	0	0	111.6	K6 S10 Q11	K6-G8 PolarHBondContact O-N 3.48Å; G8-S10 PolarHBondContact O-N 2.97Å; G8-Q11 PolarHBondContact O-N 3.1Å
9	P	45.3	Very low	62.9	Low	150 Å²	150	76.5 Å²	76.5	97%	0.974	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	35	-178.3	33.5	-38.5	0	0	0	113.7
10	S	50.8	Low	64.6	Low	114 Å²	114	72.7 Å²	72.7	80%	0.797	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.6	12.1	-177.9	-174.8	0	0	0	0	112.1	G8	G8-S10 PolarHBondContact O-N 2.97Å
11	Q	71.9	Confident	66	Low	94 Å²	94	69.2 Å²	69.2	44%	0.439	40%	0.398	S	S	.	.			trans	-89.1	117.8	178.9	-168.7	172	10.5	0	0	111.4	P7 G8 A13 H136	P7-Q11 VanDerWaalsContact CB-OE1 3.26Å; G8-Q11 PolarHBondContact O-N 3.1Å; Q11-A13 PolarHBondContact O-N 3.37Å; Q11-H136 HydrophobicContact CG-CB 3.99Å
12	V	84.9	Confident	68.9	Low	35 Å²	35	57.3 Å²	57.3	21%	0.212	34%	0.34	C	S	.	.			trans	-62.2	120.2	-179.8	-174.2	0	0	0	0	111	G59 I132 T135 H136	V12-G59 WeakPolarHBondContact CG1-O 3.49Å; V12-G59 VanDerWaalsContact CG2-O 3.22Å; V12-G59 WeakPolarHBondContact CG2-O 3.33Å; V12-I132 HydrophobicContact CG1-CG2 4.45Å; V12-T135 HydrophobicContact CB-CG2 4.48Å; V12-T135 HydrophobicContact CG1-CG2 4.17Å; V12-T135 CarbonylContact O-C 3.55Å; V12-T135 VanDerWaalsContact O-CA 3.29Å; V12-T135 WeakPolarHBondContact O-CA 3.41Å; V12-T135 WeakPolarHBondContact O-CB 3.27Å; V12-H136 PolarHBondContact O-N 3.25Å
13	A	91.7	Very high	72	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.008	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	148.1	-174.3	0	0	0	0	0	114.3	Q11 V15 F44 T61 Q62 R129 H136	Q11-A13 PolarHBondContact O-N 3.37Å; A13-V15 HydrophobicContact CB-CG2 4.06Å; A13-F44 HydrophobicContact CB-CD1 4Å; A13-F44 HydrophobicContact CB-CE1 4.36Å; A13-T61 HydrophobicContact CB-CG2 4.2Å; A13-Q62 PolarHBondContact O-N 3.18Å; A13-R129 VanDerWaalsContact C-NH1 3.26Å; A13-R129 PolarHBondContact O-NH1 3.38Å; A13-R129 PolarHBondContact O-NH2 3.39Å; A13-H136 CarbonylContact C-O 3.58Å; A13-H136 WeakPolarHBondContact CA-O 3.37Å; A13-H136 HydrophobicContact CB-CB 4.35Å
14	D	94.4	Very high	74.9	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	117.3	164.4	-67.8	-57.7	0	0	0	108	F122 F125 R129 T135 H136 K137 V138	D14-F122 HydrophobicContact CB-CD1 4.14Å; D14-F122 HydrophobicContact CB-CE1 3.84Å; D14-F125 HydrophobicContact CB-CB 4.49Å; D14-F125 HydrophobicContact CB-CD2 3.76Å; D14-F125 HydrophobicContact CB-CE2 4.18Å; D14-F125 HydrophobicContact CB-CG 4.16Å; D14-F125 VanDerWaalsContact OD1-CB 3.22Å; D14-F125 WeakPolarHBondContact OD1-CB 3.02Å; D14-F125 WeakPolarHBondContact OD1-CD1 3.28Å; D14-F125 WeakPolarHBondContact OD1-CG 3.48Å; D14-R129 IonicContact OD1-CZ 3.15Å; D14-R129 IonicContact OD1-NE 3.43Å; D14-R129 IonicContact OD1-NH1 2.84Å; D14-R129 PolarHBondContact OD1-NH1 2.83Å; D14-R129 IonicContact OD2-NH1 2.8Å; D14-R129 PolarHBondContact OD2-NH1 3.35Å; D14-T135 VanDerWaalsContact OD2-CB 3.24Å; D14-T135 WeakPolarHBondContact OD2-CB 3.45Å; D14-T135 PolarHBondContact OD2-OG1 3.47Å; D14-H136 PolarHBondContact N-O 3.29Å; D14-K137 HydrophobicContact CB-CG 4.17Å; D14-K137 CarbonylContact O-C 3.52Å; D14-K137 WeakPolarHBondContact O-CA 3.41Å; D14-V138 PolarHBondContact O-N 3.07Å
15	V	96.6	Very high	78	Confident	0 Å²	0	43 Å²	43	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	118.2	-172.7	-168.2	0	0	0	0	110.2	A13 F17 F44 T61 Q62 Y63 G64 V138	A13-V15 HydrophobicContact CB-CG2 4.06Å; V15-F17 HydrophobicContact CG1-CD2 3.99Å; V15-F17 HydrophobicContact CG1-CE2 3.55Å; V15-F17 HydrophobicContact CG1-CZ 4.48Å; V15-F44 HydrophobicContact CB-CD2 4.4Å; V15-F44 HydrophobicContact CB-CE2 4.41Å; V15-F44 HydrophobicContact CG1-CD2 3.91Å; V15-F44 HydrophobicContact CG1-CE2 3.64Å; V15-F44 HydrophobicContact CG1-CZ 4.26Å; V15-F44 HydrophobicContact CG2-CB 4.38Å; V15-F44 HydrophobicContact CG2-CD1 3.82Å; V15-F44 HydrophobicContact CG2-CD2 3.7Å; V15-F44 HydrophobicContact CG2-CE1 3.91Å; V15-F44 HydrophobicContact CG2-CE2 3.81Å; V15-F44 HydrophobicContact CG2-CG 3.72Å; V15-F44 HydrophobicContact CG2-CZ 3.91Å; V15-T61 HydrophobicContact CG2-CG2 4.22Å; V15-Q62 PolarHBondContact N-O 2.95Å; V15-Y63 HydrophobicContact CB-CD1 4.19Å; V15-Y63 CarbonylContact O-C 3.49Å; V15-Y63 WeakPolarHBondContact O-CA 3.16Å; V15-G64 PolarHBondContact O-N 3.15Å; V15-V138 WeakPolarHBondContact CA-O 3.41Å
16	V	98.3	Very high	80.6	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.4	176	-176.5	0	0	0	0	110.1	V18 G64 V66 A118 L121 F122 F125 V138 C139 V140	V16-V18 HydrophobicContact CG1-CG2 3.95Å; V16-G64 WeakPolarHBondContact CA-O 3.33Å; V16-V66 HydrophobicContact CG1-CG2 3.95Å; V16-A118 HydrophobicContact CG1-CB 3.76Å; V16-L121 HydrophobicContact CG1-CD1 3.99Å; V16-L121 HydrophobicContact CG2-CB 4.08Å; V16-L121 HydrophobicContact CG2-CD1 4.24Å; V16-F122 HydrophobicContact CB-CE2 3.87Å; V16-F122 HydrophobicContact CB-CZ 3.93Å; V16-F122 HydrophobicContact CG2-CD2 4.12Å; V16-F122 HydrophobicContact CG2-CE1 4.1Å; V16-F122 HydrophobicContact CG2-CE2 3.56Å; V16-F122 HydrophobicContact CG2-CZ 3.54Å; V16-F125 HydrophobicContact CG2-CE2 3.72Å; V16-V138 PolarHBondContact N-O 3.4Å; V16-C139 CarbonylContact O-C 3.56Å; V16-C139 WeakPolarHBondContact O-CA 3.5Å; V16-V140 PolarHBondContact O-N 3.32Å
17	F	98.5	Very high	83.4	Confident	1 Å²	1	34.3 Å²	34.3	0%	0.004	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	131.6	168	-72.7	-107.3	0	0	0	109.6	V15 I19 I37 A40 I41 G64 L65 V66 F91 V140 L142	V15-F17 HydrophobicContact CG1-CD2 3.99Å; V15-F17 HydrophobicContact CG1-CE2 3.55Å; V15-F17 HydrophobicContact CG1-CZ 4.48Å; F17-I19 HydrophobicContact CB-CD1 4.29Å; F17-I19 HydrophobicContact CB-CG1 4.22Å; F17-I37 HydrophobicContact CD1-CG2 4.17Å; F17-I37 HydrophobicContact CE1-CB 4.48Å; F17-I37 HydrophobicContact CE1-CG2 3.78Å; F17-I37 HydrophobicContact CZ-CG2 4.34Å; F17-A40 HydrophobicContact CE1-CB 4.43Å; F17-A40 HydrophobicContact CZ-CB 3.92Å; F17-I41 HydrophobicContact CE2-CG1 4.3Å; F17-I41 HydrophobicContact CZ-CG1 4.17Å; F17-G64 PolarHBondContact N-O 3.15Å; F17-L65 HydrophobicContact CB-CD1 4.35Å; F17-V66 PolarHBondContact O-N 3.04Å; F17-F91 HydrophobicContact CB-CZ 4.06Å; F17-F91 AromaticContact CD2-CE1 3.62Å; F17-F91 HydrophobicContact CD2-CE1 3.62Å; F17-F91 AromaticContact CD2-CZ 3.42Å; F17-F91 HydrophobicContact CD2-CZ 3.42Å; F17-F91 VanDerWaalsContact CD2-CZ 3.42Å; F17-F91 AromaticContact CE2-CE1 3.82Å; F17-F91 HydrophobicContact CE2-CE1 3.82Å; F17-F91 HydrophobicContact CE2-CZ 4.11Å; F17-F91 HydrophobicContact CG-CE1 4.34Å; F17-F91 AromaticContact CG-CZ 3.99Å; F17-F91 HydrophobicContact CG-CZ 3.99Å; F17-V140 WeakPolarHBondContact CA-O 3.47Å; F17-V140 HydrophobicContact CD1-CB 3.8Å; F17-V140 HydrophobicContact CD1-CG1 3.95Å; F17-V140 HydrophobicContact CD1-CG2 4.38Å; F17-V140 HydrophobicContact CE1-CB 3.97Å; F17-V140 HydrophobicContact CE1-CG1 3.86Å; F17-V140 HydrophobicContact CE1-CG2 4.17Å; F17-V140 HydrophobicContact CE2-CG2 4.45Å; F17-V140 HydrophobicContact CG-CB 4.18Å; F17-V140 HydrophobicContact CZ-CB 4.5Å; F17-V140 HydrophobicContact CZ-CG2 4.23Å; F17-L142 HydrophobicContact CD1-CD1 4.41Å
18	V	98.6	Very high	86.1	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	100.4	-176.7	-171.9	0	0	0	0	107	V16 V66 F68 L115 A118 V140 L141 L142	V16-V18 HydrophobicContact CG1-CG2 3.95Å; V18-V66 CarbonylContact C-O 3.49Å; V18-V66 WeakPolarHBondContact CA-O 3.47Å; V18-V66 HydrophobicContact CG1-CB 4.44Å; V18-V66 HydrophobicContact CG1-CG1 4.46Å; V18-V66 HydrophobicContact CG2-CB 4.42Å; V18-F68 HydrophobicContact CG1-CD1 3.68Å; V18-F68 HydrophobicContact CG1-CE1 3.79Å; V18-L115 HydrophobicContact CG1-CD2 4.42Å; V18-L115 HydrophobicContact CG2-CD2 4.46Å; V18-A118 HydrophobicContact CG2-CB 3.59Å; V18-V140 PolarHBondContact N-O 2.9Å; V18-L141 HydrophobicContact CB-CD1 4.24Å; V18-L141 HydrophobicContact CG1-CD1 4.1Å; V18-L141 CarbonylContact O-C 3.54Å; V18-L141 WeakPolarHBondContact O-CA 3.46Å; V18-L142 PolarHBondContact O-N 2.85Å
19	I	98.3	Very high	89	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.8	-164.6	-51.9	-170.8	0	0	0	110.7	F17 G21 L25 F29 L65 V66 V67 F68 I98 F100 L142	F17-I19 HydrophobicContact CB-CD1 4.29Å; F17-I19 HydrophobicContact CB-CG1 4.22Å; I19-G21 PolarHBondContact O-N 3.48Å; I19-L25 HydrophobicContact CG2-CD2 3.77Å; I19-F29 HydrophobicContact CD1-CE2 4.29Å; I19-F29 HydrophobicContact CG2-CD2 4.5Å; I19-F29 HydrophobicContact CG2-CE2 3.87Å; I19-L65 HydrophobicContact CD1-CD1 3.72Å; I19-L65 HydrophobicContact CG1-CD1 4Å; I19-V66 PolarHBondContact N-O 2.82Å; I19-V67 CarbonylContact O-C 3.53Å; I19-V67 VanDerWaalsContact O-CA 3.29Å; I19-V67 WeakPolarHBondContact O-CA 3.08Å; I19-F68 VanDerWaalsContact O-CD1 3.23Å; I19-F68 WeakPolarHBondContact O-CD1 3.48Å; I19-F68 PolarHBondContact O-N 3.39Å; I19-I98 HydrophobicContact CB-CD1 4.39Å; I19-I98 HydrophobicContact CD1-CD1 3.98Å; I19-I98 HydrophobicContact CG2-CD1 4.19Å; I19-F100 HydrophobicContact CG2-CE1 4.43Å; I19-L142 CarbonylContact C-O 3.56Å; I19-L142 WeakPolarHBondContact CA-O 3.39Å; I19-L142 HydrophobicContact CB-CB 4.47Å; I19-L142 HydrophobicContact CG1-CB 4.28Å; I19-L142 HydrophobicContact CG2-CB 4.23Å
20	E	96.6	Very high	91.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	108.9	174.1	-173.9	180	164.9	0	0	110.4	T22 L25 F68 F100 L142 C143 N144 S145	E20-T22 HydrophobicContact CG-CG2 3.62Å; E20-T22 WeakPolarHBondContact CG-OG1 2.96Å; E20-T22 PolarHBondContact O-N 2.9Å; E20-T22 PolarHBondContact OE1-OG1 2.96Å; E20-L25 HydrophobicContact CB-CB 4.44Å; E20-L25 HydrophobicContact CB-CD2 4.17Å; E20-L25 WeakPolarHBondContact O-CB 3.22Å; E20-L25 VanDerWaalsContact O-CD2 3.31Å; E20-L25 WeakPolarHBondContact O-CD2 3.46Å; E20-F68 CarbonylContact C-O 3.54Å; E20-F68 WeakPolarHBondContact CA-O 3.23Å; E20-F68 HydrophobicContact CB-CE1 4.17Å; E20-F68 HydrophobicContact CB-CE2 4.23Å; E20-F68 HydrophobicContact CB-CZ 3.81Å; E20-F68 HydrophobicContact CG-CE2 4.36Å; E20-F68 HydrophobicContact CG-CZ 4.41Å; E20-F100 WeakPolarHBondContact O-CE1 3.24Å; E20-L142 PolarHBondContact N-O 3.13Å; E20-C143 HydrophobicContact CB-CB 3.88Å; E20-C143 WeakPolarHBondContact OE2-CA 3.37Å; E20-C143 WeakPolarHBondContact OE2-CB 3.39Å; E20-N144 PolarHBondContact OE2-N 3.25Å; E20-S145 WeakPolarHBondContact OE1-CB 3.39Å; E20-S145 PolarHBondContact OE1-OG 3.08Å; E20-S145 PolarHBondContact OE2-N 3.19Å; E20-S145 PolarHBondContact OE2-OG 3.01Å
21	G	94.4	Very high	93.6	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.01	17%	0.17	C	C	.	.			trans	-77.7	9.9	-178.3	0	0	0	0	0	114.9	I19 F68 N69 F100 M101	I19-G21 PolarHBondContact O-N 3.48Å; G21-F68 PolarHBondContact N-O 2.87Å; G21-N69 WeakPolarHBondContact CA-OD1 3.4Å; G21-F100 WeakPolarHBondContact O-CA 3.24Å; G21-M101 PolarHBondContact O-N 3.29Å; G21-M101 VanDerWaalsContact O-N 3.15Å
22	T	92.3	Very high	94.8	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.006	15%	0.149	C	C	.	.	S	Bend	trans	-80.8	158.9	-173.3	73.4	0	0	0	0	112.2	E20 N24 L25 T70 M101	E20-T22 HydrophobicContact CG-CG2 3.62Å; E20-T22 WeakPolarHBondContact CG-OG1 2.96Å; E20-T22 PolarHBondContact O-N 2.9Å; E20-T22 PolarHBondContact OE1-OG1 2.96Å; T22-N24 PolarHBondContact O-N 3.49Å; T22-N24 WeakPolarHBondContact OG1-CB 3.36Å; T22-N24 PolarHBondContact OG1-N 2.57Å; T22-L25 PolarHBondContact O-N 2.76Å; T22-L25 VanDerWaalsContact O-N 3.12Å; T22-T70 HydrophobicContact CG2-CG2 3.57Å; T22-M101 WeakPolarHBondContact CA-O 3.42Å
23	A	91.3	Very high	95.3	Very high	44 Å²	44	25.9 Å²	25.9	36%	0.364	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-14.3	169.8	0	0	0	0	0	113.4	P27 G102	A23-P27 VanDerWaalsContact O-CD 3.27Å; A23-P27 WeakPolarHBondContact O-CD 3.29Å; A23-G102 VanDerWaalsContact CB-O 3.31Å; A23-G102 WeakPolarHBondContact CB-O 3.33Å; A23-G102 PolarHBondContact N-O 3.42Å
24	N	91.7	Very high	95.5	Very high	51 Å²	51	32.6 Å²	32.6	27%	0.273	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-25.5	176.7	-168.3	32.6	0	0	0	113	T22 N144 S145	T22-N24 PolarHBondContact O-N 3.49Å; T22-N24 WeakPolarHBondContact OG1-CB 3.36Å; T22-N24 PolarHBondContact OG1-N 2.57Å; N24-N144 PolarHBondContact O-ND2 3.06Å; N24-N144 PolarHBondContact OD1-ND2 2.92Å; N24-N144 VanDerWaalsContact OD1-ND2 3.14Å; N24-S145 PolarHBondContact ND2-OG 2.94Å
25	L	94.6	Very high	95.5	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-34.1	174.6	-169.2	63.5	0	0	0	112.5	I19 E20 T22 Y28 F29 L32 F100 L142 N144 P182	I19-L25 HydrophobicContact CG2-CD2 3.77Å; E20-L25 HydrophobicContact CB-CB 4.44Å; E20-L25 HydrophobicContact CB-CD2 4.17Å; E20-L25 WeakPolarHBondContact O-CB 3.22Å; E20-L25 VanDerWaalsContact O-CD2 3.31Å; E20-L25 WeakPolarHBondContact O-CD2 3.46Å; T22-L25 PolarHBondContact O-N 2.76Å; T22-L25 VanDerWaalsContact O-N 3.12Å; L25-Y28 PolarHBondContact O-N 2.88Å; L25-F29 HydrophobicContact CD2-CD2 4.09Å; L25-F29 HydrophobicContact CG-CD2 4.4Å; L25-F29 PolarHBondContact O-N 3.34Å; L25-F29 VanDerWaalsContact O-N 3.1Å; L25-L32 HydrophobicContact CD1-CD1 3.66Å; L25-F100 HydrophobicContact CB-CD1 4.21Å; L25-F100 HydrophobicContact CB-CE1 4.31Å; L25-F100 HydrophobicContact CD2-CE1 4.15Å; L25-F100 HydrophobicContact CG-CE1 4.42Å; L25-L142 HydrophobicContact CD2-CB 4.38Å; L25-N144 HydrophobicContact CD1-CB 4.06Å; L25-P182 HydrophobicContact CD1-CG 4.42Å
26	G	93.9	Very high	95.5	Very high	22 Å²	22	35.2 Å²	35.2	23%	0.227	19%	0.188	C	C	.	.	H	α-helix	trans	-44.2	-52	-171.8	0	0	0	0	0	116.5	Y28 F29 F100	G26-Y28 PolarHBondContact O-N 3.33Å; G26-Y28 VanDerWaalsContact O-N 3.1Å; G26-F29 WeakPolarHBondContact O-CB 3.21Å; G26-F29 PolarHBondContact O-N 2.96Å; G26-F29 VanDerWaalsContact O-N 3.1Å; G26-F100 VanDerWaalsContact CA-CG 3.46Å
27	P	93.9	Very high	95.4	Very high	109 Å²	109	35.2 Å²	35.2	71%	0.708	19%	0.188	S	C	*	.	H	α-helix	trans	-59.3	-24.2	-179.2	-26.7	35.7	0	0	0	114.9	A23	A23-P27 VanDerWaalsContact O-CD 3.27Å; A23-P27 WeakPolarHBondContact O-CD 3.29Å
28	Y	95.4	Very high	95.3	Very high	106 Å²	106	37 Å²	37	42%	0.416	20%	0.197	S	C	.	.	H	α-helix	trans	-100.6	-16.5	-179.7	-51.2	-81.7	0	0	0	112.8	L25 G26 E30 S31 L32 N144 P182	L25-Y28 PolarHBondContact O-N 2.88Å; G26-Y28 PolarHBondContact O-N 3.33Å; G26-Y28 VanDerWaalsContact O-N 3.1Å; Y28-E30 PolarHBondContact O-N 2.75Å; Y28-S31 WeakPolarHBondContact O-CB 3.48Å; Y28-S31 PolarHBondContact O-N 3.23Å; Y28-S31 VanDerWaalsContact O-N 3.09Å; Y28-L32 PolarHBondContact O-N 3.35Å; Y28-L32 VanDerWaalsContact O-N 3.09Å; Y28-N144 WeakPolarHBondContact CE2-ND2 3.32Å; Y28-P182 HydrophobicContact CD1-CB 3.68Å; Y28-P182 HydrophobicContact CD1-CG 4.31Å; Y28-P182 HydrophobicContact CD2-CB 4.17Å; Y28-P182 HydrophobicContact CD2-CG 3.91Å; Y28-P182 HydrophobicContact CE1-CB 4.43Å; Y28-P182 HydrophobicContact CG-CB 3.53Å; Y28-P182 HydrophobicContact CG-CG 3.79Å
29	F	96.7	Very high	95.1	Very high	12 Å²	12	37.7 Å²	37.7	5%	0.053	20%	0.202	C	C	.	.	H	α-helix	trans	-59	-42.5	-165.2	-176.2	-109.4	0	0	0	113	I19 L25 G26 S31 L32 R33 I37 I95 I98 F100 L142	I19-F29 HydrophobicContact CD1-CE2 4.29Å; I19-F29 HydrophobicContact CG2-CD2 4.5Å; I19-F29 HydrophobicContact CG2-CE2 3.87Å; L25-F29 HydrophobicContact CD2-CD2 4.09Å; L25-F29 HydrophobicContact CG-CD2 4.4Å; L25-F29 PolarHBondContact O-N 3.34Å; L25-F29 VanDerWaalsContact O-N 3.1Å; G26-F29 WeakPolarHBondContact O-CB 3.21Å; G26-F29 PolarHBondContact O-N 2.96Å; G26-F29 VanDerWaalsContact O-N 3.1Å; F29-S31 VanDerWaalsContact C-N 3.31Å; F29-S31 PolarHBondContact O-N 3.26Å; F29-L32 CarbonylContact O-C 3.6Å; F29-L32 PolarHBondContact O-N 2.65Å; F29-L32 VanDerWaalsContact O-N 3.11Å; F29-R33 HydrophobicContact CE1-CB 4.42Å; F29-R33 WeakPolarHBondContact O-CB 3.14Å; F29-R33 PolarHBondContact O-N 3.02Å; F29-I37 HydrophobicContact CE2-CD1 3.71Å; F29-I37 HydrophobicContact CZ-CD1 4.01Å; F29-I95 HydrophobicContact CE1-CG2 4.23Å; F29-I95 HydrophobicContact CZ-CG2 3.75Å; F29-I98 HydrophobicContact CZ-CD1 4.2Å; F29-F100 HydrophobicContact CB-CE1 4.44Å; F29-F100 HydrophobicContact CB-CE2 4Å; F29-F100 HydrophobicContact CB-CZ 3.95Å; F29-F100 HydrophobicContact CD1-CD2 4.45Å; F29-F100 AromaticContact CD1-CE2 3.35Å; F29-F100 HydrophobicContact CD1-CE2 3.35Å; F29-F100 AromaticContact CD1-CZ 3.46Å; F29-F100 HydrophobicContact CD1-CZ 3.46Å; F29-F100 VanDerWaalsContact CD1-CZ 3.46Å; F29-F100 AromaticContact CD2-CE1 3.97Å; F29-F100 HydrophobicContact CD2-CE1 3.97Å; F29-F100 HydrophobicContact CD2-CE2 4.15Å; F29-F100 AromaticContact CD2-CZ 3.4Å; F29-F100 HydrophobicContact CD2-CZ 3.4Å; F29-F100 VanDerWaalsContact CD2-CZ 3.4Å; F29-F100 AromaticContact CE1-CE2 3.72Å; F29-F100 HydrophobicContact CE1-CE2 3.72Å; F29-F100 AromaticContact CE1-CZ 3.64Å; F29-F100 HydrophobicContact CE1-CZ 3.64Å; F29-F100 HydrophobicContact CE2-CE1 4.34Å; F29-F100 HydrophobicContact CE2-CE2 4.48Å; F29-F100 AromaticContact CE2-CZ 3.61Å; F29-F100 HydrophobicContact CE2-CZ 3.61Å; F29-F100 HydrophobicContact CG-CE1 4.1Å; F29-F100 AromaticContact CG-CE2 3.56Å; F29-F100 HydrophobicContact CG-CE2 3.56Å; F29-F100 AromaticContact CG-CZ 3.3Å; F29-F100 HydrophobicContact CG-CZ 3.3Å; F29-F100 HydrophobicContact CZ-CE2 4.26Å; F29-F100 AromaticContact CZ-CZ 3.7Å; F29-F100 HydrophobicContact CZ-CZ 3.7Å; F29-L142 HydrophobicContact CE2-CD2 4.45Å
30	E	95.9	Very high	95	Very high	111 Å²	111	37.8 Å²	37.8	52%	0.519	20%	0.203	S	C	.	.	H	α-helix	trans	-64.9	-34	-179.4	-176.8	60.9	-177.2	0	0	112.8	Y28 R33 K34	Y28-E30 PolarHBondContact O-N 2.75Å; E30-R33 IonicContact OE1-NH1 3.96Å; E30-R33 PolarHBondContact OE1-NH1 2.87Å; E30-R33 WeakPolarHBondContact OE2-CD 3.4Å; E30-R33 IonicContact OE2-CZ 3.71Å; E30-R33 IonicContact OE2-NE 3.82Å; E30-R33 IonicContact OE2-NH1 2.61Å; E30-R33 PolarHBondContact OE2-NH1 3.2Å; E30-K34 VanDerWaalsContact O-CB 3.31Å; E30-K34 WeakPolarHBondContact O-CB 3.49Å; E30-K34 PolarHBondContact O-N 3.36Å
31	S	95.7	Very high	94.9	Very high	46 Å²	46	37.8 Å²	37.8	32%	0.322	20%	0.203	S	C	.	.	H	α-helix	trans	-68.4	-41.5	172.4	-177.6	0	0	0	0	111.4	Y28 F29 N35 H214	Y28-S31 WeakPolarHBondContact O-CB 3.48Å; Y28-S31 PolarHBondContact O-N 3.23Å; Y28-S31 VanDerWaalsContact O-N 3.09Å; F29-S31 VanDerWaalsContact C-N 3.31Å; F29-S31 PolarHBondContact O-N 3.26Å; S31-N35 VanDerWaalsContact O-CB 3.28Å; S31-N35 WeakPolarHBondContact O-CB 3.41Å; S31-N35 PolarHBondContact O-N 3.12Å; S31-N35 VanDerWaalsContact O-N 3.12Å; S31-N35 PolarHBondContact O-ND2 3.32Å; S31-N35 PolarHBondContact OG-ND2 3.48Å; S31-H214 PolarHBondContact OG-CE1 3.39Å
32	L	96.9	Very high	94.8	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67.8	-40.2	177.2	-60.8	173.5	0	0	0	111.7	L25 Y28 F29 Y36 I37 L142 V180 P182 H214	L25-L32 HydrophobicContact CD1-CD1 3.66Å; Y28-L32 PolarHBondContact O-N 3.35Å; Y28-L32 VanDerWaalsContact O-N 3.09Å; F29-L32 CarbonylContact O-C 3.6Å; F29-L32 PolarHBondContact O-N 2.65Å; F29-L32 VanDerWaalsContact O-N 3.11Å; L32-Y36 HydrophobicContact CB-CD2 4.47Å; L32-Y36 HydrophobicContact CD2-CD2 4.07Å; L32-Y36 HydrophobicContact CD2-CE2 4.02Å; L32-Y36 WeakPolarHBondContact O-CD2 3.34Å; L32-Y36 PolarHBondContact O-N 3.17Å; L32-I37 PolarHBondContact O-N 3.41Å; L32-I37 VanDerWaalsContact O-N 3.14Å; L32-L142 HydrophobicContact CB-CD2 4.24Å; L32-V180 HydrophobicContact CD2-CG1 3.94Å; L32-P182 HydrophobicContact CD1-CB 4.23Å; L32-P182 HydrophobicContact CD1-CG 4.37Å; L32-P182 HydrophobicContact CD2-CB 4.41Å; L32-H214 WeakPolarHBondContact CD2-CE1 3.15Å; L32-H214 WeakPolarHBondContact CD2-ND1 3.39Å
33	R	96.1	Very high	94.8	Very high	37 Å²	37	45.1 Å²	45.1	14%	0.14	23%	0.234	C	C	.	.	I	π-helix	trans	-60	-55.6	177.7	177.1	173.6	164.4	-85.2	-2.4	111.3	F29 E30 N35 I37 L38 D96	F29-R33 HydrophobicContact CE1-CB 4.42Å; F29-R33 WeakPolarHBondContact O-CB 3.14Å; F29-R33 PolarHBondContact O-N 3.02Å; E30-R33 IonicContact OE1-NH1 3.96Å; E30-R33 PolarHBondContact OE1-NH1 2.87Å; E30-R33 WeakPolarHBondContact OE2-CD 3.4Å; E30-R33 IonicContact OE2-CZ 3.71Å; E30-R33 IonicContact OE2-NE 3.82Å; E30-R33 IonicContact OE2-NH1 2.61Å; E30-R33 PolarHBondContact OE2-NH1 3.2Å; R33-N35 PolarHBondContact O-N 2.91Å; R33-I37 HydrophobicContact CB-CD1 3.98Å; R33-I37 HydrophobicContact CG-CD1 4.48Å; R33-I37 PolarHBondContact O-N 2.8Å; R33-L38 HydrophobicContact CG-CD1 4.42Å; R33-L38 HydrophobicContact CG-CG 4.27Å; R33-L38 PolarHBondContact O-N 3.05Å; R33-D96 IonicContact CZ-OD1 3.49Å; R33-D96 IonicContact CZ-OD2 3.64Å; R33-D96 IonicContact NE-OD1 3.23Å; R33-D96 PolarHBondContact NE-OD1 2.65Å; R33-D96 IonicContact NH2-OD1 3.97Å; R33-D96 PolarHBondContact NH2-OD1 2.96Å; R33-D96 IonicContact NH2-OD2 3.73Å; R33-D96 PolarHBondContact NH2-OD2 3.3Å
34	K	95.4	Very high	94.8	Very high	142 Å²	142	43.8 Å²	43.8	62%	0.617	22%	0.22	S	C	*	.	I	π-helix	trans	-62.2	-42.9	179.7	-176.5	178.7	177.8	-177.9	0	113.2	E30 P39	E30-K34 VanDerWaalsContact O-CB 3.31Å; E30-K34 WeakPolarHBondContact O-CB 3.49Å; E30-K34 PolarHBondContact O-N 3.36Å; K34-P39 WeakPolarHBondContact O-CD 3.37Å
35	N	94.9	Very high	94.7	Very high	51 Å²	51	43.9 Å²	43.9	27%	0.273	22%	0.221	S	C	.	.	I	π-helix	trans	-93.1	-20.2	-168.2	-63.1	-47.5	0	0	0	114.5	S31 R33 Q210	S31-N35 VanDerWaalsContact O-CB 3.28Å; S31-N35 WeakPolarHBondContact O-CB 3.41Å; S31-N35 PolarHBondContact O-N 3.12Å; S31-N35 VanDerWaalsContact O-N 3.12Å; S31-N35 PolarHBondContact O-ND2 3.32Å; S31-N35 PolarHBondContact OG-ND2 3.48Å; R33-N35 PolarHBondContact O-N 2.91Å; N35-Q210 HydrophobicContact CB-CB 4.34Å; N35-Q210 HydrophobicContact CB-CG 4.31Å
36	Y	96.2	Very high	94.3	Very high	5 Å²	5	47.5 Å²	47.5	2%	0.02	26%	0.258	C	S	.	.	I	π-helix	trans	-136.3	-38.8	-176.5	-40.2	-76.9	0	0	0	114.4	L32 A40 V180 Y208 Q210 D211 H214 V216 L223	L32-Y36 HydrophobicContact CB-CD2 4.47Å; L32-Y36 HydrophobicContact CD2-CD2 4.07Å; L32-Y36 HydrophobicContact CD2-CE2 4.02Å; L32-Y36 WeakPolarHBondContact O-CD2 3.34Å; L32-Y36 PolarHBondContact O-N 3.17Å; Y36-A40 WeakPolarHBondContact O-CB 3.38Å; Y36-A40 PolarHBondContact O-N 3.15Å; Y36-A40 VanDerWaalsContact O-N 3.13Å; Y36-V180 HydrophobicContact CD2-CG1 4.01Å; Y36-V180 HydrophobicContact CG-CG1 4.2Å; Y36-Y208 WeakPolarHBondContact CE1-O 3.49Å; Y36-Q210 HydrophobicContact CE1-CB 4.39Å; Y36-Q210 HydrophobicContact CE1-CG 4.09Å; Y36-Q210 PolarHBondContact OH-N 3.4Å; Y36-D211 PolarHBondContact OH-N 2.98Å; Y36-H214 AromaticContact CE2-CE1 3.92Å; Y36-H214 AromaticContact CE2-ND1 3.24Å; Y36-H214 WeakPolarHBondContact CE2-ND1 3.49Å; Y36-H214 AromaticContact CZ-ND1 3.63Å; Y36-H214 PolarHBondContact OH-ND1 2.92Å; Y36-V216 HydrophobicContact CD1-CG1 3.98Å; Y36-V216 HydrophobicContact CD1-CG2 3.84Å; Y36-V216 HydrophobicContact CE1-CG1 4.3Å; Y36-V216 HydrophobicContact CE1-CG2 3.53Å; Y36-V216 HydrophobicContact CE2-CG2 4.47Å; Y36-V216 HydrophobicContact CG-CG2 4.42Å; Y36-L223 HydrophobicContact CD1-CD1 4.13Å
37	I	96.4	Very high	93.9	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.005	26%	0.259	C	S	.	.	I	π-helix	trans	-70.9	-54.9	-179.5	-50.4	176.8	0	0	0	110.9	F17 F29 L32 R33 A40 I41 I95 L142	F17-I37 HydrophobicContact CD1-CG2 4.17Å; F17-I37 HydrophobicContact CE1-CB 4.48Å; F17-I37 HydrophobicContact CE1-CG2 3.78Å; F17-I37 HydrophobicContact CZ-CG2 4.34Å; F29-I37 HydrophobicContact CE2-CD1 3.71Å; F29-I37 HydrophobicContact CZ-CD1 4.01Å; L32-I37 PolarHBondContact O-N 3.41Å; L32-I37 VanDerWaalsContact O-N 3.14Å; R33-I37 HydrophobicContact CB-CD1 3.98Å; R33-I37 HydrophobicContact CG-CD1 4.48Å; R33-I37 PolarHBondContact O-N 2.8Å; I37-A40 WeakPolarHBondContact O-CB 3.47Å; I37-A40 PolarHBondContact O-N 3.2Å; I37-A40 VanDerWaalsContact O-N 3.16Å; I37-I41 HydrophobicContact CG2-CD1 3.83Å; I37-I41 HydrophobicContact CG2-CG1 4.48Å; I37-I41 WeakPolarHBondContact O-CG1 3.41Å; I37-I41 PolarHBondContact O-N 3.11Å; I37-I95 HydrophobicContact CG2-CD1 3.94Å; I37-L142 HydrophobicContact CD1-CD2 3.37Å; I37-L142 HydrophobicContact CG1-CD1 4.47Å; I37-L142 HydrophobicContact CG1-CD2 3.63Å
38	L	95.5	Very high	93.5	Very high	37 Å²	37	47 Å²	47	19%	0.194	26%	0.255	C	S	.	.	H	α-helix	trans	-61.5	-45.5	-178.4	-64.6	176.3	0	0	0	111.6	R33 A40 I41 E42 V92	R33-L38 HydrophobicContact CG-CD1 4.42Å; R33-L38 HydrophobicContact CG-CG 4.27Å; R33-L38 PolarHBondContact O-N 3.05Å; L38-A40 VanDerWaalsContact C-N 3.29Å; L38-A40 PolarHBondContact O-N 2.71Å; L38-I41 PolarHBondContact O-N 3.01Å; L38-I41 VanDerWaalsContact O-N 3.12Å; L38-E42 WeakPolarHBondContact O-CG 3.5Å; L38-E42 PolarHBondContact O-N 2.55Å; L38-V92 HydrophobicContact CD2-CG1 4.11Å; L38-V92 HydrophobicContact CD2-CG2 3.77Å
39	P	95	Very high	93	Very high	16 Å²	16	43.5 Å²	43.5	10%	0.104	25%	0.246	C	C	.	.	H	α-helix	trans	-65.4	-26.8	175	-22.9	35.3	0	0	0	114.4	K34 Y43 L223 P224	K34-P39 WeakPolarHBondContact O-CD 3.37Å; P39-Y43 WeakPolarHBondContact O-CB 3.38Å; P39-Y43 PolarHBondContact O-N 2.82Å; P39-Y43 VanDerWaalsContact O-N 3.08Å; P39-L223 HydrophobicContact CB-CD2 4.24Å; P39-P224 VanDerWaalsContact CB-CD 3.5Å; P39-P224 HydrophobicContact CB-CG 3.93Å; P39-P224 HydrophobicContact CG-CG 4.45Å
40	A	95.4	Very high	92.1	Very high	2 Å²	2	44.5 Å²	44.5	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-69.4	-42.2	170.8	0	0	0	0	0	111.7	F17 Y36 I37 L38 Y43 F44 I221 L223	F17-A40 HydrophobicContact CE1-CB 4.43Å; F17-A40 HydrophobicContact CZ-CB 3.92Å; Y36-A40 WeakPolarHBondContact O-CB 3.38Å; Y36-A40 PolarHBondContact O-N 3.15Å; Y36-A40 VanDerWaalsContact O-N 3.13Å; I37-A40 WeakPolarHBondContact O-CB 3.47Å; I37-A40 PolarHBondContact O-N 3.2Å; I37-A40 VanDerWaalsContact O-N 3.16Å; L38-A40 VanDerWaalsContact C-N 3.29Å; L38-A40 PolarHBondContact O-N 2.71Å; A40-Y43 WeakPolarHBondContact O-CB 3.21Å; A40-Y43 PolarHBondContact O-N 2.93Å; A40-F44 WeakPolarHBondContact O-CD2 3.26Å; A40-F44 PolarHBondContact O-N 3.31Å; A40-I221 HydrophobicContact CB-CD1 4.38Å; A40-I221 HydrophobicContact CB-CG2 4.05Å; A40-L223 HydrophobicContact CB-CD2 3.89Å
41	I	94.4	Very high	90.8	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-65.2	-45.8	176.2	-64	166.1	0	0	0	109.9	F17 I37 L38 Y43 F44 N45 P49 Y63 A88 F91 V92 I95	F17-I41 HydrophobicContact CE2-CG1 4.3Å; F17-I41 HydrophobicContact CZ-CG1 4.17Å; I37-I41 HydrophobicContact CG2-CD1 3.83Å; I37-I41 HydrophobicContact CG2-CG1 4.48Å; I37-I41 WeakPolarHBondContact O-CG1 3.41Å; I37-I41 PolarHBondContact O-N 3.11Å; L38-I41 PolarHBondContact O-N 3.01Å; L38-I41 VanDerWaalsContact O-N 3.12Å; I41-Y43 VanDerWaalsContact C-N 3.29Å; I41-Y43 PolarHBondContact O-N 3.24Å; I41-F44 PolarHBondContact O-N 2.87Å; I41-F44 VanDerWaalsContact O-N 3.07Å; I41-N45 VanDerWaalsContact O-CB 3.28Å; I41-N45 WeakPolarHBondContact O-CB 3.33Å; I41-N45 PolarHBondContact O-N 3.45Å; I41-P49 HydrophobicContact CG2-CG 3.75Å; I41-Y63 HydrophobicContact CG2-CE1 4.2Å; I41-A88 HydrophobicContact CG2-CB 3.8Å; I41-F91 HydrophobicContact CD1-CD1 3.71Å; I41-F91 HydrophobicContact CD1-CE1 3.77Å; I41-F91 HydrophobicContact CG1-CD1 4.07Å; I41-F91 HydrophobicContact CG1-CE1 3.99Å; I41-V92 HydrophobicContact CD1-CG2 3.75Å; I41-V92 HydrophobicContact CG2-CG2 4.48Å; I41-I95 HydrophobicContact CD1-CD1 3.73Å
42	E	92.3	Very high	89.4	Confident	79 Å²	79	49.3 Å²	49.3	37%	0.369	28%	0.28	S	S	.	.	H	α-helix	trans	-54.4	-43.7	174.7	-74.7	174.5	-169.9	0	0	112.4	L38 F44 N45 G46 G47	L38-E42 WeakPolarHBondContact O-CG 3.5Å; L38-E42 PolarHBondContact O-N 2.55Å; E42-F44 VanDerWaalsContact C-N 3.34Å; E42-F44 PolarHBondContact O-N 3.33Å; E42-N45 PolarHBondContact O-N 3.14Å; E42-G46 PolarHBondContact O-N 2.99Å; E42-G47 PolarHBondContact O-N 3.46Å; E42-G47 VanDerWaalsContact O-N 3.13Å
43	Y	92.2	Very high	87.9	Confident	76 Å²	76	51.1 Å²	51.1	30%	0.298	29%	0.29	S	S	.	.	H	α-helix	trans	-59.5	-38.9	175.9	168.5	-101.1	0	0	0	113.2	P7 P39 A40 I41 I221	P7-Y43 WeakPolarHBondContact CG-OH 3.34Å; P39-Y43 WeakPolarHBondContact O-CB 3.38Å; P39-Y43 PolarHBondContact O-N 2.82Å; P39-Y43 VanDerWaalsContact O-N 3.08Å; A40-Y43 WeakPolarHBondContact O-CB 3.21Å; A40-Y43 PolarHBondContact O-N 2.93Å; I41-Y43 VanDerWaalsContact C-N 3.29Å; I41-Y43 PolarHBondContact O-N 3.24Å; Y43-I221 HydrophobicContact CD1-CG2 3.88Å; Y43-I221 HydrophobicContact CE1-CG2 4.37Å; Y43-I221 HydrophobicContact CG-CG2 4.4Å
44	F	91.4	Very high	85.9	Confident	17 Å²	17	56.8 Å²	56.8	8%	0.075	32%	0.316	C	S	.	.	H	α-helix	trans	-86.9	-19	178.5	-66.4	-64	0	0	0	114.8	A13 V15 A40 I41 E42 T61 Y63 H136 V138 G220 I221	A13-F44 HydrophobicContact CB-CD1 4Å; A13-F44 HydrophobicContact CB-CE1 4.36Å; V15-F44 HydrophobicContact CB-CD2 4.4Å; V15-F44 HydrophobicContact CB-CE2 4.41Å; V15-F44 HydrophobicContact CG1-CD2 3.91Å; V15-F44 HydrophobicContact CG1-CE2 3.64Å; V15-F44 HydrophobicContact CG1-CZ 4.26Å; V15-F44 HydrophobicContact CG2-CB 4.38Å; V15-F44 HydrophobicContact CG2-CD1 3.82Å; V15-F44 HydrophobicContact CG2-CD2 3.7Å; V15-F44 HydrophobicContact CG2-CE1 3.91Å; V15-F44 HydrophobicContact CG2-CE2 3.81Å; V15-F44 HydrophobicContact CG2-CG 3.72Å; V15-F44 HydrophobicContact CG2-CZ 3.91Å; A40-F44 WeakPolarHBondContact O-CD2 3.26Å; A40-F44 PolarHBondContact O-N 3.31Å; I41-F44 PolarHBondContact O-N 2.87Å; I41-F44 VanDerWaalsContact O-N 3.07Å; E42-F44 VanDerWaalsContact C-N 3.34Å; E42-F44 PolarHBondContact O-N 3.33Å; F44-T61 HydrophobicContact CB-CG2 4.07Å; F44-T61 PolarHBondContact O-OG1 3.34Å; F44-Y63 HydrophobicContact CB-CE1 4.06Å; F44-H136 AromaticContact CE1-CE1 3.89Å; F44-H136 AromaticContact CE1-ND1 3.86Å; F44-V138 HydrophobicContact CE1-CG2 4.04Å; F44-V138 HydrophobicContact CZ-CB 3.92Å; F44-V138 HydrophobicContact CZ-CG1 4.1Å; F44-V138 HydrophobicContact CZ-CG2 3.74Å; F44-G220 WeakPolarHBondContact CZ-O 3.49Å; F44-I221 HydrophobicContact CE2-CD1 4.36Å; F44-I221 HydrophobicContact CE2-CG1 4.11Å; F44-I221 HydrophobicContact CZ-CG1 3.92Å
45	N	90.1	Very high	84	Confident	52 Å²	52	51.9 Å²	51.9	28%	0.278	31%	0.306	S	S	.	.	H	α-helix	trans	-88.6	-21.2	176.2	-157.3	50.6	0	0	0	112.1	I41 E42 G47 D53 Y63 A88	I41-N45 VanDerWaalsContact O-CB 3.28Å; I41-N45 WeakPolarHBondContact O-CB 3.33Å; I41-N45 PolarHBondContact O-N 3.45Å; E42-N45 PolarHBondContact O-N 3.14Å; N45-G47 VanDerWaalsContact C-N 3.31Å; N45-G47 WeakPolarHBondContact CB-O 3.37Å; N45-G47 PolarHBondContact ND2-O 3.48Å; N45-D53 PolarHBondContact ND2-OD2 3.31Å; N45-Y63 PolarHBondContact N-OH 3.4Å; N45-A88 HydrophobicContact CB-CB 4.08Å; N45-A88 VanDerWaalsContact CG-CB 3.45Å; N45-A88 VanDerWaalsContact OD1-CB 3.25Å; N45-A88 WeakPolarHBondContact OD1-CB 3.33Å
46	G	86.6	Confident	82.1	Confident	77 Å²	77	51.4 Å²	51.4	79%	0.794	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	9	-172.3	0	0	0	0	0	114	E42	E42-G46 PolarHBondContact O-N 2.99Å
47	G	85.1	Confident	80	Confident	23 Å²	23	57.8 Å²	57.8	24%	0.237	35%	0.348	C	S	.	.	S	Bend	trans	169.5	175	-176.2	0	0	0	0	0	113.4	E42 N45	E42-G47 PolarHBondContact O-N 3.46Å; E42-G47 VanDerWaalsContact O-N 3.13Å; N45-G47 VanDerWaalsContact C-N 3.31Å; N45-G47 WeakPolarHBondContact CB-O 3.37Å; N45-G47 PolarHBondContact ND2-O 3.48Å
48	P	85.1	Confident	78.1	Confident	98 Å²	98	63.8 Å²	63.8	64%	0.636	37%	0.371	S	S	*	.	S	Bend	trans	-57.4	132.5	178.3	24.8	-34.6	0	0	0	111.8	A50	P48-A50 PolarHBondContact O-N 2.68Å
49	P	85.3	Confident	76.4	Confident	32 Å²	32	63.6 Å²	63.6	21%	0.208	38%	0.378	C	S	.	.			trans	-58.7	127	176.8	-26.9	36.3	0	0	0	112.7	I41 D53 A88 F89 V92	I41-P49 HydrophobicContact CG2-CG 3.75Å; P49-D53 WeakPolarHBondContact CA-OD2 3.1Å; P49-A88 HydrophobicContact CB-CB 3.96Å; P49-A88 HydrophobicContact CG-CB 4.02Å; P49-F89 HydrophobicContact CB-CB 4.46Å; P49-V92 HydrophobicContact CB-CG2 4.37Å; P49-V92 HydrophobicContact CG-CG2 4.14Å
50	A	78.1	Confident	75.7	Confident	33 Å²	33	64.4 Å²	64.4	27%	0.273	39%	0.389	S	S	.	.			trans	-120.8	153	-175.4	0	0	0	0	0	112.9	P48 T52 D53 F89	P48-A50 PolarHBondContact O-N 2.68Å; A50-T52 WeakPolarHBondContact CB-OG1 3.38Å; A50-T52 PolarHBondContact O-N 3.4Å; A50-D53 PolarHBondContact N-OD2 2.89Å; A50-D53 VanDerWaalsContact O-CB 3.26Å; A50-D53 WeakPolarHBondContact O-CB 3.26Å; A50-D53 PolarHBondContact O-N 3.46Å; A50-F89 WeakPolarHBondContact O-CB 3.33Å
51	E	68.9	Low	75.4	Confident	153 Å²	153	65.6 Å²	65.6	72%	0.715	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-16.7	172.3	-73.6	-168	171.1	0	0	113.1	F89	E51-F89 HydrophobicContact CG-CD1 4.36Å; E51-F89 HydrophobicContact CG-CD2 4.15Å; E51-F89 HydrophobicContact CG-CE1 3.84Å; E51-F89 HydrophobicContact CG-CE2 3.6Å; E51-F89 HydrophobicContact CG-CZ 3.43Å; E51-F89 VanDerWaalsContact CG-CZ 3.43Å
52	T	66.1	Low	75.3	Confident	104 Å²	104	65.9 Å²	65.9	64%	0.638	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.3	173.3	50.5	0	0	0	0	114.2	A50 F54	A50-T52 WeakPolarHBondContact CB-OG1 3.38Å; A50-T52 PolarHBondContact O-N 3.4Å; T52-F54 WeakPolarHBondContact O-CD2 3.13Å; T52-F54 PolarHBondContact O-N 3.19Å
53	D	64.6	Low	75.4	Confident	39 Å²	39	62.1 Å²	62.1	21%	0.209	38%	0.38	C	S	.	.			trans	-76.6	63.9	175.3	-64.6	-6.7	0	0	0	109.8	N45 P49 A50 G55 S87	N45-D53 PolarHBondContact ND2-OD2 3.31Å; P49-D53 WeakPolarHBondContact CA-OD2 3.1Å; A50-D53 PolarHBondContact N-OD2 2.89Å; A50-D53 VanDerWaalsContact O-CB 3.26Å; A50-D53 WeakPolarHBondContact O-CB 3.26Å; A50-D53 PolarHBondContact O-N 3.46Å; D53-G55 PolarHBondContact O-N 3.24Å; D53-S87 WeakPolarHBondContact O-CB 3.31Å; D53-S87 PolarHBondContact O-OG 2.98Å
54	F	55.3	Low	75.7	Confident	156 Å²	156	58.5 Å²	58.5	68%	0.684	37%	0.366	S	S	*	.			trans	-64.1	104.4	170.8	-61.8	-73.2	0	0	0	108	T52 G56	T52-F54 WeakPolarHBondContact O-CD2 3.13Å; T52-F54 PolarHBondContact O-N 3.19Å; F54-G56 PolarHBondContact O-N 3.08Å
55	G	55.4	Low	76	Confident	39 Å²	39	57.7 Å²	57.7	40%	0.402	36%	0.363	S	S	.	.			trans	-52.3	114.2	-174.3	0	0	0	0	0	111.6	D53 S86	D53-G55 PolarHBondContact O-N 3.24Å; G55-S86 VanDerWaalsContact C-OG 3.26Å; G55-S86 WeakPolarHBondContact CA-OG 3.47Å
56	G	53.9	Low	76.3	Confident	41 Å²	41	55.2 Å²	55.2	42%	0.423	35%	0.349	S	S	.	.			trans	-68.9	177.6	-178.2	0	0	0	0	0	113.3	F54 S86	F54-G56 PolarHBondContact O-N 3.08Å; G56-S86 PolarHBondContact O-OG 3.01Å
57	D	53.5	Low	76.8	Confident	139 Å²	139	51.9 Å²	51.9	74%	0.743	31%	0.313	S	S	*	.	S	Bend	trans	-55.9	161.5	167	55	-65.2	0	0	0	112	G59 G60	D57-G59 PolarHBondContact O-N 2.83Å; D57-G60 PolarHBondContact O-N 3.38Å
58	Y	55.3	Low	77.3	Confident	126 Å²	126	50.8 Å²	50.8	49%	0.494	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-3	-159.3	-61	-78.1	0	0	0	116.8	M128 R129 I132	Y58-M128 HydrophobicContact CD1-CB 4.33Å; Y58-M128 HydrophobicContact CE1-CB 4.38Å; Y58-M128 HydrophobicContact CE1-CG 4.47Å; Y58-M128 HydrophobicContact CE1-SD 3.92Å; Y58-R129 PolarHBondContact O-NE 3.23Å; Y58-I132 VanDerWaalsContact C-CD1 3.49Å
59	G	60.9	Low	77.6	Confident	33 Å²	33	46.4 Å²	46.4	34%	0.34	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-16	169.8	0	0	0	0	0	115	V12 D57	V12-G59 WeakPolarHBondContact CG1-O 3.49Å; V12-G59 VanDerWaalsContact CG2-O 3.22Å; V12-G59 WeakPolarHBondContact CG2-O 3.33Å; D57-G59 PolarHBondContact O-N 2.83Å
60	G	79.8	Confident	77.9	Confident	33 Å²	33	44.9 Å²	44.9	34%	0.34	26%	0.264	S	S	.	.	S	Bend	trans	-75.6	162.4	167.2	0	0	0	0	0	112.3	D57 R129	D57-G60 PolarHBondContact O-N 3.38Å; G60-R129 PolarHBondContact O-NH2 2.82Å
61	T	89.6	Confident	78.1	Confident	27 Å²	27	44.1 Å²	44.1	17%	0.166	26%	0.255	C	S	.	.			trans	-48.1	143.7	171.4	-67.7	0	0	0	0	111.4	A13 V15 F44 Y63 S86	A13-T61 HydrophobicContact CB-CG2 4.2Å; V15-T61 HydrophobicContact CG2-CG2 4.22Å; F44-T61 HydrophobicContact CB-CG2 4.07Å; F44-T61 PolarHBondContact O-OG1 3.34Å; T61-Y63 HydrophobicContact CG2-CD1 4.3Å; T61-Y63 HydrophobicContact CG2-CD2 4.2Å; T61-Y63 HydrophobicContact CG2-CE1 3.8Å; T61-Y63 HydrophobicContact CG2-CE2 3.69Å; T61-Y63 HydrophobicContact CG2-CG 4.48Å; T61-Y63 VanDerWaalsContact CG2-CZ 3.47Å; T61-S86 WeakPolarHBondContact O-CA 3.44Å; T61-S86 WeakPolarHBondContact O-CB 3.22Å
62	Q	92.2	Very high	78.4	Confident	7 Å²	7	38.6 Å²	38.6	3%	0.033	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.5	174.2	-70	-72.2	-49.1	0	0	110.4	A13 V15 S86 F125 R129	A13-Q62 PolarHBondContact O-N 3.18Å; V15-Q62 PolarHBondContact N-O 2.95Å; Q62-S86 VanDerWaalsContact NE2-CB 3.25Å; Q62-S86 PolarHBondContact NE2-OG 2.97Å; Q62-F125 HydrophobicContact CB-CD1 4Å; Q62-F125 HydrophobicContact CB-CE1 3.47Å; Q62-F125 VanDerWaalsContact CB-CE1 3.47Å; Q62-F125 HydrophobicContact CB-CZ 4.07Å; Q62-F125 HydrophobicContact CG-CD1 4.49Å; Q62-F125 HydrophobicContact CG-CE1 4.26Å; Q62-R129 VanDerWaalsContact CG-NH2 3.32Å
63	Y	94.9	Very high	78.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.8	-179.5	-55.7	-85.4	0	0	0	111	V15 I41 F44 N45 T61 P84 T85 A88 F91	V15-Y63 HydrophobicContact CB-CD1 4.19Å; V15-Y63 CarbonylContact O-C 3.49Å; V15-Y63 WeakPolarHBondContact O-CA 3.16Å; I41-Y63 HydrophobicContact CG2-CE1 4.2Å; F44-Y63 HydrophobicContact CB-CE1 4.06Å; N45-Y63 PolarHBondContact N-OH 3.4Å; T61-Y63 HydrophobicContact CG2-CD1 4.3Å; T61-Y63 HydrophobicContact CG2-CD2 4.2Å; T61-Y63 HydrophobicContact CG2-CE1 3.8Å; T61-Y63 HydrophobicContact CG2-CE2 3.69Å; T61-Y63 HydrophobicContact CG2-CG 4.48Å; T61-Y63 VanDerWaalsContact CG2-CZ 3.47Å; Y63-P84 VanDerWaalsContact O-CA 3.24Å; Y63-P84 WeakPolarHBondContact O-CA 3.34Å; Y63-T85 PolarHBondContact N-O 3.12Å; Y63-T85 PolarHBondContact O-N 3.44Å; Y63-A88 HydrophobicContact CE2-CB 3.85Å; Y63-F91 VanDerWaalsContact CB-CD2 3.45Å; Y63-F91 VanDerWaalsContact CB-CG 3.5Å; Y63-F91 AromaticContact CD1-CD1 3.83Å; Y63-F91 HydrophobicContact CD1-CD1 3.83Å; Y63-F91 AromaticContact CD1-CE1 3.97Å; Y63-F91 HydrophobicContact CD1-CE1 3.97Å; Y63-F91 HydrophobicContact CD1-CG 4.32Å; Y63-F91 HydrophobicContact CD2-CB 4.47Å; Y63-F91 HydrophobicContact CG-CB 4.27Å; Y63-F91 AromaticContact CG-CD1 3.91Å; Y63-F91 HydrophobicContact CG-CD1 3.91Å; Y63-F91 HydrophobicContact CG-CD2 4.37Å; Y63-F91 HydrophobicContact CG-CE1 4.35Å; Y63-F91 AromaticContact CG-CG 3.93Å; Y63-F91 HydrophobicContact CG-CG 3.93Å
64	G	96.5	Very high	78.1	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	136.7	173.2	0	0	0	0	0	111.6	V15 V16 F17	V15-G64 PolarHBondContact O-N 3.15Å; V16-G64 WeakPolarHBondContact CA-O 3.33Å; F17-G64 PolarHBondContact N-O 3.15Å
65	L	98.1	Very high	78.3	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	125.7	176.7	-178.9	62.3	0	0	0	110.3	F17 I19 V67 H82 F91 W94 I95 I98	F17-L65 HydrophobicContact CB-CD1 4.35Å; I19-L65 HydrophobicContact CD1-CD1 3.72Å; I19-L65 HydrophobicContact CG1-CD1 4Å; L65-V67 HydrophobicContact CD1-CG2 4.23Å; L65-V67 HydrophobicContact CD2-CG2 4.12Å; L65-V67 HydrophobicContact CG-CG2 3.99Å; L65-H82 HydrophobicContact CB-CB 4.16Å; L65-H82 PolarHBondContact O-N 3.41Å; L65-F91 HydrophobicContact CB-CD2 4.47Å; L65-F91 HydrophobicContact CB-CE2 3.77Å; L65-W94 HydrophobicContact CB-CE3 4.3Å; L65-W94 HydrophobicContact CD2-CB 3.7Å; L65-I95 HydrophobicContact CD1-CG1 4.33Å; L65-I95 HydrophobicContact CD2-CG1 4.33Å; L65-I98 HydrophobicContact CD1-CD1 4.42Å; L65-I98 HydrophobicContact CD2-CD1 4.28Å; L65-I98 HydrophobicContact CD2-CG1 4.48Å
66	V	97.8	Very high	78.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	121	170.3	-174.7	0	0	0	0	107.8	V16 F17 V18 I19 V79 V117 A118 L121	V16-V66 HydrophobicContact CG1-CG2 3.95Å; F17-V66 PolarHBondContact O-N 3.04Å; V18-V66 CarbonylContact C-O 3.49Å; V18-V66 WeakPolarHBondContact CA-O 3.47Å; V18-V66 HydrophobicContact CG1-CB 4.44Å; V18-V66 HydrophobicContact CG1-CG1 4.46Å; V18-V66 HydrophobicContact CG2-CB 4.42Å; I19-V66 PolarHBondContact N-O 2.82Å; V66-V79 HydrophobicContact CG1-CG1 3.36Å; V66-V117 HydrophobicContact CG1-CB 4.14Å; V66-V117 HydrophobicContact CG1-CG1 4.08Å; V66-V117 HydrophobicContact CG2-CG1 4.07Å; V66-A118 HydrophobicContact CG2-CB 4.37Å; V66-L121 HydrophobicContact CG2-CD1 3.64Å
67	V	96.4	Very high	79.9	Confident	7 Å²	7	34.7 Å²	34.7	4%	0.042	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	127.4	174.1	-175.5	0	0	0	0	108.1	I19 L65 V79 Q80 I98	I19-V67 CarbonylContact O-C 3.53Å; I19-V67 VanDerWaalsContact O-CA 3.29Å; I19-V67 WeakPolarHBondContact O-CA 3.08Å; L65-V67 HydrophobicContact CD1-CG2 4.23Å; L65-V67 HydrophobicContact CD2-CG2 4.12Å; L65-V67 HydrophobicContact CG-CG2 3.99Å; V67-V79 CarbonylContact O-C 3.53Å; V67-V79 WeakPolarHBondContact O-CA 3.19Å; V67-Q80 HydrophobicContact CB-CB 4.37Å; V67-Q80 PolarHBondContact N-O 3.16Å; V67-Q80 PolarHBondContact O-N 2.97Å; V67-I98 HydrophobicContact CG1-CG2 4.07Å; V67-I98 HydrophobicContact CG2-CD1 3.86Å; V67-I98 HydrophobicContact CG2-CG1 3.97Å
68	F	95.1	Very high	81.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	147.1	-175.1	73.4	-83.4	0	0	0	112.6	V18 I19 E20 G21 Y78 V79 S109 L110 I111 L141 C143	V18-F68 HydrophobicContact CG1-CD1 3.68Å; V18-F68 HydrophobicContact CG1-CE1 3.79Å; I19-F68 VanDerWaalsContact O-CD1 3.23Å; I19-F68 WeakPolarHBondContact O-CD1 3.48Å; I19-F68 PolarHBondContact O-N 3.39Å; E20-F68 CarbonylContact C-O 3.54Å; E20-F68 WeakPolarHBondContact CA-O 3.23Å; E20-F68 HydrophobicContact CB-CE1 4.17Å; E20-F68 HydrophobicContact CB-CE2 4.23Å; E20-F68 HydrophobicContact CB-CZ 3.81Å; E20-F68 HydrophobicContact CG-CE2 4.36Å; E20-F68 HydrophobicContact CG-CZ 4.41Å; G21-F68 PolarHBondContact N-O 2.87Å; F68-Y78 CarbonylContact C-O 3.51Å; F68-Y78 VanDerWaalsContact CA-O 3.32Å; F68-Y78 WeakPolarHBondContact CA-O 3.44Å; F68-V79 HydrophobicContact CB-CG2 4.09Å; F68-S109 WeakPolarHBondContact CE2-OG 3.47Å; F68-L110 VanDerWaalsContact CD2-C 3.44Å; F68-L110 WeakPolarHBondContact CD2-O 3.36Å; F68-I111 HydrophobicContact CE2-CB 4.22Å; F68-I111 HydrophobicContact CE2-CG1 3.48Å; F68-I111 VanDerWaalsContact CE2-CG1 3.48Å; F68-I111 HydrophobicContact CZ-CG1 3.69Å; F68-L141 HydrophobicContact CE1-CD1 3.8Å; F68-L141 HydrophobicContact CZ-CD1 3.87Å; F68-C143 HydrophobicContact CZ-CB 4.1Å
69	N	92.8	Very high	83	Confident	5 Å²	5	23 Å²	23	3%	0.027	15%	0.153	C	C	.	.			trans	-115.8	-159.7	-166.3	-68.3	-34.3	0	0	0	112.5	G21 C73 S77 Y78 L110	G21-N69 WeakPolarHBondContact CA-OD1 3.4Å; N69-C73 HydrophobicContact CB-CB 3.82Å; N69-S77 PolarHBondContact ND2-O 2.75Å; N69-Y78 PolarHBondContact N-O 3.23Å; N69-L110 WeakPolarHBondContact O-CB 3.35Å; N69-L110 PolarHBondContact O-N 2.61Å
70	T	89.8	Confident	84.4	Confident	1 Å²	1	25.2 Å²	25.2	1%	0.006	16%	0.155	C	C	.	.			trans	-107	177.7	164.4	93.7	0	0	0	0	109.9	T22 D72 C73 Y78 G103 E106 C108	T22-T70 HydrophobicContact CG2-CG2 3.57Å; T70-D72 PolarHBondContact O-N 2.85Å; T70-D72 VanDerWaalsContact O-N 3.15Å; T70-D72 VanDerWaalsContact OG1-CG 3.3Å; T70-D72 PolarHBondContact OG1-N 2.85Å; T70-D72 VanDerWaalsContact OG1-N 3.17Å; T70-D72 PolarHBondContact OG1-OD1 2.87Å; T70-C73 PolarHBondContact O-SG 3.28Å; T70-C73 VanDerWaalsContact O-SG 3.4Å; T70-Y78 VanDerWaalsContact O-CD1 3.3Å; T70-Y78 WeakPolarHBondContact O-CD1 3.41Å; T70-G103 VanDerWaalsContact CG2-CA 3.45Å; T70-E106 HydrophobicContact CG2-CB 4.24Å; T70-C108 WeakPolarHBondContact CG2-O 3.36Å
71	V	82.3	Confident	85	Confident	17 Å²	17	26.7 Å²	26.7	10%	0.103	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.7	177.4	-64.7	0	0	0	0	115.1	Y78 L110 Y148 L650 L654	V71-Y78 VanDerWaalsContact CA-CE1 3.49Å; V71-Y78 HydrophobicContact CB-CE1 4.45Å; V71-Y78 WeakPolarHBondContact O-CE1 3.25Å; V71-Y78 PolarHBondContact O-OH 3.35Å; V71-L110 HydrophobicContact CG1-CD1 4.11Å; V71-L110 HydrophobicContact CG1-CD2 4Å; V71-L110 HydrophobicContact CG1-CG 4.39Å; V71-Y148 HydrophobicContact CG1-CE2 4.43Å; V71-L650 HydrophobicContact CG1-CB 4.44Å; V71-L654 HydrophobicContact CB-CD1 3.87Å; V71-L654 HydrophobicContact CG1-CD1 3.55Å; V71-L654 HydrophobicContact CG2-CD1 3.34Å
72	D	76.6	Confident	85	Confident	36 Å²	36	27.6 Å²	27.6	19%	0.193	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-9	-174.1	81.8	-16.6	0	0	0	115.1	T70 A74 G103 E106	T70-D72 PolarHBondContact O-N 2.85Å; T70-D72 VanDerWaalsContact O-N 3.15Å; T70-D72 VanDerWaalsContact OG1-CG 3.3Å; T70-D72 PolarHBondContact OG1-N 2.85Å; T70-D72 VanDerWaalsContact OG1-N 3.17Å; T70-D72 PolarHBondContact OG1-OD1 2.87Å; D72-A74 PolarHBondContact O-N 3.01Å; D72-G103 VanDerWaalsContact OD1-CA 3.27Å; D72-G103 WeakPolarHBondContact OD1-CA 3.49Å; D72-G103 PolarHBondContact OD1-N 2.98Å; D72-G103 PolarHBondContact OD2-N 2.66Å; D72-E106 HydrophobicContact CB-CG 4.24Å
73	C	69.5	Low	84.7	Confident	14 Å²	14	29.4 Å²	29.4	10%	0.095	18%	0.177	C	C	.	.			trans	-70.6	10.6	-165.4	69.1	0	0	0	0	116.9	N69 T70 E76 Y78	N69-C73 HydrophobicContact CB-CB 3.82Å; T70-C73 PolarHBondContact O-SG 3.28Å; T70-C73 VanDerWaalsContact O-SG 3.4Å; C73-E76 WeakPolarHBondContact O-CB 3.36Å; C73-E76 PolarHBondContact O-N 2.85Å; C73-E76 PolarHBondContact SG-O 3.42Å; C73-E76 VanDerWaalsContact SG-O 3.35Å; C73-Y78 WeakPolarHBondContact SG-CD1 3.48Å
74	A	54.9	Low	84.5	Confident	22 Å²	22	31.2 Å²	31.2	18%	0.182	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	136.9	-177.6	0	0	0	0	0	111.7	D72	D72-A74 PolarHBondContact O-N 3.01Å
75	P	59.5	Low	84.2	Confident	128 Å²	128	32 Å²	32	83%	0.831	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	cis	-90.5	10	16.8	37.6	-38.2	0	0	0	115.5
76	E	64.3	Low	83.8	Confident	75 Å²	75	33.1 Å²	33.1	35%	0.35	20%	0.202	S	C	.	.	S	Bend	trans	-79.5	155.4	-179.1	-56.4	-171.7	-161.5	0	0	112.8	C73 Q80 M101	C73-E76 WeakPolarHBondContact O-CB 3.36Å; C73-E76 PolarHBondContact O-N 2.85Å; C73-E76 PolarHBondContact SG-O 3.42Å; C73-E76 VanDerWaalsContact SG-O 3.35Å; E76-Q80 PolarHBondContact OE2-NE2 2.99Å; E76-M101 VanDerWaalsContact OE1-CE 3.29Å; E76-M101 WeakPolarHBondContact OE1-CE 3.19Å
77	S	77.7	Confident	83.4	Confident	58 Å²	58	33.9 Å²	33.9	41%	0.406	21%	0.207	S	C	.	.			trans	-63.3	147.1	175.1	-167.4	0	0	0	0	111.6	N69 V79	N69-S77 PolarHBondContact ND2-O 2.75Å; S77-V79 VanDerWaalsContact C-N 3.26Å; S77-V79 VanDerWaalsContact CB-O 3.28Å; S77-V79 WeakPolarHBondContact CB-O 3.38Å; S77-V79 PolarHBondContact O-N 2.91Å; S77-V79 PolarHBondContact OG-O 3.13Å
78	Y	84.6	Confident	83.1	Confident	8 Å²	8	33.5 Å²	33.5	3%	0.031	21%	0.205	C	C	.	.	S	Bend	trans	-67.1	-31.8	174.5	-64	-46.9	0	0	0	112.5	F68 N69 T70 V71 C73 L110 E154 A646 N647 L650	F68-Y78 CarbonylContact C-O 3.51Å; F68-Y78 VanDerWaalsContact CA-O 3.32Å; F68-Y78 WeakPolarHBondContact CA-O 3.44Å; N69-Y78 PolarHBondContact N-O 3.23Å; T70-Y78 VanDerWaalsContact O-CD1 3.3Å; T70-Y78 WeakPolarHBondContact O-CD1 3.41Å; V71-Y78 VanDerWaalsContact CA-CE1 3.49Å; V71-Y78 HydrophobicContact CB-CE1 4.45Å; V71-Y78 WeakPolarHBondContact O-CE1 3.25Å; V71-Y78 PolarHBondContact O-OH 3.35Å; C73-Y78 WeakPolarHBondContact SG-CD1 3.48Å; Y78-L110 HydrophobicContact CD1-CD1 3.52Å; Y78-L110 HydrophobicContact CD2-CD1 4.34Å; Y78-L110 HydrophobicContact CE1-CD1 4.28Å; Y78-L110 HydrophobicContact CG-CD1 3.58Å; Y78-E154 WeakPolarHBondContact CD2-OE1 3.3Å; Y78-A646 VanDerWaalsContact OH-CA 3.31Å; Y78-A646 WeakPolarHBondContact OH-CA 3.05Å; Y78-A646 VanDerWaalsContact OH-CB 3.3Å; Y78-A646 WeakPolarHBondContact OH-CB 3.3Å; Y78-N647 HydrophobicContact CE2-CB 3.63Å; Y78-N647 PolarHBondContact OH-N 2.97Å; Y78-L650 HydrophobicContact CD2-CD1 3.62Å; Y78-L650 HydrophobicContact CE2-CD1 3.57Å; Y78-L650 HydrophobicContact CG-CD1 4.46Å
79	V	90.2	Very high	82.9	Confident	12 Å²	12	37.3 Å²	37.3	7%	0.073	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	135.1	169.8	-174	0	0	0	0	110.5	V66 V67 F68 S77 E113 V117	V66-V79 HydrophobicContact CG1-CG1 3.36Å; V67-V79 CarbonylContact O-C 3.53Å; V67-V79 WeakPolarHBondContact O-CA 3.19Å; F68-V79 HydrophobicContact CB-CG2 4.09Å; S77-V79 VanDerWaalsContact C-N 3.26Å; S77-V79 VanDerWaalsContact CB-O 3.28Å; S77-V79 WeakPolarHBondContact CB-O 3.38Å; S77-V79 PolarHBondContact O-N 2.91Å; S77-V79 PolarHBondContact OG-O 3.13Å; V79-E113 HydrophobicContact CG2-CB 3.41Å; V79-E113 VanDerWaalsContact CG2-CB 3.41Å; V79-V117 HydrophobicContact CB-CG2 4.33Å; V79-V117 HydrophobicContact CG1-CB 4.09Å; V79-V117 HydrophobicContact CG1-CG1 4.15Å; V79-V117 HydrophobicContact CG1-CG2 3.95Å; V79-V117 HydrophobicContact CG2-CG2 4.44Å
80	Q	90.8	Very high	82.8	Confident	79 Å²	79	41 Å²	41	37%	0.369	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	130.4	166.2	-52.5	-177.2	16.6	0	0	107.6	V67 E76	V67-Q80 HydrophobicContact CB-CB 4.37Å; V67-Q80 PolarHBondContact N-O 3.16Å; V67-Q80 PolarHBondContact O-N 2.97Å; E76-Q80 PolarHBondContact OE2-NE2 2.99Å
81	C	92.2	Very high	83.1	Confident	64 Å²	64	41 Å²	41	43%	0.432	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	128.7	-177.8	-168.3	0	0	0	0	110	V117	C81-V117 HydrophobicContact CB-CG1 3.89Å
82	H	89.9	Confident	83.7	Confident	46 Å²	46	41 Å²	41	21%	0.213	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-86.3	146.3	170.6	-68.1	-119.5	0	0	0	109.2	L65 W94	L65-H82 HydrophobicContact CB-CB 4.16Å; L65-H82 PolarHBondContact O-N 3.41Å; H82-W94 HydrophobicContact CB-CD2 4.08Å; H82-W94 HydrophobicContact CB-CE3 3.54Å; H82-W94 HydrophobicContact CB-CH2 4.21Å; H82-W94 HydrophobicContact CB-CZ3 3.62Å; H82-W94 AromaticContact CE1-CD1 3.99Å; H82-W94 AromaticContact CE1-CG 3.58Å; H82-W94 AromaticContact CG-CD2 3.86Å; H82-W94 AromaticContact CG-CE3 3.74Å; H82-W94 AromaticContact ND1-CD1 3.71Å; H82-W94 AromaticContact ND1-CD2 3.17Å; H82-W94 AromaticContact ND1-CE2 3.68Å; H82-W94 AromaticContact ND1-CE3 3.56Å; H82-W94 AromaticContact ND1-CG 3.21Å; H82-W94 AromaticContact ND1-NE1 3.95Å
83	A	84.9	Confident	84.5	Confident	45 Å²	45	41.9 Å²	41.9	37%	0.372	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-67.2	144.3	167.8	0	0	0	0	0	108.6	W94	A83-W94 WeakPolarHBondContact O-CH2 3.33Å; A83-W94 WeakPolarHBondContact O-CZ3 2.98Å
84	P	90.3	Very high	85.8	Confident	39 Å²	39	42.9 Å²	42.9	25%	0.253	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-64.6	156.3	-177.3	-25	35.3	0	0	0	115	Y63 L121 F125 M128	Y63-P84 VanDerWaalsContact O-CA 3.24Å; Y63-P84 WeakPolarHBondContact O-CA 3.34Å; P84-L121 HydrophobicContact CG-CD2 4.03Å; P84-F125 HydrophobicContact CB-CD1 4.47Å; P84-F125 HydrophobicContact CB-CE1 3.37Å; P84-F125 HydrophobicContact CB-CZ 3.73Å; P84-F125 HydrophobicContact CG-CD1 4.44Å; P84-F125 HydrophobicContact CG-CE1 3.57Å; P84-F125 HydrophobicContact CG-CZ 3.78Å; P84-M128 HydrophobicContact CB-CE 4.49Å; P84-M128 HydrophobicContact CG-CE 4.22Å
85	T	90.1	Very high	87.7	Confident	15 Å²	15	41.9 Å²	41.9	9%	0.092	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-140.2	149.8	177.3	-172.6	0	0	0	0	111.6	Y63 S87 E90 F91 W94	Y63-T85 PolarHBondContact N-O 3.12Å; Y63-T85 PolarHBondContact O-N 3.44Å; T85-S87 WeakPolarHBondContact CG2-O 3.43Å; T85-S87 PolarHBondContact OG1-N 2.94Å; T85-S87 VanDerWaalsContact OG1-N 3.11Å; T85-E90 VanDerWaalsContact CB-OE2 3.25Å; T85-E90 WeakPolarHBondContact CB-OE2 3.37Å; T85-E90 HydrophobicContact CG2-CB 4.38Å; T85-E90 PolarHBondContact OG1-OE2 3.47Å; T85-F91 HydrophobicContact CG2-CB 4.06Å; T85-W94 HydrophobicContact CG2-CH2 3.42Å; T85-W94 VanDerWaalsContact CG2-CH2 3.42Å; T85-W94 HydrophobicContact CG2-CZ2 4.18Å; T85-W94 HydrophobicContact CG2-CZ3 3.66Å
86	S	89.3	Confident	89.4	Confident	25 Å²	25	39.9 Å²	39.9	18%	0.175	22%	0.223	C	C	.	.	S	Bend	trans	-86.1	-8.3	166.3	19.7	0	0	0	0	113.2	G55 G56 T61 Q62	G55-S86 VanDerWaalsContact C-OG 3.26Å; G55-S86 WeakPolarHBondContact CA-OG 3.47Å; G56-S86 PolarHBondContact O-OG 3.01Å; T61-S86 WeakPolarHBondContact O-CA 3.44Å; T61-S86 WeakPolarHBondContact O-CB 3.22Å; Q62-S86 VanDerWaalsContact NE2-CB 3.25Å; Q62-S86 PolarHBondContact NE2-OG 2.97Å
87	S	90.2	Very high	90.8	Very high	15 Å²	15	39.5 Å²	39.5	11%	0.105	23%	0.229	C	C	.	.			trans	-87.8	110.9	179.7	-175.9	0	0	0	0	111.3	D53 T85 F89 E90 F91	D53-S87 WeakPolarHBondContact O-CB 3.31Å; D53-S87 PolarHBondContact O-OG 2.98Å; T85-S87 WeakPolarHBondContact CG2-O 3.43Å; T85-S87 PolarHBondContact OG1-N 2.94Å; T85-S87 VanDerWaalsContact OG1-N 3.11Å; S87-F89 PolarHBondContact O-N 3.36Å; S87-E90 PolarHBondContact O-N 2.94Å; S87-E90 PolarHBondContact OG-N 3.19Å; S87-F91 WeakPolarHBondContact O-CB 3.45Å; S87-F91 PolarHBondContact O-N 2.74Å
88	A	91.3	Very high	91.6	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.9	-33.6	173.6	0	0	0	0	0	112.2	I41 N45 P49 Y63 F91 V92	I41-A88 HydrophobicContact CG2-CB 3.8Å; N45-A88 HydrophobicContact CB-CB 4.08Å; N45-A88 VanDerWaalsContact CG-CB 3.45Å; N45-A88 VanDerWaalsContact OD1-CB 3.25Å; N45-A88 WeakPolarHBondContact OD1-CB 3.33Å; P49-A88 HydrophobicContact CB-CB 3.96Å; P49-A88 HydrophobicContact CG-CB 4.02Å; Y63-A88 HydrophobicContact CE2-CB 3.85Å; A88-F91 PolarHBondContact O-N 3.26Å; A88-V92 WeakPolarHBondContact O-CG2 3.34Å; A88-V92 PolarHBondContact O-N 3.39Å
89	F	89.6	Confident	91.8	Very high	80 Å²	80	43.8 Å²	43.8	35%	0.351	24%	0.243	S	C	.	.	H	α-helix	trans	-69.1	-44	176.5	179.9	-90.3	0	0	0	112.6	P49 A50 E51 S87 F91 V92 S93	P49-F89 HydrophobicContact CB-CB 4.46Å; A50-F89 WeakPolarHBondContact O-CB 3.33Å; E51-F89 HydrophobicContact CG-CD1 4.36Å; E51-F89 HydrophobicContact CG-CD2 4.15Å; E51-F89 HydrophobicContact CG-CE1 3.84Å; E51-F89 HydrophobicContact CG-CE2 3.6Å; E51-F89 HydrophobicContact CG-CZ 3.43Å; E51-F89 VanDerWaalsContact CG-CZ 3.43Å; S87-F89 PolarHBondContact O-N 3.36Å; F89-F91 VanDerWaalsContact C-N 3.27Å; F89-F91 PolarHBondContact O-N 3.07Å; F89-V92 PolarHBondContact O-N 2.8Å; F89-S93 PolarHBondContact O-N 3.39Å
90	E	91.7	Very high	91.9	Very high	83 Å²	83	45.3 Å²	45.3	39%	0.388	25%	0.249	S	C	.	.	H	α-helix	trans	-60.2	-42.6	173.4	-170.4	-176.4	-156.4	0	0	110.6	T85 S87 S93 W94	T85-E90 VanDerWaalsContact CB-OE2 3.25Å; T85-E90 WeakPolarHBondContact CB-OE2 3.37Å; T85-E90 HydrophobicContact CG2-CB 4.38Å; T85-E90 PolarHBondContact OG1-OE2 3.47Å; S87-E90 PolarHBondContact O-N 2.94Å; S87-E90 PolarHBondContact OG-N 3.19Å; E90-S93 WeakPolarHBondContact O-CA 3.36Å; E90-S93 WeakPolarHBondContact O-CB 3.27Å; E90-S93 PolarHBondContact O-N 2.87Å; E90-S93 VanDerWaalsContact O-N 3.09Å; E90-S93 PolarHBondContact O-OG 2.95Å; E90-W94 VanDerWaalsContact CD-CZ2 3.41Å; E90-W94 HydrophobicContact CG-CZ2 3.67Å; E90-W94 PolarHBondContact O-N 3.34Å; E90-W94 VanDerWaalsContact O-N 3.14Å
91	F	94.9	Very high	91.7	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61.2	-45.1	178	-175.1	-114.5	0	0	0	113.1	F17 I41 Y63 L65 T85 S87 A88 F89 S93 W94 I95	F17-F91 HydrophobicContact CB-CZ 4.06Å; F17-F91 AromaticContact CD2-CE1 3.62Å; F17-F91 HydrophobicContact CD2-CE1 3.62Å; F17-F91 AromaticContact CD2-CZ 3.42Å; F17-F91 HydrophobicContact CD2-CZ 3.42Å; F17-F91 VanDerWaalsContact CD2-CZ 3.42Å; F17-F91 AromaticContact CE2-CE1 3.82Å; F17-F91 HydrophobicContact CE2-CE1 3.82Å; F17-F91 HydrophobicContact CE2-CZ 4.11Å; F17-F91 HydrophobicContact CG-CE1 4.34Å; F17-F91 AromaticContact CG-CZ 3.99Å; F17-F91 HydrophobicContact CG-CZ 3.99Å; I41-F91 HydrophobicContact CD1-CD1 3.71Å; I41-F91 HydrophobicContact CD1-CE1 3.77Å; I41-F91 HydrophobicContact CG1-CD1 4.07Å; I41-F91 HydrophobicContact CG1-CE1 3.99Å; Y63-F91 VanDerWaalsContact CB-CD2 3.45Å; Y63-F91 VanDerWaalsContact CB-CG 3.5Å; Y63-F91 AromaticContact CD1-CD1 3.83Å; Y63-F91 HydrophobicContact CD1-CD1 3.83Å; Y63-F91 AromaticContact CD1-CE1 3.97Å; Y63-F91 HydrophobicContact CD1-CE1 3.97Å; Y63-F91 HydrophobicContact CD1-CG 4.32Å; Y63-F91 HydrophobicContact CD2-CB 4.47Å; Y63-F91 HydrophobicContact CG-CB 4.27Å; Y63-F91 AromaticContact CG-CD1 3.91Å; Y63-F91 HydrophobicContact CG-CD1 3.91Å; Y63-F91 HydrophobicContact CG-CD2 4.37Å; Y63-F91 HydrophobicContact CG-CE1 4.35Å; Y63-F91 AromaticContact CG-CG 3.93Å; Y63-F91 HydrophobicContact CG-CG 3.93Å; L65-F91 HydrophobicContact CB-CD2 4.47Å; L65-F91 HydrophobicContact CB-CE2 3.77Å; T85-F91 HydrophobicContact CG2-CB 4.06Å; S87-F91 WeakPolarHBondContact O-CB 3.45Å; S87-F91 PolarHBondContact O-N 2.74Å; A88-F91 PolarHBondContact O-N 3.26Å; F89-F91 VanDerWaalsContact C-N 3.27Å; F89-F91 PolarHBondContact O-N 3.07Å; F91-S93 VanDerWaalsContact C-N 3.31Å; F91-S93 PolarHBondContact O-N 3.47Å; F91-W94 AromaticContact CD2-CE3 3.9Å; F91-W94 HydrophobicContact CD2-CE3 3.9Å; F91-W94 HydrophobicContact CD2-CZ3 4.15Å; F91-W94 WeakPolarHBondContact O-CB 3.46Å; F91-W94 PolarHBondContact O-N 3.46Å; F91-I95 HydrophobicContact CD1-CD1 3.79Å; F91-I95 HydrophobicContact CE1-CD1 3.47Å; F91-I95 VanDerWaalsContact CE1-CD1 3.47Å; F91-I95 HydrophobicContact CG-CD1 4.44Å; F91-I95 HydrophobicContact CZ-CD1 3.87Å; F91-I95 WeakPolarHBondContact O-CG1 3.5Å; F91-I95 PolarHBondContact O-N 3.22Å
92	V	95.1	Very high	91.1	Very high	17 Å²	17	44.1 Å²	44.1	10%	0.103	25%	0.248	C	C	.	.	H	α-helix	trans	-60.6	-40.2	171.1	171.4	0	0	0	0	111	L38 I41 P49 A88 F89 W94 I95 D96	L38-V92 HydrophobicContact CD2-CG1 4.11Å; L38-V92 HydrophobicContact CD2-CG2 3.77Å; I41-V92 HydrophobicContact CD1-CG2 3.75Å; I41-V92 HydrophobicContact CG2-CG2 4.48Å; P49-V92 HydrophobicContact CB-CG2 4.37Å; P49-V92 HydrophobicContact CG-CG2 4.14Å; A88-V92 WeakPolarHBondContact O-CG2 3.34Å; A88-V92 PolarHBondContact O-N 3.39Å; F89-V92 PolarHBondContact O-N 2.8Å; V92-W94 PolarHBondContact O-N 3.36Å; V92-W94 VanDerWaalsContact O-N 3.16Å; V92-I95 WeakPolarHBondContact O-CB 3.39Å; V92-I95 PolarHBondContact O-N 3.34Å; V92-I95 VanDerWaalsContact O-N 3.13Å; V92-D96 WeakPolarHBondContact O-CB 3.31Å; V92-D96 VanDerWaalsContact O-CG 3.26Å; V92-D96 PolarHBondContact O-N 3.39Å
93	S	93.9	Very high	90.5	Very high	54 Å²	54	42 Å²	42	38%	0.378	24%	0.239	S	C	.	.	H	α-helix	trans	-62.3	-24.9	178.1	85.9	0	0	0	0	113.8	F89 E90 F91 S97	F89-S93 PolarHBondContact O-N 3.39Å; E90-S93 WeakPolarHBondContact O-CA 3.36Å; E90-S93 WeakPolarHBondContact O-CB 3.27Å; E90-S93 PolarHBondContact O-N 2.87Å; E90-S93 VanDerWaalsContact O-N 3.09Å; E90-S93 PolarHBondContact O-OG 2.95Å; F91-S93 VanDerWaalsContact C-N 3.31Å; F91-S93 PolarHBondContact O-N 3.47Å; S93-S97 PolarHBondContact O-N 2.88Å
94	W	95.6	Very high	89.6	Confident	36 Å²	36	43.1 Å²	43.1	14%	0.136	26%	0.255	C	S	.	.	H	α-helix	trans	-78.8	-44	172.8	-58.4	-17.5	0	0	0	112.1	L65 H82 A83 T85 E90 F91 V92 D96 S97 I98	L65-W94 HydrophobicContact CB-CE3 4.3Å; L65-W94 HydrophobicContact CD2-CB 3.7Å; H82-W94 HydrophobicContact CB-CD2 4.08Å; H82-W94 HydrophobicContact CB-CE3 3.54Å; H82-W94 HydrophobicContact CB-CH2 4.21Å; H82-W94 HydrophobicContact CB-CZ3 3.62Å; H82-W94 AromaticContact CE1-CD1 3.99Å; H82-W94 AromaticContact CE1-CG 3.58Å; H82-W94 AromaticContact CG-CD2 3.86Å; H82-W94 AromaticContact CG-CE3 3.74Å; H82-W94 AromaticContact ND1-CD1 3.71Å; H82-W94 AromaticContact ND1-CD2 3.17Å; H82-W94 AromaticContact ND1-CE2 3.68Å; H82-W94 AromaticContact ND1-CE3 3.56Å; H82-W94 AromaticContact ND1-CG 3.21Å; H82-W94 AromaticContact ND1-NE1 3.95Å; A83-W94 WeakPolarHBondContact O-CH2 3.33Å; A83-W94 WeakPolarHBondContact O-CZ3 2.98Å; T85-W94 HydrophobicContact CG2-CH2 3.42Å; T85-W94 VanDerWaalsContact CG2-CH2 3.42Å; T85-W94 HydrophobicContact CG2-CZ2 4.18Å; T85-W94 HydrophobicContact CG2-CZ3 3.66Å; E90-W94 VanDerWaalsContact CD-CZ2 3.41Å; E90-W94 HydrophobicContact CG-CZ2 3.67Å; E90-W94 PolarHBondContact O-N 3.34Å; E90-W94 VanDerWaalsContact O-N 3.14Å; F91-W94 AromaticContact CD2-CE3 3.9Å; F91-W94 HydrophobicContact CD2-CE3 3.9Å; F91-W94 HydrophobicContact CD2-CZ3 4.15Å; F91-W94 WeakPolarHBondContact O-CB 3.46Å; F91-W94 PolarHBondContact O-N 3.46Å; V92-W94 PolarHBondContact O-N 3.36Å; V92-W94 VanDerWaalsContact O-N 3.16Å; W94-D96 PolarHBondContact O-N 2.84Å; W94-S97 WeakPolarHBondContact O-CA 3.33Å; W94-S97 WeakPolarHBondContact O-CB 3.14Å; W94-S97 PolarHBondContact O-N 2.95Å; W94-S97 PolarHBondContact O-OG 2.93Å; W94-I98 PolarHBondContact O-N 3.22Å
95	I	96.1	Very high	88.7	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-56.1	-41.3	173.8	-71.2	167.2	0	0	0	110.6	F29 I37 I41 L65 F91 V92 S97 I98	F29-I95 HydrophobicContact CE1-CG2 4.23Å; F29-I95 HydrophobicContact CZ-CG2 3.75Å; I37-I95 HydrophobicContact CG2-CD1 3.94Å; I41-I95 HydrophobicContact CD1-CD1 3.73Å; L65-I95 HydrophobicContact CD1-CG1 4.33Å; L65-I95 HydrophobicContact CD2-CG1 4.33Å; F91-I95 HydrophobicContact CD1-CD1 3.79Å; F91-I95 HydrophobicContact CE1-CD1 3.47Å; F91-I95 VanDerWaalsContact CE1-CD1 3.47Å; F91-I95 HydrophobicContact CG-CD1 4.44Å; F91-I95 HydrophobicContact CZ-CD1 3.87Å; F91-I95 WeakPolarHBondContact O-CG1 3.5Å; F91-I95 PolarHBondContact O-N 3.22Å; V92-I95 WeakPolarHBondContact O-CB 3.39Å; V92-I95 PolarHBondContact O-N 3.34Å; V92-I95 VanDerWaalsContact O-N 3.13Å; I95-S97 PolarHBondContact O-N 2.79Å; I95-I98 WeakPolarHBondContact O-CG1 3.46Å; I95-I98 PolarHBondContact O-N 2.99Å
96	D	94.4	Very high	88.4	Confident	86 Å²	86	46.5 Å²	46.5	46%	0.46	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.8	177.2	-69.1	13.8	0	0	0	113.4	R33 V92 W94	R33-D96 IonicContact CZ-OD1 3.49Å; R33-D96 IonicContact CZ-OD2 3.64Å; R33-D96 IonicContact NE-OD1 3.23Å; R33-D96 PolarHBondContact NE-OD1 2.65Å; R33-D96 IonicContact NH2-OD1 3.97Å; R33-D96 PolarHBondContact NH2-OD1 2.96Å; R33-D96 IonicContact NH2-OD2 3.73Å; R33-D96 PolarHBondContact NH2-OD2 3.3Å; V92-D96 WeakPolarHBondContact O-CB 3.31Å; V92-D96 VanDerWaalsContact O-CG 3.26Å; V92-D96 PolarHBondContact O-N 3.39Å; W94-D96 PolarHBondContact O-N 2.84Å
97	S	94.3	Very high	88.2	Confident	67 Å²	67	50 Å²	50	47%	0.469	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-4.7	179.5	76.9	0	0	0	0	114.4	S93 W94 I95 Q99	S93-S97 PolarHBondContact O-N 2.88Å; W94-S97 WeakPolarHBondContact O-CA 3.33Å; W94-S97 WeakPolarHBondContact O-CB 3.14Å; W94-S97 PolarHBondContact O-N 2.95Å; W94-S97 PolarHBondContact O-OG 2.93Å; I95-S97 PolarHBondContact O-N 2.79Å; S97-Q99 PolarHBondContact O-N 3.14Å
98	I	93.3	Very high	88.2	Confident	23 Å²	23	50.6 Å²	50.6	12%	0.118	31%	0.308	C	S	.	.			trans	-64.5	128.1	-178.6	-58.7	174.9	0	0	0	110.2	I19 F29 L65 V67 W94 I95 F100	I19-I98 HydrophobicContact CB-CD1 4.39Å; I19-I98 HydrophobicContact CD1-CD1 3.98Å; I19-I98 HydrophobicContact CG2-CD1 4.19Å; F29-I98 HydrophobicContact CZ-CD1 4.2Å; L65-I98 HydrophobicContact CD1-CD1 4.42Å; L65-I98 HydrophobicContact CD2-CD1 4.28Å; L65-I98 HydrophobicContact CD2-CG1 4.48Å; V67-I98 HydrophobicContact CG1-CG2 4.07Å; V67-I98 HydrophobicContact CG2-CD1 3.86Å; V67-I98 HydrophobicContact CG2-CG1 3.97Å; W94-I98 PolarHBondContact O-N 3.22Å; I95-I98 WeakPolarHBondContact O-CG1 3.46Å; I95-I98 PolarHBondContact O-N 2.99Å; I98-F100 HydrophobicContact CB-CE2 3.93Å; I98-F100 HydrophobicContact CB-CZ 3.8Å; I98-F100 HydrophobicContact CD1-CZ 4.43Å; I98-F100 HydrophobicContact CG2-CD1 4.17Å; I98-F100 HydrophobicContact CG2-CD2 4.31Å; I98-F100 HydrophobicContact CG2-CE1 3.62Å; I98-F100 HydrophobicContact CG2-CE2 3.77Å; I98-F100 HydrophobicContact CG2-CG 4.48Å; I98-F100 HydrophobicContact CG2-CZ 3.38Å
99	Q	90.4	Very high	88.3	Confident	133 Å²	133	50.6 Å²	50.6	62%	0.621	31%	0.308	S	S	*	.			trans	-101.3	105.7	177.7	-60.6	-174	20.1	0	0	109.6	S97 M101	S97-Q99 PolarHBondContact O-N 3.14Å; Q99-M101 HydrophobicContact CB-CE 3.89Å; Q99-M101 HydrophobicContact CB-CG 4.23Å; Q99-M101 HydrophobicContact CB-SD 4.39Å; Q99-M101 PolarHBondContact O-N 3.01Å
100	F	91.2	Very high	88.5	Confident	44 Å²	44	46.9 Å²	46.9	19%	0.193	29%	0.292	C	S	.	.			trans	-76.3	87.1	-177.6	-64.4	-77.3	0	0	0	111.3	I19 E20 G21 L25 G26 F29 I98	I19-F100 HydrophobicContact CG2-CE1 4.43Å; E20-F100 WeakPolarHBondContact O-CE1 3.24Å; G21-F100 WeakPolarHBondContact O-CA 3.24Å; L25-F100 HydrophobicContact CB-CD1 4.21Å; L25-F100 HydrophobicContact CB-CE1 4.31Å; L25-F100 HydrophobicContact CD2-CE1 4.15Å; L25-F100 HydrophobicContact CG-CE1 4.42Å; G26-F100 VanDerWaalsContact CA-CG 3.46Å; F29-F100 HydrophobicContact CB-CE1 4.44Å; F29-F100 HydrophobicContact CB-CE2 4Å; F29-F100 HydrophobicContact CB-CZ 3.95Å; F29-F100 HydrophobicContact CD1-CD2 4.45Å; F29-F100 AromaticContact CD1-CE2 3.35Å; F29-F100 HydrophobicContact CD1-CE2 3.35Å; F29-F100 AromaticContact CD1-CZ 3.46Å; F29-F100 HydrophobicContact CD1-CZ 3.46Å; F29-F100 VanDerWaalsContact CD1-CZ 3.46Å; F29-F100 AromaticContact CD2-CE1 3.97Å; F29-F100 HydrophobicContact CD2-CE1 3.97Å; F29-F100 HydrophobicContact CD2-CE2 4.15Å; F29-F100 AromaticContact CD2-CZ 3.4Å; F29-F100 HydrophobicContact CD2-CZ 3.4Å; F29-F100 VanDerWaalsContact CD2-CZ 3.4Å; F29-F100 AromaticContact CE1-CE2 3.72Å; F29-F100 HydrophobicContact CE1-CE2 3.72Å; F29-F100 AromaticContact CE1-CZ 3.64Å; F29-F100 HydrophobicContact CE1-CZ 3.64Å; F29-F100 HydrophobicContact CE2-CE1 4.34Å; F29-F100 HydrophobicContact CE2-CE2 4.48Å; F29-F100 AromaticContact CE2-CZ 3.61Å; F29-F100 HydrophobicContact CE2-CZ 3.61Å; F29-F100 HydrophobicContact CG-CE1 4.1Å; F29-F100 AromaticContact CG-CE2 3.56Å; F29-F100 HydrophobicContact CG-CE2 3.56Å; F29-F100 AromaticContact CG-CZ 3.3Å; F29-F100 HydrophobicContact CG-CZ 3.3Å; F29-F100 HydrophobicContact CZ-CE2 4.26Å; F29-F100 AromaticContact CZ-CZ 3.7Å; F29-F100 HydrophobicContact CZ-CZ 3.7Å; I98-F100 HydrophobicContact CB-CE2 3.93Å; I98-F100 HydrophobicContact CB-CZ 3.8Å; I98-F100 HydrophobicContact CD1-CZ 4.43Å; I98-F100 HydrophobicContact CG2-CD1 4.17Å; I98-F100 HydrophobicContact CG2-CD2 4.31Å; I98-F100 HydrophobicContact CG2-CE1 3.62Å; I98-F100 HydrophobicContact CG2-CE2 3.77Å; I98-F100 HydrophobicContact CG2-CG 4.48Å; I98-F100 HydrophobicContact CG2-CZ 3.38Å
101	M	85.9	Confident	88.8	Confident	82 Å²	82	43 Å²	43	40%	0.404	27%	0.274	S	S	.	.			trans	-133.7	162	-170.4	-61	-164.3	-58.9	0	0	112.1	G21 T22 E76 Q99	G21-M101 PolarHBondContact O-N 3.29Å; G21-M101 VanDerWaalsContact O-N 3.15Å; T22-M101 WeakPolarHBondContact CA-O 3.42Å; E76-M101 VanDerWaalsContact OE1-CE 3.29Å; E76-M101 WeakPolarHBondContact OE1-CE 3.19Å; Q99-M101 HydrophobicContact CB-CE 3.89Å; Q99-M101 HydrophobicContact CB-CG 4.23Å; Q99-M101 HydrophobicContact CB-SD 4.39Å; Q99-M101 PolarHBondContact O-N 3.01Å
102	G	81.1	Confident	88.9	Confident	36 Å²	36	43.2 Å²	43.2	37%	0.371	28%	0.275	S	S	.	.	S	Bend	trans	61.9	-169.8	-176.3	0	0	0	0	0	113.6	A23 G104	A23-G102 VanDerWaalsContact CB-O 3.31Å; A23-G102 WeakPolarHBondContact CB-O 3.33Å; A23-G102 PolarHBondContact N-O 3.42Å; G102-G104 PolarHBondContact O-N 3.08Å
103	G	75.9	Confident	88.9	Confident	2 Å²	2	42.4 Å²	42.4	2%	0.021	27%	0.271	C	S	.	.			trans	70.7	-18.8	173.8	0	0	0	0	0	117.1	T70 D72 A105 E106	T70-G103 VanDerWaalsContact CG2-CA 3.45Å; D72-G103 VanDerWaalsContact OD1-CA 3.27Å; D72-G103 WeakPolarHBondContact OD1-CA 3.49Å; D72-G103 PolarHBondContact OD1-N 2.98Å; D72-G103 PolarHBondContact OD2-N 2.66Å; G103-A105 PolarHBondContact O-N 3.5Å; G103-E106 PolarHBondContact O-N 3.01Å
104	G	67.6	Low	89.1	Confident	69 Å²	69	39.9 Å²	39.9	71%	0.711	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-3.1	-172.8	0	0	0	0	0	116.6	G102	G102-G104 PolarHBondContact O-N 3.08Å
105	A	70.9	Confident	89.2	Confident	81 Å²	81	38.1 Å²	38.1	67%	0.669	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-5.3	173.4	0	0	0	0	0	113.6	G103	G103-A105 PolarHBondContact O-N 3.5Å
106	E	82.8	Confident	89.3	Confident	44 Å²	44	38.1 Å²	38.1	21%	0.206	25%	0.246	C	C	.	.			trans	-114.2	141.6	-172.6	-57.7	-74.1	150.7	0	0	110.1	T70 D72 G103 Y148 R640	T70-E106 HydrophobicContact CG2-CB 4.24Å; D72-E106 HydrophobicContact CB-CG 4.24Å; G103-E106 PolarHBondContact O-N 3.01Å; E106-Y148 WeakPolarHBondContact CB-OH 3.16Å; E106-Y148 PolarHBondContact OE2-OH 3.23Å; E106-Y148 VanDerWaalsContact OE2-OH 3.12Å; E106-R640 IonicContact OE1-CZ 2.8Å; E106-R640 IonicContact OE1-NH1 2.7Å; E106-R640 PolarHBondContact OE1-NH1 2.85Å; E106-R640 IonicContact OE1-NH2 3.88Å
107	S	85.1	Confident	89.4	Confident	99 Å²	99	34.8 Å²	34.8	69%	0.692	23%	0.229	S	C	*	.	S	Bend	trans	-90.3	-1.3	-175	60.7	0	0	0	0	114.6	P146	S107-P146 VanDerWaalsContact O-CD 3.25Å; S107-P146 WeakPolarHBondContact O-CD 3.47Å; S107-P146 WeakPolarHBondContact O-CG 3.46Å
108	C	90.8	Very high	89.6	Confident	26 Å²	26	31.6 Å²	31.6	18%	0.176	21%	0.206	C	C	.	.			trans	-139.4	159.1	-173.4	-62.2	0	0	0	0	110.3	T70 P146 Y148	T70-C108 WeakPolarHBondContact CG2-O 3.36Å; C108-P146 CarbonylContact C-O 3.49Å; C108-P146 VanDerWaalsContact CA-O 3.26Å; C108-P146 WeakPolarHBondContact CA-O 3.1Å; C108-Y148 HydrophobicContact CB-CD1 3.58Å; C108-Y148 HydrophobicContact CB-CD2 3.96Å; C108-Y148 HydrophobicContact CB-CE1 3.69Å; C108-Y148 HydrophobicContact CB-CE2 4.06Å; C108-Y148 HydrophobicContact CB-CG 3.72Å; C108-Y148 WeakPolarHBondContact O-CE2 3.43Å; C108-Y148 PolarHBondContact O-OH 2.9Å
109	S	93.6	Very high	89.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-127.7	159.9	177.5	61.4	0	0	0	0	112.6	F68 I111 S145 P146 Y148	F68-S109 WeakPolarHBondContact CE2-OG 3.47Å; S109-I111 PolarHBondContact O-N 3.02Å; S109-S145 WeakPolarHBondContact OG-CB 3.41Å; S109-P146 PolarHBondContact N-O 3.26Å; S109-Y148 VanDerWaalsContact C-CD2 3.44Å; S109-Y148 WeakPolarHBondContact O-CD2 3.48Å; S109-Y148 PolarHBondContact O-N 3.45Å; S109-Y148 VanDerWaalsContact O-N 3.12Å
110	L	94.4	Very high	90	Very high	3 Å²	3	26.9 Å²	26.9	2%	0.016	18%	0.184	C	C	.	.			trans	-80	51.5	-173.3	-68.1	168.3	0	0	0	112.6	F68 N69 V71 Y78 A112 E113 G114 Y148 L150 L650	F68-L110 VanDerWaalsContact CD2-C 3.44Å; F68-L110 WeakPolarHBondContact CD2-O 3.36Å; N69-L110 WeakPolarHBondContact O-CB 3.35Å; N69-L110 PolarHBondContact O-N 2.61Å; V71-L110 HydrophobicContact CG1-CD1 4.11Å; V71-L110 HydrophobicContact CG1-CD2 4Å; V71-L110 HydrophobicContact CG1-CG 4.39Å; Y78-L110 HydrophobicContact CD1-CD1 3.52Å; Y78-L110 HydrophobicContact CD2-CD1 4.34Å; Y78-L110 HydrophobicContact CE1-CD1 4.28Å; Y78-L110 HydrophobicContact CG-CD1 3.58Å; L110-A112 PolarHBondContact O-N 3.49Å; L110-A112 VanDerWaalsContact O-N 3.16Å; L110-E113 HydrophobicContact CB-CB 4.27Å; L110-E113 HydrophobicContact CB-CG 4.02Å; L110-E113 HydrophobicContact CD2-CG 4.36Å; L110-E113 PolarHBondContact O-N 3.36Å; L110-G114 PolarHBondContact O-N 3.26Å; L110-G114 VanDerWaalsContact O-N 3.09Å; L110-Y148 HydrophobicContact CD2-CD2 3.69Å; L110-Y148 HydrophobicContact CD2-CE2 4.16Å; L110-Y148 HydrophobicContact CD2-CG 4.49Å; L110-Y148 HydrophobicContact CG-CD2 3.98Å; L110-Y148 HydrophobicContact CG-CE2 4.13Å; L110-L150 HydrophobicContact CD2-CD1 4.44Å; L110-L650 HydrophobicContact CD2-CD2 4.28Å
111	I	97.4	Very high	90.2	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-55.1	-33.6	177.5	-61.7	-180	0	0	0	111.2	F68 S109 G114 L115 L141 P147 A163 L188 L191	F68-I111 HydrophobicContact CE2-CB 4.22Å; F68-I111 HydrophobicContact CE2-CG1 3.48Å; F68-I111 VanDerWaalsContact CE2-CG1 3.48Å; F68-I111 HydrophobicContact CZ-CG1 3.69Å; S109-I111 PolarHBondContact O-N 3.02Å; I111-G114 PolarHBondContact O-N 3.42Å; I111-L115 HydrophobicContact CG2-CD1 3.69Å; I111-L115 HydrophobicContact CG2-CG 3.94Å; I111-L115 WeakPolarHBondContact O-CB 3.34Å; I111-L115 VanDerWaalsContact O-CG 3.3Å; I111-L115 WeakPolarHBondContact O-CG 3.36Å; I111-L115 PolarHBondContact O-N 3.38Å; I111-L141 HydrophobicContact CD1-CD2 4.4Å; I111-L141 HydrophobicContact CG2-CD1 4.31Å; I111-L141 HydrophobicContact CG2-CD2 3.99Å; I111-P147 HydrophobicContact CB-CB 4.05Å; I111-P147 HydrophobicContact CD1-CB 4.03Å; I111-P147 HydrophobicContact CG1-CB 4.38Å; I111-A163 HydrophobicContact CG2-CB 4.21Å; I111-L188 HydrophobicContact CD1-CD2 3.52Å; I111-L191 HydrophobicContact CG2-CD1 4.12Å
112	A	97.2	Very high	90.7	Very high	5 Å²	5	21.6 Å²	21.6	4%	0.041	16%	0.159	C	C	.	.	H	α-helix	trans	-59.8	-49.8	174.6	0	0	0	0	0	111.7	L110 S116 L150 A152 L166	L110-A112 PolarHBondContact O-N 3.49Å; L110-A112 VanDerWaalsContact O-N 3.16Å; A112-S116 WeakPolarHBondContact O-CB 3.32Å; A112-S116 PolarHBondContact O-N 3.05Å; A112-S116 PolarHBondContact O-OG 3.33Å; A112-L150 WeakPolarHBondContact CB-O 3.34Å; A112-A152 HydrophobicContact CB-CB 4.37Å; A112-L166 HydrophobicContact CB-CD1 4.23Å; A112-L166 WeakPolarHBondContact O-CD1 3.48Å
113	E	95.6	Very high	91.3	Very high	1 Å²	1	21.4 Å²	21.4	1%	0.005	15%	0.15	C	C	.	.	H	α-helix	trans	-61.8	-47.9	177.1	-54.9	-66.5	171.8	0	0	110.5	V79 L110 L115 S116 V117 A152 V153 E154	V79-E113 HydrophobicContact CG2-CB 3.41Å; V79-E113 VanDerWaalsContact CG2-CB 3.41Å; L110-E113 HydrophobicContact CB-CB 4.27Å; L110-E113 HydrophobicContact CB-CG 4.02Å; L110-E113 HydrophobicContact CD2-CG 4.36Å; L110-E113 PolarHBondContact O-N 3.36Å; E113-L115 PolarHBondContact O-N 3.31Å; E113-S116 WeakPolarHBondContact CA-OG 3.45Å; E113-S116 PolarHBondContact O-N 3.49Å; E113-S116 VanDerWaalsContact O-N 3.11Å; E113-S116 PolarHBondContact O-OG 3.23Å; E113-V117 PolarHBondContact O-N 3.35Å; E113-A152 WeakPolarHBondContact OE1-CA 3.3Å; E113-A152 WeakPolarHBondContact OE2-CA 3.45Å; E113-A152 WeakPolarHBondContact OE2-CB 3.47Å; E113-V153 VanDerWaalsContact CD-N 3.29Å; E113-V153 PolarHBondContact OE1-N 3.27Å; E113-V153 PolarHBondContact OE2-N 3.1Å; E113-E154 PolarHBondContact OE2-N 3.03Å
114	G	97	Very high	92	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57	-48.4	179.1	0	0	0	0	0	113.7	L110 I111 S116 V117 A118	L110-G114 PolarHBondContact O-N 3.26Å; L110-G114 VanDerWaalsContact O-N 3.09Å; I111-G114 PolarHBondContact O-N 3.42Å; G114-S116 VanDerWaalsContact C-N 3.33Å; G114-S116 PolarHBondContact O-N 2.85Å; G114-V117 PolarHBondContact O-N 3.45Å; G114-A118 WeakPolarHBondContact O-CB 3.46Å; G114-A118 PolarHBondContact O-N 2.94Å
115	L	98.4	Very high	93.1	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-68.5	-31.7	176.2	-65.6	179.3	0	0	0	112.4	V18 I111 E113 V117 A118 L119 L166 V167 I170 F177	V18-L115 HydrophobicContact CG1-CD2 4.42Å; V18-L115 HydrophobicContact CG2-CD2 4.46Å; I111-L115 HydrophobicContact CG2-CD1 3.69Å; I111-L115 HydrophobicContact CG2-CG 3.94Å; I111-L115 WeakPolarHBondContact O-CB 3.34Å; I111-L115 VanDerWaalsContact O-CG 3.3Å; I111-L115 WeakPolarHBondContact O-CG 3.36Å; I111-L115 PolarHBondContact O-N 3.38Å; E113-L115 PolarHBondContact O-N 3.31Å; L115-V117 VanDerWaalsContact C-N 3.32Å; L115-V117 PolarHBondContact O-N 2.88Å; L115-A118 PolarHBondContact O-N 2.81Å; L115-L119 PolarHBondContact O-N 2.75Å; L115-L166 HydrophobicContact CB-CB 4.04Å; L115-L166 HydrophobicContact CB-CD1 4.08Å; L115-L166 HydrophobicContact CD1-CB 4.45Å; L115-V167 HydrophobicContact CD1-CG1 3.73Å; L115-I170 HydrophobicContact CD2-CD1 4.11Å; L115-F177 HydrophobicContact CD2-CE2 3.81Å; L115-F177 HydrophobicContact CD2-CZ 4.31Å
116	S	97.6	Very high	94	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-70.8	-26.7	178.1	81.1	0	0	0	0	113.3	A112 E113 G114 A152 S155 Y158	A112-S116 WeakPolarHBondContact O-CB 3.32Å; A112-S116 PolarHBondContact O-N 3.05Å; A112-S116 PolarHBondContact O-OG 3.33Å; E113-S116 WeakPolarHBondContact CA-OG 3.45Å; E113-S116 PolarHBondContact O-N 3.49Å; E113-S116 VanDerWaalsContact O-N 3.11Å; E113-S116 PolarHBondContact O-OG 3.23Å; G114-S116 VanDerWaalsContact C-N 3.33Å; G114-S116 PolarHBondContact O-N 2.85Å; S116-A152 WeakPolarHBondContact OG-CB 3.49Å; S116-S155 PolarHBondContact O-OG 3.1Å; S116-S155 WeakPolarHBondContact OG-CB 3.39Å; S116-Y158 VanDerWaalsContact O-CD2 3.31Å; S116-Y158 WeakPolarHBondContact O-CD2 3.46Å
117	V	96.9	Very high	94.2	Very high	15 Å²	15	28.4 Å²	28.4	9%	0.091	15%	0.147	C	C	.	.	H	α-helix	trans	-84.4	-37.9	171.9	173.2	0	0	0	0	110.6	V66 V79 C81 E113 G114 L115 L119 Q120 L121	V66-V117 HydrophobicContact CG1-CB 4.14Å; V66-V117 HydrophobicContact CG1-CG1 4.08Å; V66-V117 HydrophobicContact CG2-CG1 4.07Å; V79-V117 HydrophobicContact CB-CG2 4.33Å; V79-V117 HydrophobicContact CG1-CB 4.09Å; V79-V117 HydrophobicContact CG1-CG1 4.15Å; V79-V117 HydrophobicContact CG1-CG2 3.95Å; V79-V117 HydrophobicContact CG2-CG2 4.44Å; C81-V117 HydrophobicContact CB-CG1 3.89Å; E113-V117 PolarHBondContact O-N 3.35Å; G114-V117 PolarHBondContact O-N 3.45Å; L115-V117 VanDerWaalsContact C-N 3.32Å; L115-V117 PolarHBondContact O-N 2.88Å; V117-L119 VanDerWaalsContact C-N 3.27Å; V117-L119 PolarHBondContact O-N 3.12Å; V117-Q120 WeakPolarHBondContact O-CB 3.24Å; V117-Q120 PolarHBondContact O-N 2.8Å; V117-L121 PolarHBondContact O-N 3.13Å; V117-L121 VanDerWaalsContact O-N 3.08Å
118	A	97.9	Very high	94	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-56.9	-40.3	172.4	0	0	0	0	0	112.5	V16 V18 V66 G114 L115 Q120 L121 F122	V16-A118 HydrophobicContact CG1-CB 3.76Å; V18-A118 HydrophobicContact CG2-CB 3.59Å; V66-A118 HydrophobicContact CG2-CB 4.37Å; G114-A118 WeakPolarHBondContact O-CB 3.46Å; G114-A118 PolarHBondContact O-N 2.94Å; L115-A118 PolarHBondContact O-N 2.81Å; A118-Q120 PolarHBondContact O-N 3.04Å; A118-L121 WeakPolarHBondContact O-CB 3.22Å; A118-L121 PolarHBondContact O-N 3.18Å; A118-F122 WeakPolarHBondContact O-CD2 3.43Å; A118-F122 PolarHBondContact O-N 3.23Å; A118-F122 VanDerWaalsContact O-N 3.12Å
119	L	97.7	Very high	93.5	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-66.4	-31.1	174.2	-81.4	169.5	0	0	0	113.7	L115 V117 F122 D123 Y158 L166 I169 I170 I175	L115-L119 PolarHBondContact O-N 2.75Å; V117-L119 VanDerWaalsContact C-N 3.27Å; V117-L119 PolarHBondContact O-N 3.12Å; L119-F122 PolarHBondContact O-N 3.05Å; L119-D123 PolarHBondContact O-N 3.44Å; L119-D123 VanDerWaalsContact O-N 3.11Å; L119-Y158 HydrophobicContact CB-CD1 4.34Å; L119-Y158 HydrophobicContact CB-CD2 3.98Å; L119-Y158 HydrophobicContact CB-CE1 4.02Å; L119-Y158 HydrophobicContact CB-CE2 3.64Å; L119-Y158 HydrophobicContact CB-CG 4.34Å; L119-Y158 HydrophobicContact CD1-CD1 4.09Å; L119-Y158 HydrophobicContact CD1-CE1 4.08Å; L119-L166 HydrophobicContact CD1-CB 4.29Å; L119-L166 HydrophobicContact CD1-CD2 3.79Å; L119-I169 HydrophobicContact CD1-CB 4.09Å; L119-I169 HydrophobicContact CD1-CG2 3.75Å; L119-I169 HydrophobicContact CD2-CG2 4.01Å; L119-I170 HydrophobicContact CD1-CG1 4.21Å; L119-I170 HydrophobicContact CD2-CG1 3.78Å; L119-I170 HydrophobicContact CG-CG1 4.01Å; L119-I175 HydrophobicContact CD2-CD1 4.04Å
120	Q	95.6	Very high	92.6	Very high	57 Å²	57	34.3 Å²	34.3	27%	0.266	16%	0.162	S	C	.	.	H	α-helix	trans	-65.1	-42.1	170.2	-64.9	-177.3	2.6	0	0	111.3	V117 A118 F122 D123 D124 S155 Y158	V117-Q120 WeakPolarHBondContact O-CB 3.24Å; V117-Q120 PolarHBondContact O-N 2.8Å; A118-Q120 PolarHBondContact O-N 3.04Å; Q120-F122 VanDerWaalsContact C-N 3.28Å; Q120-F122 PolarHBondContact O-N 3.25Å; Q120-D123 WeakPolarHBondContact O-CA 3.43Å; Q120-D123 WeakPolarHBondContact O-CB 3.25Å; Q120-D123 PolarHBondContact O-N 3.3Å; Q120-D124 PolarHBondContact O-N 2.91Å; Q120-S155 PolarHBondContact NE2-OG 2.95Å; Q120-Y158 HydrophobicContact CG-CD2 3.98Å; Q120-Y158 HydrophobicContact CG-CE2 4.01Å
121	L	95.2	Very high	90.9	Very high	10 Å²	10	43.5 Å²	43.5	5%	0.052	21%	0.205	C	C	.	.	H	α-helix	trans	-59	-39.4	174.7	-67.5	-179.8	0	0	0	111.7	V16 V66 P84 V117 A118 D123 D124 F125	V16-L121 HydrophobicContact CG1-CD1 3.99Å; V16-L121 HydrophobicContact CG2-CB 4.08Å; V16-L121 HydrophobicContact CG2-CD1 4.24Å; V66-L121 HydrophobicContact CG2-CD1 3.64Å; P84-L121 HydrophobicContact CG-CD2 4.03Å; V117-L121 PolarHBondContact O-N 3.13Å; V117-L121 VanDerWaalsContact O-N 3.08Å; A118-L121 WeakPolarHBondContact O-CB 3.22Å; A118-L121 PolarHBondContact O-N 3.18Å; L121-D123 VanDerWaalsContact C-N 3.33Å; L121-D123 PolarHBondContact O-N 2.83Å; L121-D124 PolarHBondContact O-N 2.86Å; L121-F125 HydrophobicContact CB-CE2 4.29Å; L121-F125 WeakPolarHBondContact O-CB 3.16Å; L121-F125 WeakPolarHBondContact O-CD2 3.49Å; L121-F125 VanDerWaalsContact O-CG 3.26Å; L121-F125 WeakPolarHBondContact O-CG 3.36Å; L121-F125 PolarHBondContact O-N 2.84Å
122	F	95.4	Very high	89.4	Confident	5 Å²	5	46.8 Å²	46.8	2%	0.022	22%	0.222	C	C	.	.	H	α-helix	trans	-68	-26.5	173.2	-73	-67.9	0	0	0	114.5	D14 V16 A118 L119 Q120 F125 K126 K137 C139 I175	D14-F122 HydrophobicContact CB-CD1 4.14Å; D14-F122 HydrophobicContact CB-CE1 3.84Å; V16-F122 HydrophobicContact CB-CE2 3.87Å; V16-F122 HydrophobicContact CB-CZ 3.93Å; V16-F122 HydrophobicContact CG2-CD2 4.12Å; V16-F122 HydrophobicContact CG2-CE1 4.1Å; V16-F122 HydrophobicContact CG2-CE2 3.56Å; V16-F122 HydrophobicContact CG2-CZ 3.54Å; A118-F122 WeakPolarHBondContact O-CD2 3.43Å; A118-F122 PolarHBondContact O-N 3.23Å; A118-F122 VanDerWaalsContact O-N 3.12Å; L119-F122 PolarHBondContact O-N 3.05Å; Q120-F122 VanDerWaalsContact C-N 3.28Å; Q120-F122 PolarHBondContact O-N 3.25Å; F122-F125 HydrophobicContact CD1-CD2 4Å; F122-F125 HydrophobicContact CE1-CD2 4.42Å; F122-K126 WeakPolarHBondContact O-CB 3.11Å; F122-K126 PolarHBondContact O-N 2.9Å; F122-K137 HydrophobicContact CD1-CB 4.32Å; F122-K137 HydrophobicContact CD1-CD 4.35Å; F122-K137 HydrophobicContact CD1-CG 4.44Å; F122-K137 HydrophobicContact CE1-CB 3.93Å; F122-K137 HydrophobicContact CE1-CG 4.41Å; F122-C139 HydrophobicContact CE2-CB 3.89Å; F122-C139 HydrophobicContact CZ-CB 4.12Å; F122-I175 HydrophobicContact CB-CD1 4.03Å; F122-I175 HydrophobicContact CD1-CD1 4.18Å; F122-I175 HydrophobicContact CD1-CG1 4.49Å; F122-I175 HydrophobicContact CD2-CD1 3.75Å; F122-I175 HydrophobicContact CD2-CG2 4.5Å; F122-I175 HydrophobicContact CE1-CG2 4.16Å; F122-I175 HydrophobicContact CE2-CD1 4.26Å; F122-I175 HydrophobicContact CE2-CG2 3.92Å; F122-I175 HydrophobicContact CG-CD1 3.72Å; F122-I175 HydrophobicContact CG-CG1 4.5Å; F122-I175 HydrophobicContact CZ-CG2 3.73Å
123	D	93.7	Very high	88.1	Confident	32 Å²	32	49.4 Å²	49.4	17%	0.171	25%	0.249	C	C	.	.	H	α-helix	trans	-71.4	-40.6	169	-64.8	-41.1	0	0	0	111.4	L119 Q120 L121 K126 K127 Y158 R173	L119-D123 PolarHBondContact O-N 3.44Å; L119-D123 VanDerWaalsContact O-N 3.11Å; Q120-D123 WeakPolarHBondContact O-CA 3.43Å; Q120-D123 WeakPolarHBondContact O-CB 3.25Å; Q120-D123 PolarHBondContact O-N 3.3Å; L121-D123 VanDerWaalsContact C-N 3.33Å; L121-D123 PolarHBondContact O-N 2.83Å; D123-K126 WeakPolarHBondContact O-CB 3.13Å; D123-K126 PolarHBondContact O-N 2.82Å; D123-K127 WeakPolarHBondContact O-CE 3.46Å; D123-K127 WeakPolarHBondContact O-CG 3.4Å; D123-K127 PolarHBondContact O-N 3.04Å; D123-K127 VanDerWaalsContact O-N 3.1Å; D123-Y158 VanDerWaalsContact CG-OH 3.23Å; D123-Y158 PolarHBondContact OD1-OH 3.3Å; D123-Y158 WeakPolarHBondContact OD2-CE2 3.45Å; D123-Y158 PolarHBondContact OD2-OH 3.25Å; D123-R173 IonicContact OD1-CZ 3.57Å; D123-R173 IonicContact OD1-NH1 2.71Å; D123-R173 PolarHBondContact OD1-NH1 3.11Å; D123-R173 IonicContact OD1-NH2 3.52Å
124	D	91	Very high	87.3	Confident	65 Å²	65	58.5 Å²	58.5	35%	0.348	29%	0.291	S	S	.	.	H	α-helix	trans	-71.2	-37.5	178.9	-73.9	-18.9	0	0	0	112.3	Q120 L121 K126 K127 M128	Q120-D124 PolarHBondContact O-N 2.91Å; L121-D124 PolarHBondContact O-N 2.86Å; D124-K126 VanDerWaalsContact C-N 3.32Å; D124-K126 PolarHBondContact O-N 2.84Å; D124-K127 PolarHBondContact O-N 3.04Å; D124-K127 WeakPolarHBondContact OD1-CE 3.4Å; D124-K127 IonicContact OD1-NZ 2.65Å; D124-K127 PolarHBondContact OD1-NZ 2.92Å; D124-M128 HydrophobicContact CB-CE 4.49Å; D124-M128 WeakPolarHBondContact O-CG 3.39Å; D124-M128 PolarHBondContact O-N 3.02Å
125	F	91.5	Very high	86.9	Confident	1 Å²	1	59.5 Å²	59.5	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-56.5	-45	167.3	-73.5	-40.7	0	0	0	112.2	D14 V16 Q62 P84 L121 F122 K127 M128 R129	D14-F125 HydrophobicContact CB-CB 4.49Å; D14-F125 HydrophobicContact CB-CD2 3.76Å; D14-F125 HydrophobicContact CB-CE2 4.18Å; D14-F125 HydrophobicContact CB-CG 4.16Å; D14-F125 VanDerWaalsContact OD1-CB 3.22Å; D14-F125 WeakPolarHBondContact OD1-CB 3.02Å; D14-F125 WeakPolarHBondContact OD1-CD1 3.28Å; D14-F125 WeakPolarHBondContact OD1-CG 3.48Å; V16-F125 HydrophobicContact CG2-CE2 3.72Å; Q62-F125 HydrophobicContact CB-CD1 4Å; Q62-F125 HydrophobicContact CB-CE1 3.47Å; Q62-F125 VanDerWaalsContact CB-CE1 3.47Å; Q62-F125 HydrophobicContact CB-CZ 4.07Å; Q62-F125 HydrophobicContact CG-CD1 4.49Å; Q62-F125 HydrophobicContact CG-CE1 4.26Å; P84-F125 HydrophobicContact CB-CD1 4.47Å; P84-F125 HydrophobicContact CB-CE1 3.37Å; P84-F125 HydrophobicContact CB-CZ 3.73Å; P84-F125 HydrophobicContact CG-CD1 4.44Å; P84-F125 HydrophobicContact CG-CE1 3.57Å; P84-F125 HydrophobicContact CG-CZ 3.78Å; L121-F125 HydrophobicContact CB-CE2 4.29Å; L121-F125 WeakPolarHBondContact O-CB 3.16Å; L121-F125 WeakPolarHBondContact O-CD2 3.49Å; L121-F125 VanDerWaalsContact O-CG 3.26Å; L121-F125 WeakPolarHBondContact O-CG 3.36Å; L121-F125 PolarHBondContact O-N 2.84Å; F122-F125 HydrophobicContact CD1-CD2 4Å; F122-F125 HydrophobicContact CE1-CD2 4.42Å; F125-K127 VanDerWaalsContact C-N 3.29Å; F125-K127 PolarHBondContact O-N 2.78Å; F125-M128 HydrophobicContact CD1-CE 3.7Å; F125-M128 HydrophobicContact CE1-CE 4.14Å; F125-M128 PolarHBondContact O-N 2.94Å; F125-R129 WeakPolarHBondContact O-CB 3.32Å; F125-R129 PolarHBondContact O-N 3.27Å
126	K	89.5	Confident	86.6	Confident	146 Å²	146	60.4 Å²	60.4	64%	0.635	30%	0.302	S	S	*	.	H	α-helix	trans	-60.9	-37.4	176.7	-171.2	-171	174.3	-169.3	0	112.1	F122 D123 D124 E130	F122-K126 WeakPolarHBondContact O-CB 3.11Å; F122-K126 PolarHBondContact O-N 2.9Å; D123-K126 WeakPolarHBondContact O-CB 3.13Å; D123-K126 PolarHBondContact O-N 2.82Å; D124-K126 VanDerWaalsContact C-N 3.32Å; D124-K126 PolarHBondContact O-N 2.84Å; K126-E130 PolarHBondContact O-N 3.11Å
127	K	87.4	Confident	86.5	Confident	130 Å²	130	62.6 Å²	62.6	57%	0.565	31%	0.311	S	S	*	.	H	α-helix	trans	-69.8	-47.9	175.5	-63.5	162.6	-153	164	0	111.6	D123 D124 F125 R129 E130	D123-K127 WeakPolarHBondContact O-CE 3.46Å; D123-K127 WeakPolarHBondContact O-CG 3.4Å; D123-K127 PolarHBondContact O-N 3.04Å; D123-K127 VanDerWaalsContact O-N 3.1Å; D124-K127 PolarHBondContact O-N 3.04Å; D124-K127 WeakPolarHBondContact OD1-CE 3.4Å; D124-K127 IonicContact OD1-NZ 2.65Å; D124-K127 PolarHBondContact OD1-NZ 2.92Å; F125-K127 VanDerWaalsContact C-N 3.29Å; F125-K127 PolarHBondContact O-N 2.78Å; K127-R129 PolarHBondContact O-N 3.2Å; K127-E130 PolarHBondContact O-N 3.41Å
128	M	80.3	Confident	86.6	Confident	69 Å²	69	61.9 Å²	61.9	34%	0.34	31%	0.307	S	S	.	.	H	α-helix	trans	-63.8	-28	-180	-71.4	-173.7	-71.6	0	0	112.8	Y58 P84 D124 F125	Y58-M128 HydrophobicContact CD1-CB 4.33Å; Y58-M128 HydrophobicContact CE1-CB 4.38Å; Y58-M128 HydrophobicContact CE1-CG 4.47Å; Y58-M128 HydrophobicContact CE1-SD 3.92Å; P84-M128 HydrophobicContact CB-CE 4.49Å; P84-M128 HydrophobicContact CG-CE 4.22Å; D124-M128 HydrophobicContact CB-CE 4.49Å; D124-M128 WeakPolarHBondContact O-CG 3.39Å; D124-M128 PolarHBondContact O-N 3.02Å; F125-M128 HydrophobicContact CD1-CE 3.7Å; F125-M128 HydrophobicContact CE1-CE 4.14Å; F125-M128 PolarHBondContact O-N 2.94Å
129	R	80.1	Confident	86.6	Confident	8 Å²	8	61.9 Å²	61.9	3%	0.03	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	23.6	-178.6	-67.1	-172.4	167.6	159.9	-7.1	114.5	A13 D14 Y58 G60 Q62 F125 K127 Q131 I132	A13-R129 VanDerWaalsContact C-NH1 3.26Å; A13-R129 PolarHBondContact O-NH1 3.38Å; A13-R129 PolarHBondContact O-NH2 3.39Å; D14-R129 IonicContact OD1-CZ 3.15Å; D14-R129 IonicContact OD1-NE 3.43Å; D14-R129 IonicContact OD1-NH1 2.84Å; D14-R129 PolarHBondContact OD1-NH1 2.83Å; D14-R129 IonicContact OD2-NH1 2.8Å; D14-R129 PolarHBondContact OD2-NH1 3.35Å; Y58-R129 PolarHBondContact O-NE 3.23Å; G60-R129 PolarHBondContact O-NH2 2.82Å; Q62-R129 VanDerWaalsContact CG-NH2 3.32Å; F125-R129 WeakPolarHBondContact O-CB 3.32Å; F125-R129 PolarHBondContact O-N 3.27Å; K127-R129 PolarHBondContact O-N 3.2Å; R129-Q131 PolarHBondContact O-N 3.08Å; R129-I132 HydrophobicContact CB-CB 4.16Å; R129-I132 HydrophobicContact CG-CD1 4.31Å; R129-I132 PolarHBondContact O-N 3.34Å
130	E	74.8	Confident	86.6	Confident	172 Å²	172	62 Å²	62	80%	0.804	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-22.1	-179.5	-169.8	162.8	-120.4	0	0	113.8	K126 K127	K126-E130 PolarHBondContact O-N 3.11Å; K127-E130 PolarHBondContact O-N 3.41Å
131	Q	59.5	Low	86.8	Confident	196 Å²	196	59.3 Å²	59.3	92%	0.916	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-9.8	175.4	-62.9	-177.9	-7.6	0	0	115.1	R129	R129-Q131 PolarHBondContact O-N 3.08Å
132	I	66.3	Low	86.9	Confident	70 Å²	70	58.9 Å²	58.9	36%	0.359	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	-16.6	-164.1	-59.8	-176.1	0	0	0	112.9	V12 Y58 R129	V12-I132 HydrophobicContact CG1-CG2 4.45Å; Y58-I132 VanDerWaalsContact C-CD1 3.49Å; R129-I132 HydrophobicContact CB-CB 4.16Å; R129-I132 HydrophobicContact CG-CD1 4.31Å; R129-I132 PolarHBondContact O-N 3.34Å
133	G	69.3	Low	86.9	Confident	59 Å²	59	58.7 Å²	58.7	61%	0.608	29%	0.292	S	S	*	.			trans	94.9	-143.1	170.6	0	0	0	0	0	114.6
134	Q	78.8	Confident	87	Confident	193 Å²	193	57.3 Å²	57.3	90%	0.902	28%	0.284	S	S	*	.			trans	-82.2	129.5	-179.4	-75.6	-168.3	-7.5	0	0	111.8
135	T	88.5	Confident	87.2	Confident	20 Å²	20	54.3 Å²	54.3	12%	0.123	27%	0.268	C	S	.	.			trans	-111.9	153.8	179.5	55.7	0	0	0	0	111.4	V12 D14 K137	V12-T135 HydrophobicContact CB-CG2 4.48Å; V12-T135 HydrophobicContact CG1-CG2 4.17Å; V12-T135 CarbonylContact O-C 3.55Å; V12-T135 VanDerWaalsContact O-CA 3.29Å; V12-T135 WeakPolarHBondContact O-CA 3.41Å; V12-T135 WeakPolarHBondContact O-CB 3.27Å; D14-T135 VanDerWaalsContact OD2-CB 3.24Å; D14-T135 WeakPolarHBondContact OD2-CB 3.45Å; D14-T135 PolarHBondContact OD2-OG1 3.47Å; T135-K137 PolarHBondContact O-N 2.79Å; T135-K137 WeakPolarHBondContact OG1-CE 3.4Å
136	H	92.4	Very high	87.4	Confident	20 Å²	20	55.8 Å²	55.8	9%	0.093	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	110.8	172.6	177.5	-134.8	0	0	0	109.5	Q11 V12 A13 D14 F44 H176 G220	Q11-H136 HydrophobicContact CG-CB 3.99Å; V12-H136 PolarHBondContact O-N 3.25Å; A13-H136 CarbonylContact C-O 3.58Å; A13-H136 WeakPolarHBondContact CA-O 3.37Å; A13-H136 HydrophobicContact CB-CB 4.35Å; D14-H136 PolarHBondContact N-O 3.29Å; F44-H136 AromaticContact CE1-CE1 3.89Å; F44-H136 AromaticContact CE1-ND1 3.86Å; H136-H176 AromaticContact CD2-CD2 3.63Å; H136-H176 AromaticContact CD2-NE2 3.84Å; H136-H176 AromaticContact NE2-CD2 3.44Å; H136-H176 PolarHBondContact NE2-CD2 3.27Å; H136-H176 AromaticContact NE2-NE2 3.85Å; H136-G220 PolarHBondContact CE1-O 3.42Å
137	K	95.6	Very high	87.6	Confident	46 Å²	46	49.6 Å²	49.6	20%	0.2	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125	-168.9	-60.1	-179.7	-178.1	176.8	0	111.2	D14 F122 T135 I175 H176	D14-K137 HydrophobicContact CB-CG 4.17Å; D14-K137 CarbonylContact O-C 3.52Å; D14-K137 WeakPolarHBondContact O-CA 3.41Å; F122-K137 HydrophobicContact CD1-CB 4.32Å; F122-K137 HydrophobicContact CD1-CD 4.35Å; F122-K137 HydrophobicContact CD1-CG 4.44Å; F122-K137 HydrophobicContact CE1-CB 3.93Å; F122-K137 HydrophobicContact CE1-CG 4.41Å; T135-K137 PolarHBondContact O-N 2.79Å; T135-K137 WeakPolarHBondContact OG1-CE 3.4Å; K137-I175 HydrophobicContact CB-CB 4.2Å; K137-I175 HydrophobicContact CB-CG1 3.89Å; K137-I175 HydrophobicContact CB-CG2 4.09Å; K137-I175 HydrophobicContact CD-CG1 4.07Å; K137-H176 PolarHBondContact O-N 3.45Å
138	V	97.6	Very high	87.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	124.4	-174.5	-170.2	0	0	0	0	111.4	D14 V15 V16 F44 V140 H176 I221	D14-V138 PolarHBondContact O-N 3.07Å; V15-V138 WeakPolarHBondContact CA-O 3.41Å; V16-V138 PolarHBondContact N-O 3.4Å; F44-V138 HydrophobicContact CE1-CG2 4.04Å; F44-V138 HydrophobicContact CZ-CB 3.92Å; F44-V138 HydrophobicContact CZ-CG1 4.1Å; F44-V138 HydrophobicContact CZ-CG2 3.74Å; V138-V140 HydrophobicContact CG1-CG2 4.05Å; V138-H176 CarbonylContact C-O 3.55Å; V138-H176 WeakPolarHBondContact CA-O 3.41Å; V138-H176 HydrophobicContact CG2-CB 4.34Å; V138-I221 HydrophobicContact CG1-CD1 4.01Å; V138-I221 HydrophobicContact CG1-CG1 3.82Å
139	C	98.4	Very high	88.2	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.5	177.8	-176.5	0	0	0	0	109.4	V16 F122 I175 H176 F177 S178	V16-C139 CarbonylContact O-C 3.56Å; V16-C139 WeakPolarHBondContact O-CA 3.5Å; F122-C139 HydrophobicContact CE2-CB 3.89Å; F122-C139 HydrophobicContact CZ-CB 4.12Å; C139-I175 HydrophobicContact CB-CG2 3.91Å; C139-H176 PolarHBondContact N-O 3.38Å; C139-F177 HydrophobicContact CB-CD2 4.12Å; C139-F177 CarbonylContact O-C 3.6Å; C139-F177 WeakPolarHBondContact O-CA 3.06Å; C139-S178 PolarHBondContact O-N 3.08Å
140	V	98.4	Very high	88.7	Confident	4 Å²	4	47.2 Å²	47.2	2%	0.024	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	106.8	-172	-167.6	0	0	0	0	110.1	V16 F17 V18 V138 L142 S178 I221	V16-V140 PolarHBondContact O-N 3.32Å; F17-V140 WeakPolarHBondContact CA-O 3.47Å; F17-V140 HydrophobicContact CD1-CB 3.8Å; F17-V140 HydrophobicContact CD1-CG1 3.95Å; F17-V140 HydrophobicContact CD1-CG2 4.38Å; F17-V140 HydrophobicContact CE1-CB 3.97Å; F17-V140 HydrophobicContact CE1-CG1 3.86Å; F17-V140 HydrophobicContact CE1-CG2 4.17Å; F17-V140 HydrophobicContact CE2-CG2 4.45Å; F17-V140 HydrophobicContact CG-CB 4.18Å; F17-V140 HydrophobicContact CZ-CB 4.5Å; F17-V140 HydrophobicContact CZ-CG2 4.23Å; V18-V140 PolarHBondContact N-O 2.9Å; V138-V140 HydrophobicContact CG1-CG2 4.05Å; V140-L142 HydrophobicContact CG1-CD1 3.89Å; V140-S178 WeakPolarHBondContact CA-O 3.48Å; V140-I221 HydrophobicContact CG2-CD1 3.75Å
141	L	98.6	Very high	89.5	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120.1	178.5	176.1	63.2	0	0	0	110.8	V18 F68 I111 F177 S178 V179 V180 L188 L191	V18-L141 HydrophobicContact CB-CD1 4.24Å; V18-L141 HydrophobicContact CG1-CD1 4.1Å; V18-L141 CarbonylContact O-C 3.54Å; V18-L141 WeakPolarHBondContact O-CA 3.46Å; F68-L141 HydrophobicContact CE1-CD1 3.8Å; F68-L141 HydrophobicContact CZ-CD1 3.87Å; I111-L141 HydrophobicContact CD1-CD2 4.4Å; I111-L141 HydrophobicContact CG2-CD1 4.31Å; I111-L141 HydrophobicContact CG2-CD2 3.99Å; L141-F177 HydrophobicContact CB-CE2 3.94Å; L141-F177 HydrophobicContact CB-CZ 3.87Å; L141-F177 HydrophobicContact CD2-CZ 3.81Å; L141-F177 HydrophobicContact CG-CZ 4.5Å; L141-S178 PolarHBondContact N-O 3.35Å; L141-V179 HydrophobicContact CB-CG2 4.47Å; L141-V179 WeakPolarHBondContact O-CA 3.48Å; L141-V180 PolarHBondContact O-N 2.93Å; L141-L188 HydrophobicContact CD2-CD2 4.42Å; L141-L191 HydrophobicContact CD2-CD1 4.39Å
142	L	98.1	Very high	91.1	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	120	168.7	-93.1	78.2	0	0	0	110.9	F17 V18 I19 E20 L25 F29 L32 I37 V140 V180	F17-L142 HydrophobicContact CD1-CD1 4.41Å; V18-L142 PolarHBondContact O-N 2.85Å; I19-L142 CarbonylContact C-O 3.56Å; I19-L142 WeakPolarHBondContact CA-O 3.39Å; I19-L142 HydrophobicContact CB-CB 4.47Å; I19-L142 HydrophobicContact CG1-CB 4.28Å; I19-L142 HydrophobicContact CG2-CB 4.23Å; E20-L142 PolarHBondContact N-O 3.13Å; L25-L142 HydrophobicContact CD2-CB 4.38Å; F29-L142 HydrophobicContact CE2-CD2 4.45Å; L32-L142 HydrophobicContact CB-CD2 4.24Å; I37-L142 HydrophobicContact CD1-CD2 3.37Å; I37-L142 HydrophobicContact CG1-CD1 4.47Å; I37-L142 HydrophobicContact CG1-CD2 3.63Å; V140-L142 HydrophobicContact CG1-CD1 3.89Å; L142-V180 WeakPolarHBondContact CA-O 3.34Å; L142-V180 HydrophobicContact CD1-CB 3.83Å; L142-V180 HydrophobicContact CD1-CG1 4.36Å; L142-V180 HydrophobicContact CD1-CG2 4.42Å; L142-V180 HydrophobicContact CG-CB 3.95Å; L142-V180 HydrophobicContact CG-CG1 4.13Å
143	C	96.1	Very high	92.2	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.166	C	C	.	.			trans	-158.5	159.4	178.2	47	0	0	0	0	113	E20 F68 V180 A181 P182 L188	E20-C143 HydrophobicContact CB-CB 3.88Å; E20-C143 WeakPolarHBondContact OE2-CA 3.37Å; E20-C143 WeakPolarHBondContact OE2-CB 3.39Å; F68-C143 HydrophobicContact CZ-CB 4.1Å; C143-V180 PolarHBondContact N-O 2.91Å; C143-A181 WeakPolarHBondContact O-CA 3.35Å; C143-A181 WeakPolarHBondContact O-CB 3.4Å; C143-P182 WeakPolarHBondContact O-CD 3.49Å; C143-L188 WeakPolarHBondContact SG-CD1 3.03Å
144	N	95.8	Very high	92.8	Very high	3 Å²	3	30 Å²	30	2%	0.016	15%	0.153	C	C	.	.	S	Bend	trans	-115.8	-0.9	172.3	-166.6	18.7	0	0	0	112.1	E20 N24 L25 Y28 P182 R183	E20-N144 PolarHBondContact OE2-N 3.25Å; N24-N144 PolarHBondContact O-ND2 3.06Å; N24-N144 PolarHBondContact OD1-ND2 2.92Å; N24-N144 VanDerWaalsContact OD1-ND2 3.14Å; L25-N144 HydrophobicContact CD1-CB 4.06Å; Y28-N144 WeakPolarHBondContact CE2-ND2 3.32Å; N144-P182 HydrophobicContact CB-CG 3.91Å; N144-P182 WeakPolarHBondContact OD1-CG 3.37Å; N144-R183 PolarHBondContact O-NE 3.07Å; N144-R183 PolarHBondContact O-NH2 3.36Å; N144-R183 WeakPolarHBondContact OD1-CD 3.49Å; N144-R183 WeakPolarHBondContact OD1-CG 3.33Å; N144-R183 PolarHBondContact OD1-NE 3.23Å
145	S	94.4	Very high	93.1	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.014	11%	0.11	C	C	.	.	S	Bend	trans	-119.4	146.5	-177.8	-50.3	0	0	0	0	111.6	E20 N24 S109	E20-S145 WeakPolarHBondContact OE1-CB 3.39Å; E20-S145 PolarHBondContact OE1-OG 3.08Å; E20-S145 PolarHBondContact OE2-N 3.19Å; E20-S145 PolarHBondContact OE2-OG 3.01Å; N24-S145 PolarHBondContact ND2-OG 2.94Å; S109-S145 WeakPolarHBondContact OG-CB 3.41Å
146	P	94.7	Very high	92.9	Very high	33 Å²	33	26 Å²	26	21%	0.214	14%	0.142	C	C	.	.	P	Polyproline II helix	trans	-65.4	160.7	167	29.3	-36.3	0	0	0	112	S107 C108 S109 A187	S107-P146 VanDerWaalsContact O-CD 3.25Å; S107-P146 WeakPolarHBondContact O-CD 3.47Å; S107-P146 WeakPolarHBondContact O-CG 3.46Å; C108-P146 CarbonylContact C-O 3.49Å; C108-P146 VanDerWaalsContact CA-O 3.26Å; C108-P146 WeakPolarHBondContact CA-O 3.1Å; S109-P146 PolarHBondContact N-O 3.26Å; P146-A187 HydrophobicContact CB-CB 4Å
147	P	94.8	Very high	92.8	Very high	16 Å²	16	28.8 Å²	28.8	10%	0.104	16%	0.164	C	C	.	.	B	Isolated β-bridge	trans	-67.4	142.1	175.4	29.1	-35.3	0	0	0	111.2	I111 A163 L191	I111-P147 HydrophobicContact CB-CB 4.05Å; I111-P147 HydrophobicContact CD1-CB 4.03Å; I111-P147 HydrophobicContact CG1-CB 4.38Å; P147-A163 HydrophobicContact CB-CB 4.01Å; P147-L191 HydrophobicContact CG-CD1 4.29Å
148	Y	91.4	Very high	92.8	Very high	20 Å²	20	27.1 Å²	27.1	8%	0.078	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-59.9	142.8	158.4	-76.3	-75.6	0	0	0	110.4	V71 E106 C108 S109 L110 L150 L654	V71-Y148 HydrophobicContact CG1-CE2 4.43Å; E106-Y148 WeakPolarHBondContact CB-OH 3.16Å; E106-Y148 PolarHBondContact OE2-OH 3.23Å; E106-Y148 VanDerWaalsContact OE2-OH 3.12Å; C108-Y148 HydrophobicContact CB-CD1 3.58Å; C108-Y148 HydrophobicContact CB-CD2 3.96Å; C108-Y148 HydrophobicContact CB-CE1 3.69Å; C108-Y148 HydrophobicContact CB-CE2 4.06Å; C108-Y148 HydrophobicContact CB-CG 3.72Å; C108-Y148 WeakPolarHBondContact O-CE2 3.43Å; C108-Y148 PolarHBondContact O-OH 2.9Å; S109-Y148 VanDerWaalsContact C-CD2 3.44Å; S109-Y148 WeakPolarHBondContact O-CD2 3.48Å; S109-Y148 PolarHBondContact O-N 3.45Å; S109-Y148 VanDerWaalsContact O-N 3.12Å; L110-Y148 HydrophobicContact CD2-CD2 3.69Å; L110-Y148 HydrophobicContact CD2-CE2 4.16Å; L110-Y148 HydrophobicContact CD2-CG 4.49Å; L110-Y148 HydrophobicContact CG-CD2 3.98Å; L110-Y148 HydrophobicContact CG-CE2 4.13Å; Y148-L150 HydrophobicContact CD1-CD1 4.21Å; Y148-L150 HydrophobicContact CG-CD1 3.99Å; Y148-L150 PolarHBondContact O-N 3.47Å; Y148-L654 HydrophobicContact CD1-CD2 3.93Å; Y148-L654 HydrophobicContact CE1-CD1 4.46Å; Y148-L654 HydrophobicContact CE1-CD2 3.91Å
149	L	89.3	Confident	92.6	Very high	131 Å²	131	31 Å²	31	69%	0.686	18%	0.18	S	C	*	.	S	Bend	trans	-76.8	54.3	167.9	-60.8	-178.9	0	0	0	111
150	L	89.5	Confident	92.4	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.031	21%	0.206	C	C	.	.			trans	-124.3	144.8	-179.7	-64.7	172.1	0	0	0	109.4	L110 A112 Y148 L650 L653 L654	L110-L150 HydrophobicContact CD2-CD1 4.44Å; A112-L150 WeakPolarHBondContact CB-O 3.34Å; Y148-L150 HydrophobicContact CD1-CD1 4.21Å; Y148-L150 HydrophobicContact CG-CD1 3.99Å; Y148-L150 PolarHBondContact O-N 3.47Å; L150-L650 HydrophobicContact CB-CD2 4.34Å; L150-L650 HydrophobicContact CD1-CD2 3.88Å; L150-L653 HydrophobicContact CD2-CB 3.64Å; L150-L654 HydrophobicContact CD1-CD1 4.45Å; L150-L654 HydrophobicContact CD1-CD2 3.89Å; L150-L654 HydrophobicContact CD1-CG 3.86Å
151	P	92.3	Very high	92.3	Very high	35 Å²	35	37.1 Å²	37.1	23%	0.227	22%	0.221	C	C	.	.			trans	-72	154	165.6	32.5	-34.2	0	0	0	110.6	G160 F161 L653	P151-G160 VanDerWaalsContact CB-C 3.44Å; P151-G160 WeakPolarHBondContact CB-O 3.48Å; P151-F161 WeakPolarHBondContact CA-O 3.32Å; P151-L653 HydrophobicContact CG-CD1 4.33Å
152	A	92.9	Very high	92.2	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.232	C	C	.	.			trans	-64.8	142.2	166.2	0	0	0	0	0	111.1	A112 E113 S116 T159 G160 F161	A112-A152 HydrophobicContact CB-CB 4.37Å; E113-A152 WeakPolarHBondContact OE1-CA 3.3Å; E113-A152 WeakPolarHBondContact OE2-CA 3.45Å; E113-A152 WeakPolarHBondContact OE2-CB 3.47Å; S116-A152 WeakPolarHBondContact OG-CB 3.49Å; A152-T159 CarbonylContact O-C 3.58Å; A152-T159 WeakPolarHBondContact O-CA 3.34Å; A152-G160 PolarHBondContact O-N 2.79Å; A152-F161 PolarHBondContact N-O 3.28Å
153	V	89.7	Confident	92.1	Very high	28 Å²	28	39 Å²	39	17%	0.17	23%	0.233	C	C	.	.			trans	-126.4	-23.2	178.2	-50.9	0	0	0	0	113.8	E113 L650	E113-V153 VanDerWaalsContact CD-N 3.29Å; E113-V153 PolarHBondContact OE1-N 3.27Å; E113-V153 PolarHBondContact OE2-N 3.1Å; V153-L650 HydrophobicContact CG1-CD2 4.41Å; V153-L650 HydrophobicContact CG1-CG 4.42Å; V153-L650 HydrophobicContact CG2-CD1 3.78Å; V153-L650 HydrophobicContact CG2-CD2 4.37Å; V153-L650 HydrophobicContact CG2-CG 3.69Å
154	E	82.3	Confident	92.2	Very high	71 Å²	71	41 Å²	41	33%	0.332	24%	0.244	S	C	.	.	S	Bend	trans	-80.3	-30.4	-178	-58.9	-161.9	139.5	0	0	112.2	Y78 E113 V156	Y78-E154 WeakPolarHBondContact CD2-OE1 3.3Å; E113-E154 PolarHBondContact OE2-N 3.03Å; E154-V156 PolarHBondContact O-N 3.32Å
155	S	84.4	Confident	92.2	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	26%	0.258	C	S	.	.			trans	-78.6	108.4	-180	179.8	0	0	0	0	112.3	S116 Q120 S157 Y158 T159	S116-S155 PolarHBondContact O-OG 3.1Å; S116-S155 WeakPolarHBondContact OG-CB 3.39Å; Q120-S155 PolarHBondContact NE2-OG 2.95Å; S155-S157 VanDerWaalsContact C-N 3.34Å; S155-S157 PolarHBondContact O-N 2.98Å; S155-Y158 CarbonylContact O-C 3.59Å; S155-Y158 PolarHBondContact O-N 3.04Å; S155-T159 WeakPolarHBondContact O-CA 2.98Å; S155-T159 WeakPolarHBondContact O-CB 3.45Å; S155-T159 PolarHBondContact O-N 3.02Å
156	V	84.3	Confident	92.4	Very high	129 Å²	129	43.6 Å²	43.6	78%	0.782	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-55.5	-46.1	179.6	-178.2	0	0	0	0	112.3	E154 Y158	E154-V156 PolarHBondContact O-N 3.32Å; V156-Y158 VanDerWaalsContact C-N 3.34Å; V156-Y158 PolarHBondContact O-N 3.24Å
157	S	90.1	Very high	92.6	Very high	79 Å²	79	42 Å²	42	55%	0.552	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-75.7	-18.3	-177	-55.4	0	0	0	0	114.5	S155	S155-S157 VanDerWaalsContact C-N 3.34Å; S155-S157 PolarHBondContact O-N 2.98Å
158	Y	94.9	Very high	92.7	Very high	12 Å²	12	44.3 Å²	44.3	5%	0.047	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-132.5	23.1	-172.6	-59.1	-79.9	0	0	0	113	S116 L119 Q120 D123 S155 V156 F161 L166 I169 R173	S116-Y158 VanDerWaalsContact O-CD2 3.31Å; S116-Y158 WeakPolarHBondContact O-CD2 3.46Å; L119-Y158 HydrophobicContact CB-CD1 4.34Å; L119-Y158 HydrophobicContact CB-CD2 3.98Å; L119-Y158 HydrophobicContact CB-CE1 4.02Å; L119-Y158 HydrophobicContact CB-CE2 3.64Å; L119-Y158 HydrophobicContact CB-CG 4.34Å; L119-Y158 HydrophobicContact CD1-CD1 4.09Å; L119-Y158 HydrophobicContact CD1-CE1 4.08Å; Q120-Y158 HydrophobicContact CG-CD2 3.98Å; Q120-Y158 HydrophobicContact CG-CE2 4.01Å; D123-Y158 VanDerWaalsContact CG-OH 3.23Å; D123-Y158 PolarHBondContact OD1-OH 3.3Å; D123-Y158 WeakPolarHBondContact OD2-CE2 3.45Å; D123-Y158 PolarHBondContact OD2-OH 3.25Å; S155-Y158 CarbonylContact O-C 3.59Å; S155-Y158 PolarHBondContact O-N 3.04Å; V156-Y158 VanDerWaalsContact C-N 3.34Å; V156-Y158 PolarHBondContact O-N 3.24Å; Y158-F161 HydrophobicContact CD1-CD2 4.48Å; Y158-F161 WeakPolarHBondContact O-CD2 3.49Å; Y158-L166 HydrophobicContact CD1-CD2 4.36Å; Y158-L166 HydrophobicContact CG-CD2 4.4Å; Y158-I169 HydrophobicContact CD1-CD1 4.49Å; Y158-I169 HydrophobicContact CE1-CG2 4.29Å; Y158-R173 PolarHBondContact OH-NH1 2.88Å; Y158-R173 PolarHBondContact OH-NH2 3.02Å
159	T	94.1	Very high	93	Very high	81 Å²	81	44.9 Å²	44.9	50%	0.497	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	144.8	175.5	-169.7	0	0	0	0	110.8	A152 S155 F161	A152-T159 CarbonylContact O-C 3.58Å; A152-T159 WeakPolarHBondContact O-CA 3.34Å; S155-T159 WeakPolarHBondContact O-CA 2.98Å; S155-T159 WeakPolarHBondContact O-CB 3.45Å; S155-T159 PolarHBondContact O-N 3.02Å; T159-F161 VanDerWaalsContact C-N 3.29Å; T159-F161 PolarHBondContact O-N 2.89Å
160	G	93.4	Very high	93.4	Very high	52 Å²	52	38.7 Å²	38.7	54%	0.536	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	-8.5	179.8	0	0	0	0	0	115.4	P151 A152	P151-G160 VanDerWaalsContact CB-C 3.44Å; P151-G160 WeakPolarHBondContact CB-O 3.48Å; A152-G160 PolarHBondContact O-N 2.79Å
161	F	96.6	Very high	93.6	Very high	80 Å²	80	41.3 Å²	41.3	35%	0.351	24%	0.236	S	C	.	.			trans	-89.9	131.5	177	-66.4	-68.6	0	0	0	112.5	P151 A152 Y158 T159 N165 L166 I169	P151-F161 WeakPolarHBondContact CA-O 3.32Å; A152-F161 PolarHBondContact N-O 3.28Å; Y158-F161 HydrophobicContact CD1-CD2 4.48Å; Y158-F161 WeakPolarHBondContact O-CD2 3.49Å; T159-F161 VanDerWaalsContact C-N 3.29Å; T159-F161 PolarHBondContact O-N 2.89Å; F161-N165 HydrophobicContact CB-CB 4.2Å; F161-N165 HydrophobicContact CD1-CB 3.8Å; F161-N165 HydrophobicContact CG-CB 4.44Å; F161-L166 HydrophobicContact CB-CD2 3.79Å; F161-L166 HydrophobicContact CB-CG 3.88Å; F161-I169 HydrophobicContact CD1-CD1 4.19Å; F161-I169 HydrophobicContact CD2-CD1 4.22Å; F161-I169 HydrophobicContact CE1-CD1 4.17Å; F161-I169 HydrophobicContact CE2-CD1 4.21Å; F161-I169 HydrophobicContact CG-CD1 4.22Å; F161-I169 HydrophobicContact CZ-CD1 4.18Å
162	T	96.7	Very high	93.8	Very high	39 Å²	39	44.9 Å²	44.9	24%	0.239	25%	0.254	C	S	.	.			trans	-75.7	164	168.4	57	0	0	0	0	111.4	D164 N165 L166	T162-D164 PolarHBondContact O-N 2.89Å; T162-N165 PolarHBondContact O-N 3.05Å; T162-L166 WeakPolarHBondContact O-CG 3.41Å; T162-L166 PolarHBondContact O-N 3.44Å
163	A	97.3	Very high	93.8	Very high	1 Å²	1	49.9 Å²	49.9	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-49.2	-45.2	174.7	0	0	0	0	0	112.4	I111 P147 N165 L166 V167 L191	I111-A163 HydrophobicContact CG2-CB 4.21Å; P147-A163 HydrophobicContact CB-CB 4.01Å; A163-N165 PolarHBondContact O-N 3.32Å; A163-L166 PolarHBondContact O-N 3.22Å; A163-L166 VanDerWaalsContact O-N 3.14Å; A163-V167 WeakPolarHBondContact O-CG2 3.25Å; A163-V167 PolarHBondContact O-N 2.68Å; A163-L191 HydrophobicContact CB-CD1 4.41Å; A163-L191 HydrophobicContact CB-CD2 3.87Å
164	D	96.8	Very high	94	Very high	44 Å²	44	51.1 Å²	51.1	24%	0.235	29%	0.291	C	S	.	.	H	α-helix	trans	-54.7	-35.6	176.2	-50.1	16.8	0	0	0	113.2	T162 V167 K168 W194	T162-D164 PolarHBondContact O-N 2.89Å; D164-V167 WeakPolarHBondContact O-CG2 3.2Å; D164-K168 WeakPolarHBondContact O-CD 3.46Å; D164-K168 WeakPolarHBondContact O-CE 3.5Å; D164-K168 VanDerWaalsContact O-CG 3.26Å; D164-K168 WeakPolarHBondContact O-CG 3.31Å; D164-K168 PolarHBondContact O-NZ 3.49Å; D164-W194 HydrophobicContact CB-CE3 3.98Å; D164-W194 HydrophobicContact CB-CH2 4.41Å; D164-W194 HydrophobicContact CB-CZ3 3.75Å; D164-W194 WeakPolarHBondContact OD1-CZ3 3.47Å; D164-W194 WeakPolarHBondContact OD2-CH2 3.46Å; D164-W194 WeakPolarHBondContact OD2-CZ3 3.42Å
165	N	97.1	Very high	94.7	Very high	58 Å²	58	48.1 Å²	48.1	31%	0.31	28%	0.277	S	S	.	.	H	α-helix	trans	-84.4	-36	179.9	-67.5	-15	0	0	0	111.1	F161 T162 A163 K168 I169	F161-N165 HydrophobicContact CB-CB 4.2Å; F161-N165 HydrophobicContact CD1-CB 3.8Å; F161-N165 HydrophobicContact CG-CB 4.44Å; T162-N165 PolarHBondContact O-N 3.05Å; A163-N165 PolarHBondContact O-N 3.32Å; N165-K168 PolarHBondContact O-N 3.44Å; N165-K168 PolarHBondContact OD1-NZ 2.98Å; N165-I169 WeakPolarHBondContact O-CG1 3.38Å; N165-I169 PolarHBondContact O-N 2.78Å
166	L	98.3	Very high	95.2	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64	-40.6	175.7	-63.2	162.4	0	0	0	111.4	A112 L115 L119 Y158 F161 T162 A163 K168 I169 I170	A112-L166 HydrophobicContact CB-CD1 4.23Å; A112-L166 WeakPolarHBondContact O-CD1 3.48Å; L115-L166 HydrophobicContact CB-CB 4.04Å; L115-L166 HydrophobicContact CB-CD1 4.08Å; L115-L166 HydrophobicContact CD1-CB 4.45Å; L119-L166 HydrophobicContact CD1-CB 4.29Å; L119-L166 HydrophobicContact CD1-CD2 3.79Å; Y158-L166 HydrophobicContact CD1-CD2 4.36Å; Y158-L166 HydrophobicContact CG-CD2 4.4Å; F161-L166 HydrophobicContact CB-CD2 3.79Å; F161-L166 HydrophobicContact CB-CG 3.88Å; T162-L166 WeakPolarHBondContact O-CG 3.41Å; T162-L166 PolarHBondContact O-N 3.44Å; A163-L166 PolarHBondContact O-N 3.22Å; A163-L166 VanDerWaalsContact O-N 3.14Å; L166-K168 VanDerWaalsContact C-N 3.34Å; L166-K168 PolarHBondContact O-N 3.11Å; L166-I169 WeakPolarHBondContact O-CB 3.4Å; L166-I169 PolarHBondContact O-N 3.43Å; L166-I170 WeakPolarHBondContact O-CG1 3.45Å; L166-I170 PolarHBondContact O-N 3.01Å
167	V	97.9	Very high	95.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-68.5	-29.5	175.7	-62.8	0	0	0	0	113.8	L115 A163 D164 I170 R171 F177 L191 W194 A195	L115-V167 HydrophobicContact CD1-CG1 3.73Å; A163-V167 WeakPolarHBondContact O-CG2 3.25Å; A163-V167 PolarHBondContact O-N 2.68Å; D164-V167 WeakPolarHBondContact O-CG2 3.2Å; V167-I170 PolarHBondContact O-N 2.98Å; V167-R171 PolarHBondContact O-N 3.33Å; V167-R171 VanDerWaalsContact O-N 3.08Å; V167-F177 HydrophobicContact CG1-CD1 4.34Å; V167-F177 HydrophobicContact CG1-CE1 3.86Å; V167-F177 HydrophobicContact CG1-CE2 4.45Å; V167-F177 HydrophobicContact CG1-CZ 3.92Å; V167-L191 HydrophobicContact CG1-CB 4.19Å; V167-L191 HydrophobicContact CG1-CD2 4.03Å; V167-L191 HydrophobicContact CG2-CD2 3.98Å; V167-W194 HydrophobicContact CG2-CB 3.82Å; V167-W194 HydrophobicContact CG2-CE3 4.36Å; V167-A195 HydrophobicContact CB-CB 4.29Å
168	K	97	Very high	96.2	Very high	64 Å²	64	41.6 Å²	41.6	28%	0.278	23%	0.229	S	C	.	.	H	α-helix	trans	-66.7	-44.2	169.7	-64.8	160.5	-158.2	149.1	0	110.4	D164 N165 L166 I170 R171 D172	D164-K168 WeakPolarHBondContact O-CD 3.46Å; D164-K168 WeakPolarHBondContact O-CE 3.5Å; D164-K168 VanDerWaalsContact O-CG 3.26Å; D164-K168 WeakPolarHBondContact O-CG 3.31Å; D164-K168 PolarHBondContact O-NZ 3.49Å; N165-K168 PolarHBondContact O-N 3.44Å; N165-K168 PolarHBondContact OD1-NZ 2.98Å; L166-K168 VanDerWaalsContact C-N 3.34Å; L166-K168 PolarHBondContact O-N 3.11Å; K168-I170 VanDerWaalsContact C-N 3.32Å; K168-I170 PolarHBondContact O-N 3.41Å; K168-R171 WeakPolarHBondContact O-CB 3.39Å; K168-R171 PolarHBondContact O-N 2.93Å; K168-D172 WeakPolarHBondContact O-CB 3.26Å; K168-D172 PolarHBondContact O-N 2.86Å
169	I	97.4	Very high	96.4	Very high	33 Å²	33	41 Å²	41	17%	0.169	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-38.1	175.3	-65.8	164.1	0	0	0	111.6	L119 Y158 F161 N165 L166 R173	L119-I169 HydrophobicContact CD1-CB 4.09Å; L119-I169 HydrophobicContact CD1-CG2 3.75Å; L119-I169 HydrophobicContact CD2-CG2 4.01Å; Y158-I169 HydrophobicContact CD1-CD1 4.49Å; Y158-I169 HydrophobicContact CE1-CG2 4.29Å; F161-I169 HydrophobicContact CD1-CD1 4.19Å; F161-I169 HydrophobicContact CD2-CD1 4.22Å; F161-I169 HydrophobicContact CE1-CD1 4.17Å; F161-I169 HydrophobicContact CE2-CD1 4.21Å; F161-I169 HydrophobicContact CG-CD1 4.22Å; F161-I169 HydrophobicContact CZ-CD1 4.18Å; N165-I169 WeakPolarHBondContact O-CG1 3.38Å; N165-I169 PolarHBondContact O-N 2.78Å; L166-I169 WeakPolarHBondContact O-CB 3.4Å; L166-I169 PolarHBondContact O-N 3.43Å; I169-R173 HydrophobicContact CG2-CG 4.47Å; I169-R173 WeakPolarHBondContact O-CB 3.2Å; I169-R173 WeakPolarHBondContact O-CD 3.36Å; I169-R173 WeakPolarHBondContact O-CG 3.44Å; I169-R173 PolarHBondContact O-N 3.43Å; I169-R173 VanDerWaalsContact O-N 3.15Å
170	I	97.4	Very high	96.5	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-59.1	-52.8	173.4	-73.9	170	0	0	0	110.4	L115 L119 L166 V167 K168 R173 I175 F177	L115-I170 HydrophobicContact CD2-CD1 4.11Å; L119-I170 HydrophobicContact CD1-CG1 4.21Å; L119-I170 HydrophobicContact CD2-CG1 3.78Å; L119-I170 HydrophobicContact CG-CG1 4.01Å; L166-I170 WeakPolarHBondContact O-CG1 3.45Å; L166-I170 PolarHBondContact O-N 3.01Å; V167-I170 PolarHBondContact O-N 2.98Å; K168-I170 VanDerWaalsContact C-N 3.32Å; K168-I170 PolarHBondContact O-N 3.41Å; I170-R173 PolarHBondContact O-N 2.89Å; I170-I175 HydrophobicContact CG2-CB 3.8Å; I170-I175 HydrophobicContact CG2-CG2 3.9Å; I170-I175 WeakPolarHBondContact CG2-O 3.36Å; I170-I175 WeakPolarHBondContact O-CB 3.25Å; I170-I175 PolarHBondContact O-N 2.86Å; I170-F177 HydrophobicContact CD1-CD2 4.23Å; I170-F177 HydrophobicContact CD1-CE2 4.41Å; I170-F177 HydrophobicContact CG2-CB 3.96Å; I170-F177 HydrophobicContact CG2-CD2 4.33Å; I170-F177 HydrophobicContact CG2-CG 4.43Å
171	R	95.5	Very high	96.7	Very high	60 Å²	60	34.9 Å²	34.9	23%	0.226	18%	0.179	C	C	.	.	H	α-helix	trans	-58.4	-50.5	176	177.9	-162.2	68.4	-153.6	1.1	112.7	V167 K168 R173 G174 W194 A195 S196	V167-R171 PolarHBondContact O-N 3.33Å; V167-R171 VanDerWaalsContact O-N 3.08Å; K168-R171 WeakPolarHBondContact O-CB 3.39Å; K168-R171 PolarHBondContact O-N 2.93Å; R171-R173 PolarHBondContact O-N 3.44Å; R171-R173 VanDerWaalsContact O-N 3.15Å; R171-G174 PolarHBondContact O-N 2.82Å; R171-W194 PolarHBondContact NH1-O 2.85Å; R171-A195 WeakPolarHBondContact CG-O 3.29Å; R171-S196 WeakPolarHBondContact CD-O 3.32Å
172	D	95.5	Very high	96.7	Very high	111 Å²	111	31.4 Å²	31.4	59%	0.594	16%	0.164	S	C	*	.	H	α-helix	trans	-68.5	-14.5	-174.2	-62.1	-18.5	0	0	0	112.3	K168	K168-D172 WeakPolarHBondContact O-CB 3.26Å; K168-D172 PolarHBondContact O-N 2.86Å
173	R	93.8	Very high	96.7	Very high	105 Å²	105	34.9 Å²	34.9	40%	0.396	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	2	170.7	-71.7	171.9	171	-131.8	-3.9	114.4	D123 Y158 I169 I170 R171 I175	D123-R173 IonicContact OD1-CZ 3.57Å; D123-R173 IonicContact OD1-NH1 2.71Å; D123-R173 PolarHBondContact OD1-NH1 3.11Å; D123-R173 IonicContact OD1-NH2 3.52Å; Y158-R173 PolarHBondContact OH-NH1 2.88Å; Y158-R173 PolarHBondContact OH-NH2 3.02Å; I169-R173 HydrophobicContact CG2-CG 4.47Å; I169-R173 WeakPolarHBondContact O-CB 3.2Å; I169-R173 WeakPolarHBondContact O-CD 3.36Å; I169-R173 WeakPolarHBondContact O-CG 3.44Å; I169-R173 PolarHBondContact O-N 3.43Å; I169-R173 VanDerWaalsContact O-N 3.15Å; I170-R173 PolarHBondContact O-N 2.89Å; R171-R173 PolarHBondContact O-N 3.44Å; R171-R173 VanDerWaalsContact O-N 3.15Å; R173-I175 VanDerWaalsContact C-N 3.32Å; R173-I175 HydrophobicContact CB-CD1 3.95Å; R173-I175 HydrophobicContact CB-CG1 4.08Å
174	G	93.2	Very high	96.6	Very high	54 Å²	54	40.4 Å²	40.4	56%	0.557	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.3	24.7	-176.7	0	0	0	0	0	114	R171	R171-G174 PolarHBondContact O-N 2.82Å
175	I	96.3	Very high	96.5	Very high	7 Å²	7	39 Å²	39	4%	0.036	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-89.2	123.8	176	-55.9	164.7	0	0	0	108	L119 F122 K137 C139 I170 R173 F177	L119-I175 HydrophobicContact CD2-CD1 4.04Å; F122-I175 HydrophobicContact CB-CD1 4.03Å; F122-I175 HydrophobicContact CD1-CD1 4.18Å; F122-I175 HydrophobicContact CD1-CG1 4.49Å; F122-I175 HydrophobicContact CD2-CD1 3.75Å; F122-I175 HydrophobicContact CD2-CG2 4.5Å; F122-I175 HydrophobicContact CE1-CG2 4.16Å; F122-I175 HydrophobicContact CE2-CD1 4.26Å; F122-I175 HydrophobicContact CE2-CG2 3.92Å; F122-I175 HydrophobicContact CG-CD1 3.72Å; F122-I175 HydrophobicContact CG-CG1 4.5Å; F122-I175 HydrophobicContact CZ-CG2 3.73Å; K137-I175 HydrophobicContact CB-CB 4.2Å; K137-I175 HydrophobicContact CB-CG1 3.89Å; K137-I175 HydrophobicContact CB-CG2 4.09Å; K137-I175 HydrophobicContact CD-CG1 4.07Å; C139-I175 HydrophobicContact CB-CG2 3.91Å; I170-I175 HydrophobicContact CG2-CB 3.8Å; I170-I175 HydrophobicContact CG2-CG2 3.9Å; I170-I175 WeakPolarHBondContact CG2-O 3.36Å; I170-I175 WeakPolarHBondContact O-CB 3.25Å; I170-I175 PolarHBondContact O-N 2.86Å; R173-I175 VanDerWaalsContact C-N 3.32Å; R173-I175 HydrophobicContact CB-CD1 3.95Å; R173-I175 HydrophobicContact CB-CG1 4.08Å; I175-F177 PolarHBondContact O-N 3.04Å
176	H	96.4	Very high	96.5	Very high	70 Å²	70	41.5 Å²	41.5	32%	0.324	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	123.3	174.7	-60.4	-52.6	0	0	0	110.2	H136 K137 V138 C139 R219	H136-H176 AromaticContact CD2-CD2 3.63Å; H136-H176 AromaticContact CD2-NE2 3.84Å; H136-H176 AromaticContact NE2-CD2 3.44Å; H136-H176 PolarHBondContact NE2-CD2 3.27Å; H136-H176 AromaticContact NE2-NE2 3.85Å; K137-H176 PolarHBondContact O-N 3.45Å; V138-H176 CarbonylContact C-O 3.55Å; V138-H176 WeakPolarHBondContact CA-O 3.41Å; V138-H176 HydrophobicContact CG2-CB 4.34Å; C139-H176 PolarHBondContact N-O 3.38Å; H176-R219 HydrophobicContact CB-CB 4.33Å; H176-R219 HydrophobicContact CB-CG 4.11Å; H176-R219 WeakPolarHBondContact CB-O 3.48Å
177	F	97.6	Very high	96.4	Very high	1 Å²	1	43.4 Å²	43.4	0%	0.004	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	132.2	177.4	-169.2	-123.9	0	0	0	110.7	L115 C139 L141 V167 I170 I175 V179 L191 F192 A195 R219	L115-F177 HydrophobicContact CD2-CE2 3.81Å; L115-F177 HydrophobicContact CD2-CZ 4.31Å; C139-F177 HydrophobicContact CB-CD2 4.12Å; C139-F177 CarbonylContact O-C 3.6Å; C139-F177 WeakPolarHBondContact O-CA 3.06Å; L141-F177 HydrophobicContact CB-CE2 3.94Å; L141-F177 HydrophobicContact CB-CZ 3.87Å; L141-F177 HydrophobicContact CD2-CZ 3.81Å; L141-F177 HydrophobicContact CG-CZ 4.5Å; V167-F177 HydrophobicContact CG1-CD1 4.34Å; V167-F177 HydrophobicContact CG1-CE1 3.86Å; V167-F177 HydrophobicContact CG1-CE2 4.45Å; V167-F177 HydrophobicContact CG1-CZ 3.92Å; I170-F177 HydrophobicContact CD1-CD2 4.23Å; I170-F177 HydrophobicContact CD1-CE2 4.41Å; I170-F177 HydrophobicContact CG2-CB 3.96Å; I170-F177 HydrophobicContact CG2-CD2 4.33Å; I170-F177 HydrophobicContact CG2-CG 4.43Å; I175-F177 PolarHBondContact O-N 3.04Å; F177-V179 HydrophobicContact CD1-CG2 4.14Å; F177-V179 HydrophobicContact CE1-CG2 3.52Å; F177-V179 HydrophobicContact CZ-CG2 3.95Å; F177-L191 HydrophobicContact CE1-CB 4.15Å; F177-F192 VanDerWaalsContact O-CE2 3.24Å; F177-F192 WeakPolarHBondContact O-CE2 3.45Å; F177-A195 HydrophobicContact CB-CB 3.49Å; F177-A195 VanDerWaalsContact CB-CB 3.49Å; F177-A195 HydrophobicContact CD1-CB 3.6Å; F177-A195 HydrophobicContact CG-CB 3.88Å; F177-R219 WeakPolarHBondContact O-CB 3.32Å
178	S	97.4	Very high	96.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	146.4	175.4	-66.1	0	0	0	0	110.3	C139 V140 L141 L217 V218 R219	C139-S178 PolarHBondContact O-N 3.08Å; V140-S178 WeakPolarHBondContact CA-O 3.48Å; L141-S178 PolarHBondContact N-O 3.35Å; S178-L217 CarbonylContact C-O 3.56Å; S178-L217 VanDerWaalsContact CA-O 3.25Å; S178-L217 WeakPolarHBondContact CA-O 3.46Å; S178-V218 WeakPolarHBondContact OG-CA 3.35Å; S178-R219 PolarHBondContact OG-N 2.85Å; S178-R219 PolarHBondContact OG-O 3.22Å
179	V	97.7	Very high	96.3	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	129.1	179.3	176.1	0	0	0	0	109.7	L141 F177 L188 F192 M215 L217	L141-V179 HydrophobicContact CB-CG2 4.47Å; L141-V179 WeakPolarHBondContact O-CA 3.48Å; F177-V179 HydrophobicContact CD1-CG2 4.14Å; F177-V179 HydrophobicContact CE1-CG2 3.52Å; F177-V179 HydrophobicContact CZ-CG2 3.95Å; V179-L188 HydrophobicContact CG1-CB 3.93Å; V179-L188 HydrophobicContact CG1-CD1 4.38Å; V179-F192 HydrophobicContact CG2-CB 4.09Å; V179-F192 HydrophobicContact CG2-CD2 4.31Å; V179-M215 HydrophobicContact CG1-CE 4.28Å; V179-L217 HydrophobicContact CB-CB 4.38Å; V179-L217 PolarHBondContact N-O 2.82Å; V179-L217 PolarHBondContact O-N 2.81Å
180	V	98	Very high	96.2	Very high	4 Å²	4	47 Å²	47	2%	0.024	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.7	174.5	174.1	0	0	0	0	109	L32 Y36 L141 L142 C143 M215 V216	L32-V180 HydrophobicContact CD2-CG1 3.94Å; Y36-V180 HydrophobicContact CD2-CG1 4.01Å; Y36-V180 HydrophobicContact CG-CG1 4.2Å; L141-V180 PolarHBondContact O-N 2.93Å; L142-V180 WeakPolarHBondContact CA-O 3.34Å; L142-V180 HydrophobicContact CD1-CB 3.83Å; L142-V180 HydrophobicContact CD1-CG1 4.36Å; L142-V180 HydrophobicContact CD1-CG2 4.42Å; L142-V180 HydrophobicContact CG-CB 3.95Å; L142-V180 HydrophobicContact CG-CG1 4.13Å; C143-V180 PolarHBondContact N-O 2.91Å; V180-M215 CarbonylContact C-O 3.58Å; V180-M215 VanDerWaalsContact CA-O 3.32Å; V180-M215 WeakPolarHBondContact CA-O 3.38Å; V180-V216 HydrophobicContact CG2-CG1 4.49Å
181	A	97.5	Very high	96.2	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	151	179.1	0	0	0	0	0	110.8	C143 R183 L188 H214 M215	C143-A181 WeakPolarHBondContact O-CA 3.35Å; C143-A181 WeakPolarHBondContact O-CB 3.4Å; A181-R183 PolarHBondContact O-N 3.35Å; A181-L188 HydrophobicContact CB-CD1 4.06Å; A181-H214 CarbonylContact O-C 3.52Å; A181-H214 WeakPolarHBondContact O-CA 3.26Å; A181-M215 HydrophobicContact CB-CB 4.35Å; A181-M215 HydrophobicContact CB-CE 4.2Å; A181-M215 PolarHBondContact N-O 2.66Å; A181-M215 PolarHBondContact O-N 2.95Å
182	P	96.8	Very high	96.2	Very high	7 Å²	7	44.2 Å²	44.2	5%	0.045	23%	0.231	C	C	.	.	S	Bend	trans	-75.7	-7.5	179.8	32.3	-34.8	0	0	0	113.4	L25 Y28 L32 C143 N144 H214	L25-P182 HydrophobicContact CD1-CG 4.42Å; Y28-P182 HydrophobicContact CD1-CB 3.68Å; Y28-P182 HydrophobicContact CD1-CG 4.31Å; Y28-P182 HydrophobicContact CD2-CB 4.17Å; Y28-P182 HydrophobicContact CD2-CG 3.91Å; Y28-P182 HydrophobicContact CE1-CB 4.43Å; Y28-P182 HydrophobicContact CG-CB 3.53Å; Y28-P182 HydrophobicContact CG-CG 3.79Å; L32-P182 HydrophobicContact CD1-CB 4.23Å; L32-P182 HydrophobicContact CD1-CG 4.37Å; L32-P182 HydrophobicContact CD2-CB 4.41Å; C143-P182 WeakPolarHBondContact O-CD 3.49Å; N144-P182 HydrophobicContact CB-CG 3.91Å; N144-P182 WeakPolarHBondContact OD1-CG 3.37Å; P182-H214 PolarHBondContact O-CD2 3.33Å
183	R	95.2	Very high	96.2	Very high	112 Å²	112	42.8 Å²	42.8	42%	0.423	22%	0.22	S	C	.	.	S	Bend	trans	-144.5	155.1	177	61.7	-177.9	178.6	131.5	-1.8	111	N144 A181 L185 F213	N144-R183 PolarHBondContact O-NE 3.07Å; N144-R183 PolarHBondContact O-NH2 3.36Å; N144-R183 WeakPolarHBondContact OD1-CD 3.49Å; N144-R183 WeakPolarHBondContact OD1-CG 3.33Å; N144-R183 PolarHBondContact OD1-NE 3.23Å; A181-R183 PolarHBondContact O-N 3.35Å; R183-L185 HydrophobicContact CG-CD1 4.24Å; R183-L185 HydrophobicContact CG-CG 4.17Å; R183-L185 PolarHBondContact O-N 2.63Å; R183-F213 CarbonylContact C-O 3.5Å; R183-F213 VanDerWaalsContact CA-O 3.31Å; R183-F213 WeakPolarHBondContact CA-O 3.49Å
184	K	95	Very high	96.2	Very high	118 Å²	118	42.7 Å²	42.7	51%	0.513	22%	0.22	S	C	.	.			trans	-65.5	123.5	173.4	-40.5	-62.6	-177.1	-178.9	0	110	P212 F213 H214 M215	K184-P212 WeakPolarHBondContact CE-O 3.13Å; K184-P212 PolarHBondContact NZ-O 2.71Å; K184-F213 WeakPolarHBondContact CD-O 3.42Å; K184-F213 WeakPolarHBondContact CE-O 3.42Å; K184-F213 PolarHBondContact N-O 3.01Å; K184-H214 WeakPolarHBondContact CE-O 3.36Å; K184-H214 PolarHBondContact NZ-O 2.99Å; K184-M215 HydrophobicContact CD-CB 4.06Å; K184-M215 HydrophobicContact CD-CG 4.5Å
185	L	95.9	Very high	96.2	Very high	15 Å²	15	40.3 Å²	40.3	8%	0.079	20%	0.195	C	C	.	.			trans	-129.9	109	-177.9	-85.1	166	0	0	0	110.7	R183 A187 L188 R189 M215	R183-L185 HydrophobicContact CG-CD1 4.24Å; R183-L185 HydrophobicContact CG-CG 4.17Å; R183-L185 PolarHBondContact O-N 2.63Å; L185-A187 VanDerWaalsContact C-N 3.29Å; L185-A187 PolarHBondContact O-N 3.31Å; L185-L188 HydrophobicContact CB-CB 4.26Å; L185-L188 HydrophobicContact CB-CD1 3.85Å; L185-L188 HydrophobicContact CB-CG 3.88Å; L185-L188 HydrophobicContact CD1-CD1 3.53Å; L185-L188 HydrophobicContact CD1-CG 4.2Å; L185-L188 HydrophobicContact CG-CD1 4.34Å; L185-L188 PolarHBondContact O-N 2.87Å; L185-L188 VanDerWaalsContact O-N 3.14Å; L185-R189 PolarHBondContact O-N 2.8Å; L185-R189 VanDerWaalsContact O-N 3.08Å; L185-M215 HydrophobicContact CB-CE 3.9Å; L185-M215 WeakPolarHBondContact O-CE 3.39Å
186	P	95.9	Very high	95.7	Very high	110 Å²	110	40.9 Å²	40.9	71%	0.714	20%	0.2	S	C	*	.	H	α-helix	trans	-55.9	-37.7	-176.4	-28.8	36	0	0	0	114.5	R189 A190	P186-R189 PolarHBondContact O-N 3.25Å; P186-A190 PolarHBondContact O-N 2.91Å
187	A	96.3	Very high	94.8	Very high	39 Å²	39	41.7 Å²	41.7	32%	0.322	21%	0.211	S	C	.	.	H	α-helix	trans	-64.4	-41.8	178.5	0	0	0	0	0	112.8	P146 L185 R189 A190 L191	P146-A187 HydrophobicContact CB-CB 4Å; L185-A187 VanDerWaalsContact C-N 3.29Å; L185-A187 PolarHBondContact O-N 3.31Å; A187-R189 VanDerWaalsContact C-N 3.34Å; A187-A190 WeakPolarHBondContact O-CB 3.46Å; A187-A190 PolarHBondContact O-N 3.08Å; A187-L191 PolarHBondContact O-N 2.7Å
188	L	97	Very high	93.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-72.1	-31.1	177.2	-51.9	179.5	0	0	0	111.7	I111 L141 C143 V179 A181 L185 L191 F192 M215	I111-L188 HydrophobicContact CD1-CD2 3.52Å; L141-L188 HydrophobicContact CD2-CD2 4.42Å; C143-L188 WeakPolarHBondContact SG-CD1 3.03Å; V179-L188 HydrophobicContact CG1-CB 3.93Å; V179-L188 HydrophobicContact CG1-CD1 4.38Å; A181-L188 HydrophobicContact CB-CD1 4.06Å; L185-L188 HydrophobicContact CB-CB 4.26Å; L185-L188 HydrophobicContact CB-CD1 3.85Å; L185-L188 HydrophobicContact CB-CG 3.88Å; L185-L188 HydrophobicContact CD1-CD1 3.53Å; L185-L188 HydrophobicContact CD1-CG 4.2Å; L185-L188 HydrophobicContact CG-CD1 4.34Å; L185-L188 PolarHBondContact O-N 2.87Å; L185-L188 VanDerWaalsContact O-N 3.14Å; L188-L191 HydrophobicContact CD2-CD1 4.14Å; L188-L191 WeakPolarHBondContact O-CB 3.49Å; L188-L191 PolarHBondContact O-N 2.89Å; L188-F192 PolarHBondContact O-N 3.11Å; L188-M215 HydrophobicContact CB-CE 3.82Å; L188-M215 HydrophobicContact CD1-CE 4.23Å
189	R	95.8	Very high	91.5	Very high	141 Å²	141	53.5 Å²	53.5	53%	0.532	28%	0.283	S	S	.	.	H	α-helix	trans	-64.4	-41.9	169.8	-171.4	172.6	-173.9	159.5	5.9	111.2	L185 P186 A187 L191 F192 E193 M215 L217	L185-R189 PolarHBondContact O-N 2.8Å; L185-R189 VanDerWaalsContact O-N 3.08Å; P186-R189 PolarHBondContact O-N 3.25Å; A187-R189 VanDerWaalsContact C-N 3.34Å; R189-L191 VanDerWaalsContact C-N 3.33Å; R189-L191 PolarHBondContact O-N 3.06Å; R189-F192 WeakPolarHBondContact O-CB 3.07Å; R189-F192 PolarHBondContact O-N 3.13Å; R189-F192 VanDerWaalsContact O-N 3.11Å; R189-E193 HydrophobicContact CG-CG 4.46Å; R189-E193 IonicContact NE-OE1 2.72Å; R189-E193 WeakPolarHBondContact O-CG 3.35Å; R189-E193 PolarHBondContact O-N 3.12Å; R189-M215 HydrophobicContact CB-SD 4.38Å; R189-L217 HydrophobicContact CB-CD1 4.26Å; R189-L217 HydrophobicContact CG-CD1 4.03Å
190	A	96.3	Very high	89.4	Confident	32 Å²	32	57 Å²	57	26%	0.264	32%	0.319	S	S	.	.	H	α-helix	trans	-60.6	-40.9	174	0	0	0	0	0	112.2	P186 A187 F192 E193 W194	P186-A190 PolarHBondContact O-N 2.91Å; A187-A190 WeakPolarHBondContact O-CB 3.46Å; A187-A190 PolarHBondContact O-N 3.08Å; A190-F192 VanDerWaalsContact C-N 3.33Å; A190-F192 PolarHBondContact O-N 2.94Å; A190-E193 PolarHBondContact O-N 3.26Å; A190-W194 HydrophobicContact CB-CE3 4.48Å; A190-W194 HydrophobicContact CB-CH2 4.18Å; A190-W194 HydrophobicContact CB-CZ2 4.32Å; A190-W194 HydrophobicContact CB-CZ3 4.24Å; A190-W194 VanDerWaalsContact O-CD2 3.32Å; A190-W194 PolarHBondContact O-N 3.16Å
191	L	97.2	Very high	87.1	Confident	1 Å²	1	60.8 Å²	60.8	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-58.7	-41.9	171.4	-68.8	178.7	0	0	0	112.4	I111 L141 P147 A163 V167 F177 A187 L188 R189 W194 A195	I111-L191 HydrophobicContact CG2-CD1 4.12Å; L141-L191 HydrophobicContact CD2-CD1 4.39Å; P147-L191 HydrophobicContact CG-CD1 4.29Å; A163-L191 HydrophobicContact CB-CD1 4.41Å; A163-L191 HydrophobicContact CB-CD2 3.87Å; V167-L191 HydrophobicContact CG1-CB 4.19Å; V167-L191 HydrophobicContact CG1-CD2 4.03Å; V167-L191 HydrophobicContact CG2-CD2 3.98Å; F177-L191 HydrophobicContact CE1-CB 4.15Å; A187-L191 PolarHBondContact O-N 2.7Å; L188-L191 HydrophobicContact CD2-CD1 4.14Å; L188-L191 WeakPolarHBondContact O-CB 3.49Å; L188-L191 PolarHBondContact O-N 2.89Å; R189-L191 VanDerWaalsContact C-N 3.33Å; R189-L191 PolarHBondContact O-N 3.06Å; L191-W194 HydrophobicContact CD2-CE3 4.05Å; L191-W194 HydrophobicContact CD2-CZ3 4.11Å; L191-A195 PolarHBondContact O-N 2.9Å
192	F	96.1	Very high	85.1	Confident	2 Å²	2	67 Å²	67	1%	0.009	39%	0.389	C	S	.	.	H	α-helix	trans	-64	-43.7	175.4	-177	-95.9	0	0	0	112.8	F177 V179 L188 R189 A190 A195 S196 H205 L217 R219	F177-F192 VanDerWaalsContact O-CE2 3.24Å; F177-F192 WeakPolarHBondContact O-CE2 3.45Å; V179-F192 HydrophobicContact CG2-CB 4.09Å; V179-F192 HydrophobicContact CG2-CD2 4.31Å; L188-F192 PolarHBondContact O-N 3.11Å; R189-F192 WeakPolarHBondContact O-CB 3.07Å; R189-F192 PolarHBondContact O-N 3.13Å; R189-F192 VanDerWaalsContact O-N 3.11Å; A190-F192 VanDerWaalsContact C-N 3.33Å; A190-F192 PolarHBondContact O-N 2.94Å; F192-A195 CarbonylContact O-C 3.54Å; F192-A195 WeakPolarHBondContact O-CB 3.23Å; F192-A195 PolarHBondContact O-N 3.36Å; F192-S196 PolarHBondContact O-N 3.04Å; F192-S196 VanDerWaalsContact O-N 3.16Å; F192-S196 PolarHBondContact O-OG 2.93Å; F192-H205 AromaticContact CE1-NE2 3.74Å; F192-H205 AromaticContact CZ-CD2 3.76Å; F192-H205 AromaticContact CZ-NE2 3.55Å; F192-L217 HydrophobicContact CB-CD1 3.93Å; F192-L217 HydrophobicContact CD1-CB 4.04Å; F192-L217 HydrophobicContact CD1-CD1 4.06Å; F192-L217 HydrophobicContact CD2-CB 3.66Å; F192-L217 HydrophobicContact CE1-CB 4.09Å; F192-L217 HydrophobicContact CE2-CB 3.72Å; F192-L217 WeakPolarHBondContact CE2-O 3.33Å; F192-L217 HydrophobicContact CG-CB 3.82Å; F192-L217 HydrophobicContact CG-CD1 3.94Å; F192-L217 HydrophobicContact CG-CG 4.5Å; F192-L217 HydrophobicContact CZ-CB 3.93Å; F192-R219 HydrophobicContact CE2-CB 4.37Å
193	E	94.7	Very high	83.2	Confident	80 Å²	80	72.9 Å²	72.9	37%	0.374	42%	0.416	S	S	.	.	H	α-helix	trans	-72.8	-32.1	179.4	-56.1	-55.7	175.8	0	0	113	R189 A190 A195 S196	R189-E193 HydrophobicContact CG-CG 4.46Å; R189-E193 IonicContact NE-OE1 2.72Å; R189-E193 WeakPolarHBondContact O-CG 3.35Å; R189-E193 PolarHBondContact O-N 3.12Å; A190-E193 PolarHBondContact O-N 3.26Å; E193-A195 PolarHBondContact O-N 2.97Å; E193-S196 VanDerWaalsContact O-CB 3.23Å; E193-S196 WeakPolarHBondContact O-CB 3.42Å; E193-S196 PolarHBondContact O-N 3.31Å; E193-S196 PolarHBondContact OE2-OG 3.24Å; E193-S196 VanDerWaalsContact OE2-OG 3.13Å
194	W	93.8	Very high	81.4	Confident	103 Å²	103	73 Å²	73	39%	0.39	43%	0.43	S	S	.	.	H	α-helix	trans	-68	-25.1	170.9	-67.6	-32.8	0	0	0	112.9	D164 V167 R171 A190 L191 S196	D164-W194 HydrophobicContact CB-CE3 3.98Å; D164-W194 HydrophobicContact CB-CH2 4.41Å; D164-W194 HydrophobicContact CB-CZ3 3.75Å; D164-W194 WeakPolarHBondContact OD1-CZ3 3.47Å; D164-W194 WeakPolarHBondContact OD2-CH2 3.46Å; D164-W194 WeakPolarHBondContact OD2-CZ3 3.42Å; V167-W194 HydrophobicContact CG2-CB 3.82Å; V167-W194 HydrophobicContact CG2-CE3 4.36Å; R171-W194 PolarHBondContact NH1-O 2.85Å; A190-W194 HydrophobicContact CB-CE3 4.48Å; A190-W194 HydrophobicContact CB-CH2 4.18Å; A190-W194 HydrophobicContact CB-CZ2 4.32Å; A190-W194 HydrophobicContact CB-CZ3 4.24Å; A190-W194 VanDerWaalsContact O-CD2 3.32Å; A190-W194 PolarHBondContact O-N 3.16Å; L191-W194 HydrophobicContact CD2-CE3 4.05Å; L191-W194 HydrophobicContact CD2-CZ3 4.11Å; W194-S196 VanDerWaalsContact C-N 3.34Å
195	A	93.3	Very high	79.9	Confident	4 Å²	4	70.9 Å²	70.9	3%	0.033	42%	0.422	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-8.1	169.3	0	0	0	0	0	114	V167 R171 F177 L191 F192 E193	V167-A195 HydrophobicContact CB-CB 4.29Å; R171-A195 WeakPolarHBondContact CG-O 3.29Å; F177-A195 HydrophobicContact CB-CB 3.49Å; F177-A195 VanDerWaalsContact CB-CB 3.49Å; F177-A195 HydrophobicContact CD1-CB 3.6Å; F177-A195 HydrophobicContact CG-CB 3.88Å; L191-A195 PolarHBondContact O-N 2.9Å; F192-A195 CarbonylContact O-C 3.54Å; F192-A195 WeakPolarHBondContact O-CB 3.23Å; F192-A195 PolarHBondContact O-N 3.36Å; E193-A195 PolarHBondContact O-N 2.97Å
196	S	85.2	Confident	79	Confident	20 Å²	20	73.3 Å²	73.3	14%	0.14	44%	0.439	C	S	.	.	S	Bend	trans	-70.8	141.4	174.4	-64.1	0	0	0	0	110.9	R171 F192 E193 W194 V198 R219	R171-S196 WeakPolarHBondContact CD-O 3.32Å; F192-S196 PolarHBondContact O-N 3.04Å; F192-S196 VanDerWaalsContact O-N 3.16Å; F192-S196 PolarHBondContact O-OG 2.93Å; E193-S196 VanDerWaalsContact O-CB 3.23Å; E193-S196 WeakPolarHBondContact O-CB 3.42Å; E193-S196 PolarHBondContact O-N 3.31Å; E193-S196 PolarHBondContact OE2-OG 3.24Å; E193-S196 VanDerWaalsContact OE2-OG 3.13Å; W194-S196 VanDerWaalsContact C-N 3.34Å; S196-V198 PolarHBondContact O-N 2.97Å; S196-R219 VanDerWaalsContact CA-NH1 3.32Å; S196-R219 PolarHBondContact OG-NH1 2.85Å; S196-R219 PolarHBondContact OG-NH2 3.38Å
197	P	77.9	Confident	78.2	Confident	86 Å²	86	73.6 Å²	73.6	56%	0.558	44%	0.435	S	S	*	.			trans	-56.2	136.9	172.2	-24.7	34.6	0	0	0	111.7	T199	P197-T199 PolarHBondContact O-N 3.03Å
198	V	68.6	Low	77.8	Confident	122 Å²	122	73 Å²	73	74%	0.739	42%	0.424	S	S	*	.	S	Bend	trans	-72.8	-18.4	-176.9	-174.3	0	0	0	0	112.3	S196	S196-V198 PolarHBondContact O-N 2.97Å
199	T	56.4	Low	77.3	Confident	128 Å²	128	73.7 Å²	73.7	79%	0.785	43%	0.429	S	S	*	.	S	Bend	trans	-127.1	105.8	-177.6	52.7	0	0	0	0	110.7	P197	P197-T199 PolarHBondContact O-N 3.03Å
200	G	54.4	Low	76.9	Confident	72 Å²	72	70.3 Å²	70.3	74%	0.742	42%	0.419	S	S	*	.	S	Bend	trans	169.5	165.5	176.5	0	0	0	0	0	111
201	A	49.3	Very low	76.6	Confident	85 Å²	85	71.2 Å²	71.2	70%	0.702	42%	0.42	S	S	*	.			trans	-66.9	148.4	161.9	0	0	0	0	0	109.1	E203	A201-E203 VanDerWaalsContact C-N 3.29Å; A201-E203 PolarHBondContact O-N 3.01Å
202	V	56.3	Low	76.2	Confident	131 Å²	131	76.2 Å²	76.2	79%	0.794	45%	0.452	S	S	*	.			trans	-74.4	91.7	167.6	-178.9	0	0	0	0	107.2
203	E	55.9	Low	76	Confident	130 Å²	130	83.3 Å²	83.3	61%	0.607	48%	0.483	S	S	*	.			trans	-50.5	130.5	172.8	-76.7	-67.9	91.7	0	0	109.6	A201 H205	A201-E203 VanDerWaalsContact C-N 3.29Å; A201-E203 PolarHBondContact O-N 3.01Å; E203-H205 PolarHBondContact O-CE1 3.33Å; E203-H205 PolarHBondContact O-N 3.17Å; E203-H205 PolarHBondContact O-ND1 2.91Å
204	P	57.7	Low	76	Confident	113 Å²	113	80 Å²	80	73%	0.734	47%	0.467	S	S	*	.			trans	-69.5	101.1	-179.8	27.6	-33.1	0	0	0	109.2	P206	P204-P206 WeakPolarHBondContact O-CD 3.48Å
205	H	64.1	Low	76.1	Confident	74 Å²	74	75.6 Å²	75.6	34%	0.343	45%	0.451	S	S	.	.			trans	-63.7	122.9	180	-63.2	63.8	0	0	0	108.4	F192 E203 V218 R219	F192-H205 AromaticContact CE1-NE2 3.74Å; F192-H205 AromaticContact CZ-CD2 3.76Å; F192-H205 AromaticContact CZ-NE2 3.55Å; E203-H205 PolarHBondContact O-CE1 3.33Å; E203-H205 PolarHBondContact O-N 3.17Å; E203-H205 PolarHBondContact O-ND1 2.91Å; H205-V218 PolarHBondContact CD2-O 2.77Å; H205-R219 PolarHBondContact CE1-NH2 3.04Å; H205-R219 PolarHBondContact NE2-NH2 2.72Å
206	P	75.8	Confident	76.2	Confident	66 Å²	66	76 Å²	76	43%	0.429	45%	0.454	S	S	.	.			trans	-60.2	143	176.8	-22.8	33.5	0	0	0	110.9	P204 Y208	P204-P206 WeakPolarHBondContact O-CD 3.48Å; P206-Y208 HydrophobicContact CB-CD2 4.22Å; P206-Y208 HydrophobicContact CB-CE1 4.26Å; P206-Y208 HydrophobicContact CB-CE2 3.73Å; P206-Y208 HydrophobicContact CG-CE2 3.96Å; P206-Y208 WeakPolarHBondContact O-CD2 3.34Å; P206-Y208 PolarHBondContact O-N 3.02Å
207	D	80.9	Confident	76.7	Confident	117 Å²	117	76.4 Å²	76.4	63%	0.626	45%	0.454	S	S	*	.			trans	-77.8	98	173.2	-162	-11.8	0	0	0	109.7	S209	D207-S209 VanDerWaalsContact C-N 3.28Å; D207-S209 WeakPolarHBondContact OD1-CB 3.15Å; D207-S209 PolarHBondContact OD1-N 3.46Å
208	Y	87.6	Confident	77.4	Confident	27 Å²	27	72.8 Å²	72.8	11%	0.106	43%	0.431	C	S	.	.			trans	-85.2	1.4	174.8	-61.8	-77.1	0	0	0	112.6	Y36 P206 Q210 V218 L223 V225	Y36-Y208 WeakPolarHBondContact CE1-O 3.49Å; P206-Y208 HydrophobicContact CB-CD2 4.22Å; P206-Y208 HydrophobicContact CB-CE1 4.26Å; P206-Y208 HydrophobicContact CB-CE2 3.73Å; P206-Y208 HydrophobicContact CG-CE2 3.96Å; P206-Y208 WeakPolarHBondContact O-CD2 3.34Å; P206-Y208 PolarHBondContact O-N 3.02Å; Y208-Q210 PolarHBondContact O-N 2.95Å; Y208-V218 HydrophobicContact CD2-CG2 3.31Å; Y208-V218 HydrophobicContact CE2-CG2 3.34Å; Y208-V218 HydrophobicContact CG-CG2 4.29Å; Y208-L223 HydrophobicContact CD1-CB 3.64Å; Y208-L223 WeakPolarHBondContact CD1-O 3.32Å; Y208-L223 HydrophobicContact CE1-CB 4.15Å; Y208-L223 WeakPolarHBondContact CE1-O 3.49Å; Y208-L223 HydrophobicContact CG-CB 4.02Å; Y208-V225 HydrophobicContact CD1-CG1 3.82Å; Y208-V225 HydrophobicContact CE1-CG1 3.7Å
209	S	86.7	Confident	78.5	Confident	14 Å²	14	69 Å²	69	10%	0.098	40%	0.403	C	S	.	.			trans	-70.3	116.2	-175.2	-149	0	0	0	0	111.2	D207 D211 H214	D207-S209 VanDerWaalsContact C-N 3.28Å; D207-S209 WeakPolarHBondContact OD1-CB 3.15Å; D207-S209 PolarHBondContact OD1-N 3.46Å; S209-D211 VanDerWaalsContact C-N 3.28Å; S209-D211 PolarHBondContact OG-O 3.31Å; S209-H214 PolarHBondContact OG-O 2.99Å
210	Q	87.6	Confident	80	Confident	70 Å²	70	63.8 Å²	63.8	33%	0.327	38%	0.375	S	S	.	.	S	Bend	trans	-84.4	-7.3	175.5	-54.6	-59.2	-25.5	0	0	112.2	N35 Y36 Y208 P224 S226	N35-Q210 HydrophobicContact CB-CB 4.34Å; N35-Q210 HydrophobicContact CB-CG 4.31Å; Y36-Q210 HydrophobicContact CE1-CB 4.39Å; Y36-Q210 HydrophobicContact CE1-CG 4.09Å; Y36-Q210 PolarHBondContact OH-N 3.4Å; Y208-Q210 PolarHBondContact O-N 2.95Å; Q210-P224 PolarHBondContact NE2-O 3.38Å; Q210-S226 PolarHBondContact OE1-OG 2.83Å
211	D	89.2	Confident	81.8	Confident	51 Å²	51	61 Å²	61	27%	0.273	34%	0.343	S	S	.	.	S	Bend	trans	-131.7	135.9	172.4	177.3	-71.7	0	0	0	108.9	Y36 S209 F213 H214	Y36-D211 PolarHBondContact OH-N 2.98Å; S209-D211 VanDerWaalsContact C-N 3.28Å; S209-D211 PolarHBondContact OG-O 3.31Å; D211-F213 VanDerWaalsContact C-N 3.31Å; D211-F213 PolarHBondContact O-N 2.93Å; D211-F213 WeakPolarHBondContact OD1-CA 3.49Å; D211-F213 WeakPolarHBondContact OD1-CB 3.39Å; D211-F213 PolarHBondContact OD1-N 3.17Å; D211-H214 HydrophobicContact CB-CB 4.2Å; D211-H214 PolarHBondContact O-N 3.48Å; D211-H214 IonicContact OD1-CD2 3.41Å; D211-H214 PolarHBondContact OD1-CD2 3.42Å; D211-H214 PolarHBondContact OD1-N 3.19Å
212	P	88.6	Confident	83.7	Confident	105 Å²	105	60.1 Å²	60.1	68%	0.682	33%	0.331	S	S	*	.	S	Bend	trans	-63.2	-28.8	-177.2	-25.3	35.5	0	0	0	115.4	K184	K184-P212 WeakPolarHBondContact CE-O 3.13Å; K184-P212 PolarHBondContact NZ-O 2.71Å
213	F	91.8	Very high	85.2	Confident	151 Å²	151	54.4 Å²	54.4	66%	0.662	30%	0.296	S	S	*	.	S	Bend	trans	-81	-34.9	-178	-60.7	-77.2	0	0	0	112.2	R183 K184 D211	R183-F213 CarbonylContact C-O 3.5Å; R183-F213 VanDerWaalsContact CA-O 3.31Å; R183-F213 WeakPolarHBondContact CA-O 3.49Å; K184-F213 WeakPolarHBondContact CD-O 3.42Å; K184-F213 WeakPolarHBondContact CE-O 3.42Å; K184-F213 PolarHBondContact N-O 3.01Å; D211-F213 VanDerWaalsContact C-N 3.31Å; D211-F213 PolarHBondContact O-N 2.93Å; D211-F213 WeakPolarHBondContact OD1-CA 3.49Å; D211-F213 WeakPolarHBondContact OD1-CB 3.39Å; D211-F213 PolarHBondContact OD1-N 3.17Å
214	H	95.6	Very high	86.6	Confident	10 Å²	10	51.7 Å²	51.7	5%	0.046	29%	0.29	C	S	.	.			trans	-55.9	146.1	178.5	-73.6	-155.6	0	0	0	112.1	S31 L32 Y36 A181 P182 K184 S209 D211 V216	S31-H214 PolarHBondContact OG-CE1 3.39Å; L32-H214 WeakPolarHBondContact CD2-CE1 3.15Å; L32-H214 WeakPolarHBondContact CD2-ND1 3.39Å; Y36-H214 AromaticContact CE2-CE1 3.92Å; Y36-H214 AromaticContact CE2-ND1 3.24Å; Y36-H214 WeakPolarHBondContact CE2-ND1 3.49Å; Y36-H214 AromaticContact CZ-ND1 3.63Å; Y36-H214 PolarHBondContact OH-ND1 2.92Å; A181-H214 CarbonylContact O-C 3.52Å; A181-H214 WeakPolarHBondContact O-CA 3.26Å; P182-H214 PolarHBondContact O-CD2 3.33Å; K184-H214 WeakPolarHBondContact CE-O 3.36Å; K184-H214 PolarHBondContact NZ-O 2.99Å; S209-H214 PolarHBondContact OG-O 2.99Å; D211-H214 HydrophobicContact CB-CB 4.2Å; D211-H214 PolarHBondContact O-N 3.48Å; D211-H214 IonicContact OD1-CD2 3.41Å; D211-H214 PolarHBondContact OD1-CD2 3.42Å; D211-H214 PolarHBondContact OD1-N 3.19Å; H214-V216 HydrophobicContact CB-CG2 4.37Å
215	M	95	Very high	87.4	Confident	11 Å²	11	50.9 Å²	50.9	5%	0.054	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	113.9	175.1	-173.9	167.7	64.6	0	0	108.7	V179 V180 A181 K184 L185 L188 R189 L217	V179-M215 HydrophobicContact CG1-CE 4.28Å; V180-M215 CarbonylContact C-O 3.58Å; V180-M215 VanDerWaalsContact CA-O 3.32Å; V180-M215 WeakPolarHBondContact CA-O 3.38Å; A181-M215 HydrophobicContact CB-CB 4.35Å; A181-M215 HydrophobicContact CB-CE 4.2Å; A181-M215 PolarHBondContact N-O 2.66Å; A181-M215 PolarHBondContact O-N 2.95Å; K184-M215 HydrophobicContact CD-CB 4.06Å; K184-M215 HydrophobicContact CD-CG 4.5Å; L185-M215 HydrophobicContact CB-CE 3.9Å; L185-M215 WeakPolarHBondContact O-CE 3.39Å; L188-M215 HydrophobicContact CB-CE 3.82Å; L188-M215 HydrophobicContact CD1-CE 4.23Å; R189-M215 HydrophobicContact CB-SD 4.38Å; M215-L217 HydrophobicContact CG-CD1 4.09Å; M215-L217 HydrophobicContact CG-CG 3.99Å; M215-L217 HydrophobicContact SD-CD1 4.16Å
216	V	96.3	Very high	87.3	Confident	14 Å²	14	49.5 Å²	49.5	9%	0.085	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	95.3	-174.3	-174.7	0	0	0	0	107.7	Y36 V180 H214 V218 L223	Y36-V216 HydrophobicContact CD1-CG1 3.98Å; Y36-V216 HydrophobicContact CD1-CG2 3.84Å; Y36-V216 HydrophobicContact CE1-CG1 4.3Å; Y36-V216 HydrophobicContact CE1-CG2 3.53Å; Y36-V216 HydrophobicContact CE2-CG2 4.47Å; Y36-V216 HydrophobicContact CG-CG2 4.42Å; V180-V216 HydrophobicContact CG2-CG1 4.49Å; H214-V216 HydrophobicContact CB-CG2 4.37Å; V216-V218 HydrophobicContact CG1-CG1 3.98Å; V216-L223 HydrophobicContact CG1-CD1 4.14Å
217	L	94.6	Very high	86	Confident	27 Å²	27	51.7 Å²	51.7	14%	0.141	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	94.7	-178.9	-57.2	175.5	0	0	0	107.5	S178 V179 R189 F192 M215	S178-L217 CarbonylContact C-O 3.56Å; S178-L217 VanDerWaalsContact CA-O 3.25Å; S178-L217 WeakPolarHBondContact CA-O 3.46Å; V179-L217 HydrophobicContact CB-CB 4.38Å; V179-L217 PolarHBondContact N-O 2.82Å; V179-L217 PolarHBondContact O-N 2.81Å; R189-L217 HydrophobicContact CB-CD1 4.26Å; R189-L217 HydrophobicContact CG-CD1 4.03Å; F192-L217 HydrophobicContact CB-CD1 3.93Å; F192-L217 HydrophobicContact CD1-CB 4.04Å; F192-L217 HydrophobicContact CD1-CD1 4.06Å; F192-L217 HydrophobicContact CD2-CB 3.66Å; F192-L217 HydrophobicContact CE1-CB 4.09Å; F192-L217 HydrophobicContact CE2-CB 3.72Å; F192-L217 WeakPolarHBondContact CE2-O 3.33Å; F192-L217 HydrophobicContact CG-CB 3.82Å; F192-L217 HydrophobicContact CG-CD1 3.94Å; F192-L217 HydrophobicContact CG-CG 4.5Å; F192-L217 HydrophobicContact CZ-CB 3.93Å; M215-L217 HydrophobicContact CG-CD1 4.09Å; M215-L217 HydrophobicContact CG-CG 3.99Å; M215-L217 HydrophobicContact SD-CD1 4.16Å
218	V	93	Very high	84.2	Confident	11 Å²	11	49.6 Å²	49.6	7%	0.067	31%	0.311	C	S	.	.			trans	-109.9	146.9	-173.2	-62.5	0	0	0	0	113	S178 H205 Y208 V216 I221 L223	S178-V218 WeakPolarHBondContact OG-CA 3.35Å; H205-V218 PolarHBondContact CD2-O 2.77Å; Y208-V218 HydrophobicContact CD2-CG2 3.31Å; Y208-V218 HydrophobicContact CE2-CG2 3.34Å; Y208-V218 HydrophobicContact CG-CG2 4.29Å; V216-V218 HydrophobicContact CG1-CG1 3.98Å; V218-I221 HydrophobicContact CB-CB 4.44Å; V218-L223 HydrophobicContact CG1-CD1 3.95Å
219	R	91.4	Very high	81.8	Confident	42 Å²	42	51.7 Å²	51.7	16%	0.158	34%	0.341	C	S	.	.	S	Bend	trans	-149.9	132.9	176.9	-169.2	172	-73.6	145.6	-6.6	107.9	H176 F177 S178 F192 S196 H205 I221	H176-R219 HydrophobicContact CB-CB 4.33Å; H176-R219 HydrophobicContact CB-CG 4.11Å; H176-R219 WeakPolarHBondContact CB-O 3.48Å; F177-R219 WeakPolarHBondContact O-CB 3.32Å; S178-R219 PolarHBondContact OG-N 2.85Å; S178-R219 PolarHBondContact OG-O 3.22Å; F192-R219 HydrophobicContact CE2-CB 4.37Å; S196-R219 VanDerWaalsContact CA-NH1 3.32Å; S196-R219 PolarHBondContact OG-NH1 2.85Å; S196-R219 PolarHBondContact OG-NH2 3.38Å; H205-R219 PolarHBondContact CE1-NH2 3.04Å; H205-R219 PolarHBondContact NE2-NH2 2.72Å; R219-I221 VanDerWaalsContact C-N 3.29Å
220	G	88.4	Confident	79.2	Confident	19 Å²	19	53.5 Å²	53.5	20%	0.196	36%	0.362	C	S	.	.	S	Bend	trans	73.1	16.1	-171	0	0	0	0	0	114.5	F44 H136	F44-G220 WeakPolarHBondContact CZ-O 3.49Å; H136-G220 PolarHBondContact CE1-O 3.42Å
221	I	91.1	Very high	76.9	Confident	14 Å²	14	54.8 Å²	54.8	7%	0.072	38%	0.376	C	S	.	.			trans	-138.1	140	177.2	-45.3	179.3	0	0	0	108.5	A40 Y43 F44 V138 V140 V218 R219 L223	A40-I221 HydrophobicContact CB-CD1 4.38Å; A40-I221 HydrophobicContact CB-CG2 4.05Å; Y43-I221 HydrophobicContact CD1-CG2 3.88Å; Y43-I221 HydrophobicContact CE1-CG2 4.37Å; Y43-I221 HydrophobicContact CG-CG2 4.4Å; F44-I221 HydrophobicContact CE2-CD1 4.36Å; F44-I221 HydrophobicContact CE2-CG1 4.11Å; F44-I221 HydrophobicContact CZ-CG1 3.92Å; V138-I221 HydrophobicContact CG1-CD1 4.01Å; V138-I221 HydrophobicContact CG1-CG1 3.82Å; V140-I221 HydrophobicContact CG2-CD1 3.75Å; V218-I221 HydrophobicContact CB-CB 4.44Å; R219-I221 VanDerWaalsContact C-N 3.29Å; I221-L223 HydrophobicContact CG2-CD2 3.65Å; I221-L223 HydrophobicContact CG2-CG 4.02Å
222	S	89.2	Confident	74.5	Confident	65 Å²	65	58.8 Å²	58.8	46%	0.455	41%	0.405	S	S	.	.			trans	-112.4	103.4	166.5	-178.1	0	0	0	0	109.6
223	L	89.4	Confident	71.9	Confident	11 Å²	11	61.2 Å²	61.2	6%	0.058	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-86.9	166.6	175.9	-60.2	-179.7	0	0	0	111.6	Y36 P39 A40 Y208 V216 V218 I221 V225	Y36-L223 HydrophobicContact CD1-CD1 4.13Å; P39-L223 HydrophobicContact CB-CD2 4.24Å; A40-L223 HydrophobicContact CB-CD2 3.89Å; Y208-L223 HydrophobicContact CD1-CB 3.64Å; Y208-L223 WeakPolarHBondContact CD1-O 3.32Å; Y208-L223 HydrophobicContact CE1-CB 4.15Å; Y208-L223 WeakPolarHBondContact CE1-O 3.49Å; Y208-L223 HydrophobicContact CG-CB 4.02Å; V216-L223 HydrophobicContact CG1-CD1 4.14Å; V218-L223 HydrophobicContact CG1-CD1 3.95Å; I221-L223 HydrophobicContact CG2-CD2 3.65Å; I221-L223 HydrophobicContact CG2-CG 4.02Å; L223-V225 PolarHBondContact O-N 3.4Å
224	P	83.8	Confident	69.2	Low	74 Å²	74	62.7 Å²	62.7	48%	0.481	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-59.8	126.7	164.8	-22.1	34.1	0	0	0	110.7	P39 Q210	P39-P224 VanDerWaalsContact CB-CD 3.5Å; P39-P224 HydrophobicContact CB-CG 3.93Å; P39-P224 HydrophobicContact CG-CG 4.45Å; Q210-P224 PolarHBondContact NE2-O 3.38Å
225	V	76.3	Confident	66.3	Low	95 Å²	95	68.7 Å²	68.7	58%	0.576	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-76.1	148.5	171.1	-67.5	0	0	0	0	110.3	Y208 L223 A227	Y208-V225 HydrophobicContact CD1-CG1 3.82Å; Y208-V225 HydrophobicContact CE1-CG1 3.7Å; L223-V225 PolarHBondContact O-N 3.4Å; V225-A227 PolarHBondContact O-N 2.94Å
226	S	61.4	Low	63.4	Low	46 Å²	46	74.3 Å²	74.3	32%	0.322	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-69.6	126.7	-179.9	-161	0	0	0	0	111.5	Q210 G228 G229	Q210-S226 PolarHBondContact OE1-OG 2.83Å; S226-G228 PolarHBondContact O-N 3.17Å; S226-G229 PolarHBondContact O-N 2.8Å
227	A	47.3	Very low	60.7	Low	111 Å²	111	80.8 Å²	80.8	92%	0.917	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-5.9	-173.5	0	0	0	0	0	114.8	V225	V225-A227 PolarHBondContact O-N 2.94Å
228	G	43.5	Very low	58.1	Low	74 Å²	74	85 Å²	85	76%	0.763	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-10.8	170.5	0	0	0	0	0	114.7	S226 G230	S226-G228 PolarHBondContact O-N 3.17Å; G228-G230 PolarHBondContact O-N 2.8Å
229	G	38	Very low	55.5	Low	71 Å²	71	90.6 Å²	90.6	73%	0.732	59%	0.586	S	S	*	*			trans	-76.5	47.8	-173.2	0	0	0	0	0	115.9	S226	S226-G229 PolarHBondContact O-N 2.8Å
230	G	32.5	Very low	53	Low	51 Å²	51	97.4 Å²	97.4	53%	0.526	62%	0.62	S	S	.	*			trans	-65.9	151.2	169.8	0	0	0	0	0	111.9	G228	G228-G230 PolarHBondContact O-N 2.8Å
231	P	39.4	Very low	50.6	Low	98 Å²	98	102 Å²	102	64%	0.636	65%	0.646	S	S	*	*			trans	-59.7	155	170.4	28.8	-35.2	0	0	0	110	H233	P231-H233 PolarHBondContact O-CD2 3.42Å; P231-H233 PolarHBondContact O-N 3Å
232	P	37.6	Very low	48.2	Very low	135 Å²	135	107 Å²	107	88%	0.877	68%	0.679	S	S	*	*			trans	-64.5	94.7	-174	25.5	-34.6	0	0	0	111.5	K234	P232-K234 PolarHBondContact O-N 2.77Å
233	H	35.4	Very low	45.8	Very low	155 Å²	155	110.3 Å²	110.3	72%	0.718	70%	0.7	S	S	*	*			trans	-64.4	125.3	177.4	-84.3	-96.8	0	0	0	109.6	P231	P231-H233 PolarHBondContact O-CD2 3.42Å; P231-H233 PolarHBondContact O-N 3Å
234	K	34.6	Very low	43.1	Very low	182 Å²	182	113.3 Å²	113.3	79%	0.791	73%	0.733	S	S	*	*			trans	-53.3	141.9	164.5	-62.5	176.1	-179.1	177.2	0	108.3	P232 V236	P232-K234 PolarHBondContact O-N 2.77Å; K234-V236 PolarHBondContact O-N 2.77Å
235	P	35.1	Very low	40.7	Very low	136 Å²	136	119.4 Å²	119.4	88%	0.883	76%	0.755	S	S	*	*			trans	-62	112.5	-178.9	24.8	-33.6	0	0	0	110.4
236	V	33.6	Very low	38.6	Very low	130 Å²	130	120.2 Å²	120.2	79%	0.788	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-99.2	133.9	173.6	176.1	0	0	0	0	108.4	K234	K234-V236 PolarHBondContact O-N 2.77Å
237	L	39.5	Very low	37.2	Very low	150 Å²	150	124.4 Å²	124.4	79%	0.785	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-70.1	155.8	-178.8	-72.8	158.9	0	0	0	112
238	P	40.3	Very low	36.4	Very low	114 Å²	114	125.5 Å²	125.5	74%	0.74	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-59.7	141.1	178.8	-24	34.6	0	0	0	113.2
239	P	37.3	Very low	35.9	Very low	129 Å²	129	125.4 Å²	125.4	84%	0.838	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-69.2	145.1	178	-19.3	32.5	0	0	0	113.5
240	Q	38.3	Very low	36.3	Very low	185 Å²	185	127.6 Å²	127.6	86%	0.864	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-84.3	152.1	168.1	-68	-176.9	-77.1	0	0	111.9
241	P	39.6	Very low	36.2	Very low	115 Å²	115	130.6 Å²	130.6	75%	0.747	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-72.4	160	172.2	30.6	-35.1	0	0	0	113.1
242	P	40.6	Very low	35.7	Very low	119 Å²	119	135 Å²	135	77%	0.773	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-74.1	162.9	-173.3	30.2	-36.6	0	0	0	114.7
243	P	38.9	Very low	35.6	Very low	136 Å²	136	132.6 Å²	132.6	88%	0.883	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-79.8	132.9	-167.2	30.5	-35.9	0	0	0	115.1
244	G	33.1	Very low	35.9	Very low	74 Å²	74	130.9 Å²	130.9	76%	0.763	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-101.3	168.1	159.8	0	0	0	0	0	111.8
245	Q	32.5	Very low	36.3	Very low	201 Å²	201	127.4 Å²	127.4	94%	0.939	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-80.1	160.1	-169.6	-69.4	173.2	-16.4	0	0	114.5
246	S	32.6	Very low	37.2	Very low	112 Å²	112	126.8 Å²	126.8	78%	0.783	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-72.2	154.4	-170.4	53.8	0	0	0	0	116.5
247	V	30.9	Very low	37.1	Very low	135 Å²	135	128.9 Å²	128.9	82%	0.818	80%	0.8	S	S	*	*				-170.8	122.4	128.1	137.3	0	0	0	0	113.8
248	V	31.3	Very low	36.8	Very low	133 Å²	133	128.8 Å²	128.8	81%	0.806	80%	0.8	S	S	*	*			trans	47.4	98.9	148.1	-168.3	0	0	0	0	123.3
249	G	31.9	Very low	37.5	Very low	72 Å²	72	128.6 Å²	128.6	74%	0.742	80%	0.799	S	S	*	*				52.9	-179.7	125.9	0	0	0	0	0	124.3
250	P	47.6	Very low	37	Very low	118 Å²	118	126.3 Å²	126.3	77%	0.766	79%	0.791	S	S	*	*			cis	-138.1	168.5	-24.2	41.1	-25.4	0	0	0	116.2
251	S	29.9	Very low	36.7	Very low	114 Å²	114	126.3 Å²	126.3	80%	0.797	79%	0.791	S	S	*	*			trans	69.8	156.1	165	-58.2	0	0	0	0	117.6
252	Q	30.1	Very low	36.1	Very low	191 Å²	191	126.2 Å²	126.2	89%	0.893	79%	0.792	S	S	*	*			cis	-147.5	167	12.8	-149.9	170.5	42.7	0	0	112.2
253	A	34.4	Very low	35.5	Very low	84 Å²	84	131.7 Å²	131.7	69%	0.694	80%	0.799	S	S	*	*			trans	-121.1	-174.9	173.6	0	0	0	0	0	109.5
254	P	41.7	Very low	35	Very low	119 Å²	119	134.3 Å²	134.3	77%	0.773	80%	0.8	S	S	*	*			cis	-135.5	-140	8.4	45.8	-24.5	0	0	0	111.1
255	P	42.4	Very low	34.9	Very low	109 Å²	109	137.8 Å²	137.8	71%	0.708	80%	0.801	S	S	*	*			cis	-126.9	175.6	-26.5	39.5	-23.4	0	0	0	115
256	P	55.6	Low	34.9	Very low	122 Å²	122	136.3 Å²	136.3	79%	0.792	79%	0.794	S	S	*	*			trans	-107.1	157	175.4	39.1	-32.3	0	0	0	115.1
257	I	30.1	Very low	35.2	Very low	174 Å²	174	136.4 Å²	136.4	89%	0.892	79%	0.792	S	S	*	*			trans	-137.2	151.8	166.2	-66.3	-175.3	0	0	0	109.6
258	N	32.8	Very low	35.6	Very low	148 Å²	148	134.7 Å²	134.7	79%	0.791	79%	0.792	S	S	*	*			trans	-113.9	-158.4	-168.7	-150.3	3.4	0	0	0	112.1
259	P	56.2	Low	36.5	Very low	111 Å²	111	134 Å²	134	72%	0.721	78%	0.784	S	S	*	*				-117.5	167.2	-128	39.3	-21.5	0	0	0	115.7
260	A	27.6	Very low	38	Very low	80 Å²	80	134.1 Å²	134.1	66%	0.661	77%	0.77	S	S	*	*			trans	-154	113.1	174	0	0	0	0	0	114
261	H	31.9	Very low	37.9	Very low	186 Å²	186	133.9 Å²	133.9	86%	0.861	77%	0.768	S	S	*	*			trans	54.6	150.7	144.9	-46.6	-51.5	0	0	0	120.5
262	S	25.4	Very low	38.6	Very low	112 Å²	112	131.9 Å²	131.9	78%	0.783	76%	0.758	S	S	*	*			cis	-159.9	154.8	-10.7	38.3	0	0	0	0	109.7
263	Y	29.5	Very low	39.6	Very low	235 Å²	235	127.5 Å²	127.5	92%	0.922	74%	0.738	S	S	*	*			trans	-74.1	142.6	179.5	-70.1	-94.5	0	0	0	113.5
264	Q	26.8	Very low	41	Very low	190 Å²	190	127.2 Å²	127.2	89%	0.888	73%	0.727	S	S	*	*			trans	-136.6	137.1	143.1	-169.5	163.3	-5	0	0	109.2
265	N	32.5	Very low	41.5	Very low	147 Å²	147	124.1 Å²	124.1	79%	0.786	71%	0.712	S	S	*	*			trans	-113.7	123.6	-164.9	-169.3	10.5	0	0	0	110.8
266	Q	31.4	Very low	42.1	Very low	170 Å²	170	121.7 Å²	121.7	79%	0.794	70%	0.701	S	S	*	*			trans	-136	136.1	167.4	-79.3	-167	-23.5	0	0	109.6	A268	Q266-A268 PolarHBondContact O-N 2.7Å
267	P	39.3	Very low	42	Very low	114 Å²	114	121.3 Å²	121.3	74%	0.74	69%	0.689	S	S	*	*			trans	-73.9	125.6	177.1	30.1	-33.1	0	0	0	110.6	L269	P267-L269 PolarHBondContact O-N 2.9Å
268	A	38.7	Very low	43.6	Very low	100 Å²	100	119 Å²	119	83%	0.826	68%	0.675	S	S	*	*			trans	-68.4	115.5	170.6	0	0	0	0	0	109.9	Q266	Q266-A268 PolarHBondContact O-N 2.7Å
269	L	50.1	Low	44.4	Very low	119 Å²	119	114.9 Å²	114.9	62%	0.623	66%	0.662	S	S	*	*			trans	-70	145.9	174.2	-68.2	173.3	0	0	0	110.8	P267	P267-L269 PolarHBondContact O-N 2.9Å
270	T	64.1	Low	44.5	Very low	74 Å²	74	113.9 Å²	113.9	45%	0.454	65%	0.654	S	S	.	*			trans	-75.2	150.1	-178.5	62.6	0	0	0	0	111.6	A272 Q273 V274	T270-A272 PolarHBondContact O-N 2.87Å; T270-Q273 PolarHBondContact O-N 3.09Å; T270-Q273 PolarHBondContact OG1-OE1 3.02Å; T270-V274 PolarHBondContact O-N 2.81Å
271	P	45.9	Very low	45.5	Very low	113 Å²	113	114.4 Å²	114.4	73%	0.734	65%	0.645	S	S	*	*	H	α-helix	trans	-54.8	-29.6	178.2	-28.1	35.7	0	0	0	114.2	Q273 V274 A275	P271-Q273 VanDerWaalsContact C-N 3.31Å; P271-Q273 PolarHBondContact O-N 3.44Å; P271-V274 PolarHBondContact O-N 2.85Å; P271-A275 WeakPolarHBondContact O-CB 3.47Å; P271-A275 PolarHBondContact O-N 3.16Å
272	A	44.5	Very low	46.4	Very low	71 Å²	71	108.6 Å²	108.6	59%	0.587	63%	0.63	S	S	*	*	H	α-helix	trans	-62.3	-35.2	176.3	0	0	0	0	0	113.1	T270 A276	T270-A272 PolarHBondContact O-N 2.87Å; A272-A276 WeakPolarHBondContact O-CB 3.42Å; A272-A276 PolarHBondContact O-N 2.8Å
273	Q	51	Low	47.3	Very low	100 Å²	100	106.6 Å²	106.6	47%	0.467	62%	0.62	S	S	.	*	H	α-helix	trans	-74.9	-36.4	178.7	-67.5	165.7	-71.6	0	0	111.4	T270 P271 A276 Q277	T270-Q273 PolarHBondContact O-N 3.09Å; T270-Q273 PolarHBondContact OG1-OE1 3.02Å; P271-Q273 VanDerWaalsContact C-N 3.31Å; P271-Q273 PolarHBondContact O-N 3.44Å; Q273-A276 PolarHBondContact O-N 2.85Å; Q273-Q277 PolarHBondContact O-N 3.12Å
274	V	64.1	Low	48	Very low	78 Å²	78	101.4 Å²	101.4	47%	0.473	61%	0.608	S	S	.	*	H	α-helix	trans	-65.8	-42	174.1	-174.1	0	0	0	0	110.7	T270 P271 Q277 M278	T270-V274 PolarHBondContact O-N 2.81Å; P271-V274 PolarHBondContact O-N 2.85Å; V274-Q277 PolarHBondContact O-N 2.88Å; V274-M278 HydrophobicContact CG1-CE 4.37Å; V274-M278 PolarHBondContact O-N 2.84Å; V274-M278 VanDerWaalsContact O-N 3.17Å
275	A	52.3	Low	48.9	Very low	53 Å²	53	99 Å²	99	44%	0.438	60%	0.601	S	S	.	*	H	α-helix	trans	-64.3	-41.6	174.4	0	0	0	0	0	112.7	P271 Q277 M278 A279	P271-A275 WeakPolarHBondContact O-CB 3.47Å; P271-A275 PolarHBondContact O-N 3.16Å; A275-Q277 VanDerWaalsContact C-N 3.35Å; A275-Q277 PolarHBondContact O-N 2.82Å; A275-M278 PolarHBondContact O-N 2.79Å; A275-A279 PolarHBondContact O-N 2.99Å; A275-A279 VanDerWaalsContact O-N 3.15Å
276	A	53.8	Low	49.7	Very low	59 Å²	59	100.3 Å²	100.3	49%	0.488	60%	0.603	S	S	.	*	H	α-helix	trans	-62.1	-40.3	176.2	0	0	0	0	0	112.3	A272 Q273 A279 V280	A272-A276 WeakPolarHBondContact O-CB 3.42Å; A272-A276 PolarHBondContact O-N 2.8Å; Q273-A276 PolarHBondContact O-N 2.85Å; A276-A279 PolarHBondContact O-N 2.81Å; A276-V280 PolarHBondContact O-N 2.89Å
277	Q	54.4	Low	50.1	Low	114 Å²	114	101.2 Å²	101.2	53%	0.533	60%	0.604	S	S	.	*	H	α-helix	trans	-63.7	-48.5	177.3	-169.4	59.1	55.9	0	0	111.6	Q273 V274 A275 A279 V280 D281	Q273-Q277 PolarHBondContact O-N 3.12Å; V274-Q277 PolarHBondContact O-N 2.88Å; A275-Q277 VanDerWaalsContact C-N 3.35Å; A275-Q277 PolarHBondContact O-N 2.82Å; Q277-A279 PolarHBondContact O-N 2.95Å; Q277-V280 PolarHBondContact O-N 3.14Å; Q277-D281 PolarHBondContact NE2-OD2 2.89Å; Q277-D281 VanDerWaalsContact NE2-OD2 3.1Å; Q277-D281 PolarHBondContact O-N 3.21Å
278	M	62.3	Low	50	Low	124 Å²	124	103 Å²	103	61%	0.611	61%	0.608	S	S	*	*	H	α-helix	trans	-60.2	-31.4	177.8	-69.2	-171.4	-64.8	0	0	113.3	V274 A275 A282	V274-M278 HydrophobicContact CG1-CE 4.37Å; V274-M278 PolarHBondContact O-N 2.84Å; V274-M278 VanDerWaalsContact O-N 3.17Å; A275-M278 PolarHBondContact O-N 2.79Å; M278-A282 WeakPolarHBondContact O-CB 3.18Å; M278-A282 PolarHBondContact O-N 3.37Å; M278-A282 VanDerWaalsContact O-N 3.09Å
279	A	50.5	Low	49.9	Very low	63 Å²	63	109.3 Å²	109.3	52%	0.521	61%	0.61	S	S	.	*	H	α-helix	trans	-67.7	-34	175.6	0	0	0	0	0	113	A275 A276 Q277 A283	A275-A279 PolarHBondContact O-N 2.99Å; A275-A279 VanDerWaalsContact O-N 3.15Å; A276-A279 PolarHBondContact O-N 2.81Å; Q277-A279 PolarHBondContact O-N 2.95Å; A279-A283 PolarHBondContact O-N 2.81Å
280	V	57.9	Low	49.1	Very low	90 Å²	90	113.5 Å²	113.5	55%	0.545	62%	0.624	S	S	.	*	H	α-helix	trans	-72.9	-43.6	177.6	175.8	0	0	0	0	111.1	A276 Q277 A282 A283 N284	A276-V280 PolarHBondContact O-N 2.89Å; Q277-V280 PolarHBondContact O-N 3.14Å; V280-A282 VanDerWaalsContact C-N 3.32Å; V280-A282 PolarHBondContact O-N 2.84Å; V280-A283 PolarHBondContact O-N 3.17Å; V280-N284 PolarHBondContact O-N 3.13Å
281	D	48.1	Very low	47.5	Very low	90 Å²	90	116.8 Å²	116.8	48%	0.481	64%	0.644	S	S	.	*	H	α-helix	trans	-66.7	-32.5	177.8	-74	-64.3	0	0	0	112.7	Q277	Q277-D281 PolarHBondContact NE2-OD2 2.89Å; Q277-D281 VanDerWaalsContact NE2-OD2 3.1Å; Q277-D281 PolarHBondContact O-N 3.21Å
282	A	51.5	Low	46.7	Very low	64 Å²	64	115 Å²	115	53%	0.529	65%	0.646	S	S	.	*	H	α-helix	trans	-65.9	-42.5	171.2	0	0	0	0	0	112.6	M278 V280 N284 N285	M278-A282 WeakPolarHBondContact O-CB 3.18Å; M278-A282 PolarHBondContact O-N 3.37Å; M278-A282 VanDerWaalsContact O-N 3.09Å; V280-A282 VanDerWaalsContact C-N 3.32Å; V280-A282 PolarHBondContact O-N 2.84Å; A282-N284 PolarHBondContact O-N 3.2Å; A282-N285 PolarHBondContact O-N 3.14Å
283	A	43.8	Very low	46.2	Very low	70 Å²	70	120.1 Å²	120.1	58%	0.579	66%	0.661	S	S	*	*	H	α-helix	trans	-66.3	-35.9	-179	0	0	0	0	0	113	A279 V280 N285	A279-A283 PolarHBondContact O-N 2.81Å; V280-A283 PolarHBondContact O-N 3.17Å; A283-N285 VanDerWaalsContact C-N 3.3Å; A283-N285 PolarHBondContact O-N 3.45Å
284	N	44	Very low	45.2	Very low	127 Å²	127	119.2 Å²	119.2	68%	0.679	67%	0.671	S	S	*	*	H	α-helix	trans	-70.9	-24.9	-176.4	-151	14	0	0	0	112.9	V280 A282 Q286	V280-N284 PolarHBondContact O-N 3.13Å; A282-N284 PolarHBondContact O-N 3.2Å; N284-Q286 PolarHBondContact O-N 3.16Å
285	N	47.4	Very low	43.6	Very low	138 Å²	138	120.8 Å²	120.8	74%	0.738	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-76.3	-19.2	-175.8	-111.7	-66.2	0	0	0	115.1	A282 A283 K287	A282-N285 PolarHBondContact O-N 3.14Å; A283-N285 VanDerWaalsContact C-N 3.3Å; A283-N285 PolarHBondContact O-N 3.45Å; N285-K287 PolarHBondContact O-N 3.44Å
286	Q	47.8	Very low	42.6	Very low	175 Å²	175	123.6 Å²	123.6	82%	0.818	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-79.3	-14.2	-177.1	-74.6	-167.2	-21.4	0	0	114.5	N284 N288	N284-Q286 PolarHBondContact O-N 3.16Å; Q286-N288 VanDerWaalsContact C-N 3.33Å; Q286-N288 PolarHBondContact O-N 3.42Å
287	K	39.8	Very low	42.1	Very low	189 Å²	189	126.1 Å²	126.1	82%	0.822	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-81.2	-1.8	-168.6	-156.8	171.7	179.1	-179.7	0	115.4	N285	N285-K287 PolarHBondContact O-N 3.44Å
288	N	37.3	Very low	40.7	Very low	153 Å²	153	130.3 Å²	130.3	82%	0.818	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-123.6	33.2	-165.4	-147.5	27.1	0	0	0	115.3	Q286	Q286-N288 VanDerWaalsContact C-N 3.33Å; Q286-N288 PolarHBondContact O-N 3.42Å
289	R	36.7	Very low	39.1	Very low	232 Å²	232	131.7 Å²	131.7	88%	0.875	74%	0.735	S	S	*	*			trans	-136.1	47.4	-175.7	-149.9	-176.9	-169.1	-167.5	3.7	116.1
290	F	33.9	Very low	38.1	Very low	207 Å²	207	135 Å²	135	91%	0.908	74%	0.744	S	S	*	*			trans	-150.9	77	160.7	-137.2	-81.3	0	0	0	113.8
291	T	30.7	Very low	37	Very low	143 Å²	143	138.7 Å²	138.7	88%	0.877	76%	0.755	S	S	*	*			trans	-139.4	123.6	168.9	47.2	0	0	0	0	110.1
292	G	29.6	Very low	37	Very low	75 Å²	75	138.7 Å²	138.7	77%	0.773	76%	0.76	S	S	*	*			trans	121.9	96.8	169.2	0	0	0	0	0	116.3
293	I	33.3	Very low	36	Very low	179 Å²	179	142.9 Å²	142.9	92%	0.918	77%	0.772	S	S	*	*			trans	-162	147.4	134.4	-96.5	153.5	0	0	0	105.3
294	A	29.9	Very low	35.3	Very low	81 Å²	81	145.3 Å²	145.3	67%	0.669	79%	0.785	S	S	*	*			trans	-138.2	162.9	-170.4	0	0	0	0	0	112.2
295	S	29.8	Very low	34.8	Very low	111 Å²	111	144.4 Å²	144.4	78%	0.776	79%	0.788	S	S	*	*			trans	57.4	136	153.2	51.5	0	0	0	0	119.7
296	S	31.3	Very low	34.2	Very low	112 Å²	112	144 Å²	144	78%	0.783	79%	0.791	S	S	*	*			cis	-155.6	-140.5	-5.1	-79.3	0	0	0	0	109.4
297	P	42.9	Very low	33.9	Very low	111 Å²	111	141.4 Å²	141.4	72%	0.721	79%	0.789	S	S	*	*				-124.9	166.3	-100.7	39.7	-24.7	0	0	0	115.9
298	F	26.1	Very low	33.4	Very low	203 Å²	203	136 Å²	136	89%	0.89	79%	0.787	S	S	*	*			trans	-157.8	173.6	147.4	-112.2	-73.8	0	0	0	111.5
299	Q	28.4	Very low	33.8	Very low	153 Å²	153	134.5 Å²	134.5	72%	0.715	79%	0.786	S	S	*	*			trans	-114.6	157.3	-149.7	-62.4	170	-98.5	0	0	117.3
300	N	29.5	Very low	33.4	Very low	133 Å²	133	132.4 Å²	132.4	71%	0.711	78%	0.783	S	S	*	*			trans	55.1	115.9	144.1	-71.8	13.8	0	0	0	120.7
301	Q	35	Very low	33.3	Very low	167 Å²	167	131.8 Å²	131.8	78%	0.78	78%	0.783	S	S	*	*				94.9	155.4	72.3	-76.2	-113.1	-19.7	0	0	113.6
302	P	48.2	Very low	33.3	Very low	89 Å²	89	128.5 Å²	128.5	58%	0.578	78%	0.777	S	S	*	*			cis	-148.4	-175.1	-41.6	45.5	-28.5	0	0	0	116.1
303	I	31.2	Very low	33.4	Very low	153 Å²	153	133.7 Å²	133.7	79%	0.785	78%	0.781	S	S	*	*			trans	70	119.2	153.7	-67.4	160	0	0	0	121.4
304	S	28.9	Very low	33.9	Very low	121 Å²	121	130.5 Å²	130.5	85%	0.846	77%	0.772	S	S	*	*				-169.1	150.9	118.6	-79.7	0	0	0	0	112.7
305	S	32.5	Very low	33.9	Very low	108 Å²	108	132 Å²	132	76%	0.755	78%	0.778	S	S	*	*			trans	-115.7	-176.3	-177.5	48.8	0	0	0	0	111
306	V	35.3	Very low	34	Very low	130 Å²	130	134.4 Å²	134.4	79%	0.788	78%	0.781	S	S	*	*			cis	-153.3	-153	29.1	-128.6	0	0	0	0	110.5
307	P	41.6	Very low	34.4	Very low	119 Å²	119	135 Å²	135	77%	0.773	78%	0.782	S	S	*	*				-127.8	142.9	-89.3	34.8	-13.4	0	0	0	120.1
308	G	29.7	Very low	33.7	Very low	77 Å²	77	135.4 Å²	135.4	79%	0.794	78%	0.783	S	S	*	*			trans	71.3	-179.7	141.3	0	0	0	0	0	121.3
309	P	45.3	Very low	33.8	Very low	121 Å²	121	132.4 Å²	132.4	79%	0.786	78%	0.781	S	S	*	*			cis	-137.6	145.7	-6.4	39.8	-21.6	0	0	0	118.8
310	K	27.8	Very low	33.9	Very low	187 Å²	187	130.8 Å²	130.8	81%	0.813	78%	0.781	S	S	*	*			trans	40.6	119.8	143.4	-59	-176.3	178.5	-177.5	0	124
311	H	32.3	Very low	33.9	Very low	195 Å²	195	130.9 Å²	130.9	90%	0.903	79%	0.787	S	S	*	*				155.8	148.9	121.7	-85.4	94.5	0	0	0	109.6
312	G	30.2	Very low	33.6	Very low	74 Å²	74	128.2 Å²	128.2	76%	0.763	78%	0.782	S	S	*	*			cis	178.6	141.7	-8.7	0	0	0	0	0	109.8
313	Q	32.4	Very low	32.7	Very low	184 Å²	184	131.7 Å²	131.7	86%	0.86	80%	0.796	S	S	*	*			trans	-150.5	138.9	-168.6	-176.1	-174	21	0	0	113.5
314	P	44	Very low	32.5	Very low	112 Å²	112	132.9 Å²	132.9	73%	0.727	80%	0.798	S	S	*	*			trans	-104.7	146.1	154.2	35.4	-26.5	0	0	0	110.8
315	S	30	Very low	32.6	Very low	112 Å²	112	134.8 Å²	134.8	78%	0.783	80%	0.798	S	S	*	*			cis	112	114.1	24	-74.2	0	0	0	0	111.1
316	L	31.4	Very low	32.5	Very low	161 Å²	161	135.8 Å²	135.8	84%	0.843	80%	0.799	S	S	*	*			trans	-91.2	164.3	172.1	-59.7	88.2	0	0	0	111.1
317	P	39.9	Very low	32.2	Very low	124 Å²	124	137.2 Å²	137.2	81%	0.805	80%	0.799	S	S	*	*			trans	-99.9	153.7	146	35.2	-28.6	0	0	0	111.9
318	T	27.3	Very low	32.2	Very low	121 Å²	121	137.5 Å²	137.5	74%	0.742	80%	0.801	S	S	*	*			trans	-119.4	150.5	178.1	-57.7	0	0	0	0	110
319	V	28.6	Very low	32.2	Very low	140 Å²	140	141.8 Å²	141.8	85%	0.848	80%	0.801	S	S	*	*			trans	-124.7	138.5	167.1	178	0	0	0	0	109.3
320	T	30.4	Very low	31.4	Very low	118 Å²	118	145.1 Å²	145.1	72%	0.724	81%	0.806	S	S	*	*			trans	-118.3	133.5	-173.1	-55.2	0	0	0	0	110
321	T	29.9	Very low	31.6	Very low	135 Å²	135	142.3 Å²	142.3	83%	0.828	80%	0.804	S	S	*	*			trans	-137.5	148.6	163.7	-58.6	0	0	0	0	109.4
322	V	29.2	Very low	32.3	Very low	112 Å²	112	138.7 Å²	138.7	68%	0.679	80%	0.798	S	S	*	*			trans	-110.9	150.7	-170.5	-160.3	0	0	0	0	110
323	N	29.8	Very low	33	Very low	161 Å²	161	141 Å²	141	86%	0.861	80%	0.799	S	S	*	*			trans	-172.5	153.1	131.5	-95.7	-11.4	0	0	0	112.5
324	Q	26.9	Very low	32.9	Very low	179 Å²	179	138.6 Å²	138.6	84%	0.836	79%	0.792	S	S	*	*			trans	-117	160.9	167.7	-61.3	175	-5.6	0	0	108.4
325	L	29.7	Very low	33.1	Very low	161 Å²	161	138.5 Å²	138.5	84%	0.843	79%	0.792	S	S	*	*			trans	-176.2	128.2	139.1	-101.5	165.3	0	0	0	112.8
326	T	31.5	Very low	33	Very low	128 Å²	128	141 Å²	141	79%	0.785	79%	0.791	S	S	*	*			trans	35.8	137.3	149.2	44.9	0	0	0	0	124
327	M	28.6	Very low	33	Very low	160 Å²	160	141.8 Å²	141.8	79%	0.788	79%	0.79	S	S	*	*			trans	-90.6	169.9	169.2	-149	-158.2	-72.4	0	0	111.6	Q329	M327-Q329 HydrophobicContact SD-CB 4.31Å; M327-Q329 PolarHBondContact SD-N 2.64Å
328	P	41.6	Very low	32.5	Very low	125 Å²	125	139.5 Å²	139.5	81%	0.812	78%	0.782	S	S	*	*				-149.7	139.1	87.2	37.5	-18.4	0	0	0	118.7
329	Q	28.8	Very low	32.8	Very low	168 Å²	168	140.3 Å²	140.3	79%	0.785	79%	0.787	S	S	*	*			trans	-4.9	133.8	147.2	179.7	176.3	77.3	0	0	122.2	M327	M327-Q329 HydrophobicContact SD-CB 4.31Å; M327-Q329 PolarHBondContact SD-N 2.64Å
330	Q	29	Very low	33.5	Very low	190 Å²	190	139.2 Å²	139.2	89%	0.888	78%	0.782	S	S	*	*			trans	-157.8	158.2	151.2	-134.7	174.2	4	0	0	112.9
331	V	32.4	Very low	34.2	Very low	128 Å²	128	139.1 Å²	139.1	78%	0.776	78%	0.784	S	S	*	*			trans	-161	166.1	-175.6	-76.2	0	0	0	0	111.6
332	P	47.2	Very low	35.2	Very low	120 Å²	120	139.1 Å²	139.1	78%	0.779	79%	0.786	S	S	*	*			cis	-109.9	-101.7	-26.2	31.2	-10.1	0	0	0	109.6
333	P	45.6	Very low	35.3	Very low	121 Å²	121	137 Å²	137	79%	0.786	79%	0.787	S	S	*	*			cis	-117	-159.2	-16.3	43.6	-27.6	0	0	0	113.6
334	N	29.1	Very low	35.4	Very low	134 Å²	134	138 Å²	138	72%	0.717	79%	0.787	S	S	*	*			trans	-158.6	145.8	179.4	166.5	92.7	0	0	0	113
335	P	47.4	Very low	35.6	Very low	111 Å²	111	137.1 Å²	137.1	72%	0.721	79%	0.787	S	S	*	*			trans	-138.7	144.5	143.6	42.2	-29.4	0	0	0	112
336	Q	29.2	Very low	35.6	Very low	164 Å²	164	136 Å²	136	77%	0.766	79%	0.787	S	S	*	*				49.8	140	60.3	-68	-173.5	-17.3	0	0	113.3
337	Q	30.6	Very low	35.5	Very low	177 Å²	177	133.3 Å²	133.3	83%	0.827	78%	0.784	S	S	*	*			cis	-150.7	-166.6	9.4	-142.5	-174.7	101.7	0	0	107
338	A	30.1	Very low	35.6	Very low	77 Å²	77	130.6 Å²	130.6	64%	0.636	78%	0.781	S	S	*	*			cis	-160.4	-172.5	4	0	0	0	0	0	110.3
339	V	33.3	Very low	35.1	Very low	138 Å²	138	134 Å²	134	84%	0.836	79%	0.786	S	S	*	*			trans	-141.2	133.7	173.3	174.9	0	0	0	0	110.1
340	P	42.9	Very low	35.1	Very low	116 Å²	116	133.7 Å²	133.7	75%	0.753	78%	0.784	S	S	*	*			trans	-151.2	-159.6	136.5	39.9	-19	0	0	0	113.4
341	P	46	Very low	35.5	Very low	117 Å²	117	130.7 Å²	130.7	76%	0.76	78%	0.781	S	S	*	*				-127.7	179.8	-88.9	41.3	-23.1	0	0	0	115.5
342	P	50.8	Low	35.3	Very low	134 Å²	134	132.2 Å²	132.2	87%	0.87	78%	0.78	S	S	*	*			trans	-112	174.3	-171.2	41.5	-34.7	0	0	0	116.7
343	G	31.8	Very low	35.3	Very low	69 Å²	69	131.2 Å²	131.2	71%	0.711	77%	0.774	S	S	*	*			trans	-175.2	138.1	165.8	0	0	0	0	0	119.3
344	Q	31.7	Very low	34.6	Very low	182 Å²	182	133.4 Å²	133.4	85%	0.85	78%	0.778	S	S	*	*			trans	59.3	118	148	-54.4	-174.1	21.5	0	0	120
345	L	29.5	Very low	34.6	Very low	159 Å²	159	135.3 Å²	135.3	83%	0.832	78%	0.783	S	S	*	*				68.6	142.4	83.3	-62.2	172.6	0	0	0	113.8
346	V	31.5	Very low	34.7	Very low	139 Å²	139	135 Å²	135	84%	0.842	78%	0.781	S	S	*	*				-158.9	144.7	52.2	177.2	0	0	0	0	113.2
347	G	29.1	Very low	34.6	Very low	70 Å²	70	134.4 Å²	134.4	72%	0.722	79%	0.789	S	S	*	*			trans	71.3	161.8	147.1	0	0	0	0	0	121.2
348	S	29.5	Very low	34.8	Very low	104 Å²	104	130 Å²	130	73%	0.727	78%	0.783	S	S	*	*			cis	-169.3	147.5	-14.6	58	0	0	0	0	114.3
349	Q	30.9	Very low	35.2	Very low	195 Å²	195	132.6 Å²	132.6	91%	0.911	79%	0.793	S	S	*	*			trans	79	148.8	154.9	-68.1	179.1	47.2	0	0	122.6
350	Q	29.7	Very low	35.1	Very low	163 Å²	163	131.5 Å²	131.5	76%	0.762	79%	0.792	S	S	*	*			trans	-118.1	167.7	176.7	-127.3	-179.9	-37.6	0	0	107.1
351	P	37.9	Very low	34.6	Very low	126 Å²	126	130.9 Å²	130.9	82%	0.818	80%	0.796	S	S	*	*				-151.8	-172.1	60.8	40.2	-17.3	0	0	0	117.3
352	Q	28.5	Very low	34.1	Very low	161 Å²	161	134.2 Å²	134.2	75%	0.752	80%	0.802	S	S	*	*			trans	-102.4	-173	173.4	-99.9	179.6	-71	0	0	110.9
353	P	47.2	Very low	33.8	Very low	99 Å²	99	133.5 Å²	133.5	64%	0.643	80%	0.797	S	S	*	*			cis	-134.3	172	-36.6	36.8	-21.3	0	0	0	113.6
354	N	28.8	Very low	33.8	Very low	166 Å²	166	137 Å²	137	89%	0.888	80%	0.799	S	S	*	*				-179.4	167.9	129.9	-106.6	-1.6	0	0	0	116.3
355	Q	29.7	Very low	33.8	Very low	174 Å²	174	136.2 Å²	136.2	81%	0.813	80%	0.8	S	S	*	*			trans	-129	-177.9	172	-109	-168	-5.4	0	0	108.1
356	P	49.9	Very low	34	Very low	104 Å²	104	133.1 Å²	133.1	68%	0.675	80%	0.796	S	S	*	*			cis	-136.3	163.3	-35.6	36.9	-21.5	0	0	0	113.7
357	T	27.5	Very low	33.9	Very low	152 Å²	152	130.3 Å²	130.3	93%	0.933	80%	0.796	S	S	*	*			trans	-158.5	153.2	154.7	4.8	0	0	0	0	112.7
358	A	33.6	Very low	34.1	Very low	85 Å²	85	133.7 Å²	133.7	70%	0.702	80%	0.802	S	S	*	*			trans	-103.8	168.7	167.2	0	0	0	0	0	110.3
359	P	38.4	Very low	34.9	Very low	131 Å²	131	135 Å²	135	85%	0.851	81%	0.808	S	S	*	*				-145.4	175.7	97.4	38.7	-23	0	0	0	116.3
360	S	32.8	Very low	34.8	Very low	116 Å²	116	129.5 Å²	129.5	81%	0.811	80%	0.804	S	S	*	*			trans	-69.9	158.1	-175.9	53.2	0	0	0	0	117.5
361	A	30.7	Very low	34.8	Very low	103 Å²	103	125.7 Å²	125.7	85%	0.851	81%	0.808	S	S	*	*			trans	-149.7	130.1	147.2	0	0	0	0	0	112.3
362	Q	35.8	Very low	34.3	Very low	187 Å²	187	128.6 Å²	128.6	87%	0.874	81%	0.811	S	S	*	*			trans	-158	134.8	167	-142.4	-171	7.2	0	0	110
363	P	45.9	Very low	34.3	Very low	118 Å²	118	127.9 Å²	127.9	77%	0.766	82%	0.817	S	S	*	*			trans	-134.7	141.9	137.3	29	-13.4	0	0	0	111.2
364	N	31.8	Very low	33.5	Very low	142 Å²	142	129.9 Å²	129.9	76%	0.759	83%	0.828	S	S	*	*			cis	95.2	120.5	34.5	-176.8	40	0	0	0	113.9
365	I	31.6	Very low	33.4	Very low	167 Å²	167	126.4 Å²	126.4	86%	0.856	82%	0.822	S	S	*	*			trans	-179.2	145	160.6	-95.1	148.9	0	0	0	106.2
366	A	32.6	Very low	33.8	Very low	93 Å²	93	126 Å²	126	77%	0.769	83%	0.826	S	S	*	*			cis	-165.4	146.1	-33.9	0	0	0	0	0	107.5
367	G	29.7	Very low	33.3	Very low	80 Å²	80	126.8 Å²	126.8	83%	0.825	83%	0.831	S	S	*	*			trans	163.8	107.3	174.9	0	0	0	0	0	115.7
368	V	33.7	Very low	33.5	Very low	142 Å²	142	128.6 Å²	128.6	86%	0.861	83%	0.831	S	S	*	*			trans	-137.6	173.9	177.5	-82.5	0	0	0	0	108.7
369	P	45.5	Very low	33.5	Very low	130 Å²	130	128 Å²	128	84%	0.844	83%	0.834	S	S	*	*			cis	-120.6	-173.5	-10	21.3	3.3	0	0	0	111.5
370	G	29.6	Very low	33.1	Very low	80 Å²	80	129.8 Å²	129.8	83%	0.825	83%	0.83	S	S	*	*			cis	163.1	162.4	-6.3	0	0	0	0	0	111.2
371	G	29.5	Very low	33.4	Very low	83 Å²	83	130 Å²	130	86%	0.856	83%	0.829	S	S	*	*			trans	165.7	116.4	178.4	0	0	0	0	0	112
372	Q	28.4	Very low	33.6	Very low	188 Å²	188	135 Å²	135	88%	0.879	84%	0.835	S	S	*	*			trans	-105.3	141.9	-174.8	-63.2	170.3	-39.3	0	0	111.1
373	V	28.4	Very low	34	Very low	146 Å²	146	129.2 Å²	129.2	89%	0.885	83%	0.825	S	S	*	*				-166.7	153.8	102.8	-89.5	0	0	0	0	112.4
374	T	28.8	Very low	34	Very low	141 Å²	141	126.9 Å²	126.9	87%	0.865	81%	0.805	S	S	*	*			trans	-64.7	142	-173.8	46.7	0	0	0	0	117.1
375	A	28.6	Very low	35	Very low	93 Å²	93	124.2 Å²	124.2	77%	0.769	80%	0.802	S	S	*	*				-165.7	137	125.4	0	0	0	0	0	112.1
376	N	37.7	Very low	36.7	Very low	166 Å²	166	121.8 Å²	121.8	89%	0.888	79%	0.791	S	S	*	*			trans	-80.3	145.6	166.9	-76.3	-6	0	0	0	110.7
377	P	38.6	Very low	38.9	Very low	120 Å²	120	120.2 Å²	120.2	78%	0.779	77%	0.767	S	S	*	*			trans	-108.8	129.7	140.6	-7.5	27	0	0	0	111.1
378	M	31.9	Very low	41.7	Very low	189 Å²	189	120 Å²	120	93%	0.931	75%	0.749	S	S	*	*			trans	-83.6	123	174.5	180	157.2	55.1	0	0	110.6
379	G	32.9	Very low	44.4	Very low	74 Å²	74	117.6 Å²	117.6	76%	0.763	73%	0.73	S	S	*	*			trans	49.1	80.2	159.9	0	0	0	0	0	118.1
380	Q	30.5	Very low	46.6	Very low	167 Å²	167	112.6 Å²	112.6	78%	0.78	70%	0.7	S	S	*	*			trans	-90	146.3	155.7	-75	-168.6	-12.2	0	0	110.9	Q382	Q380-Q382 PolarHBondContact O-N 3.28Å
381	P	39.2	Very low	49.6	Very low	120 Å²	120	109.5 Å²	109.5	78%	0.779	66%	0.663	S	S	*	*			trans	-65.9	128.1	171	-17.5	31.2	0	0	0	111.3	G383	P381-G383 PolarHBondContact O-N 3.09Å
382	Q	35.4	Very low	52.7	Low	209 Å²	209	108.6 Å²	108.6	98%	0.977	64%	0.641	S	S	*	*	S	Bend	trans	-70.7	89.3	176.5	-71.6	169.4	-95.2	0	0	111	Q380	Q380-Q382 PolarHBondContact O-N 3.28Å
383	G	42.9	Very low	55.9	Low	65 Å²	65	100 Å²	100	67%	0.67	60%	0.603	S	S	*	*			trans	-164.4	9.2	177	0	0	0	0	0	116.1	P381	P381-G383 PolarHBondContact O-N 3.09Å
384	M	47.3	Very low	59	Low	69 Å²	69	95.4 Å²	95.4	34%	0.34	58%	0.575	S	S	.	*			trans	-101.9	-6.1	-170.7	-146.8	72.2	-175.5	0	0	114.8	N386 K387 F420 L462	M384-N386 VanDerWaalsContact C-N 3.3Å; M384-N386 PolarHBondContact O-N 2.85Å; M384-N386 VanDerWaalsContact O-N 3.16Å; M384-K387 PolarHBondContact O-N 2.88Å; M384-F420 HydrophobicContact CE-CD1 3.53Å; M384-F420 HydrophobicContact CE-CD2 3.74Å; M384-F420 HydrophobicContact CE-CE1 3.47Å; M384-F420 VanDerWaalsContact CE-CE1 3.47Å; M384-F420 HydrophobicContact CE-CE2 3.68Å; M384-F420 HydrophobicContact CE-CG 3.66Å; M384-F420 HydrophobicContact CE-CZ 3.56Å; M384-L462 HydrophobicContact CE-CD2 4.44Å
385	A	52.2	Low	62.2	Low	86 Å²	86	88.7 Å²	88.7	71%	0.711	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-30.1	-163.8	0	0	0	0	0	115.3	Q423	A385-Q423 PolarHBondContact O-NE2 3.35Å
386	N	67.5	Low	65.4	Low	117 Å²	117	85.9 Å²	85.9	63%	0.626	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	18	-169.9	-62.3	8.7	0	0	0	113.4	M384 Q423	M384-N386 VanDerWaalsContact C-N 3.3Å; M384-N386 PolarHBondContact O-N 2.85Å; M384-N386 VanDerWaalsContact O-N 3.16Å; N386-Q423 WeakPolarHBondContact O-CG 3.5Å; N386-Q423 PolarHBondContact O-N 3.49Å
387	K	78.8	Confident	68	Low	59 Å²	59	78 Å²	78	26%	0.257	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	139.1	-174.3	-58.6	-160	-179.8	-156.8	0	113.5	M384 F420 V421 N422	M384-K387 PolarHBondContact O-N 2.88Å; K387-F420 HydrophobicContact CB-CB 4.33Å; K387-F420 HydrophobicContact CB-CD1 4.42Å; K387-V421 CarbonylContact C-O 3.6Å; K387-V421 VanDerWaalsContact CA-O 3.28Å; K387-V421 WeakPolarHBondContact CA-O 3.47Å; K387-V421 WeakPolarHBondContact CB-O 3.22Å; K387-N422 WeakPolarHBondContact CE-OD1 3.16Å; K387-N422 PolarHBondContact NZ-OD1 2.94Å
388	V	88.6	Confident	70.4	Confident	75 Å²	75	76.3 Å²	76.3	46%	0.455	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	137.6	179	-172.1	0	0	0	0	109	A390 F420 V421 Q423	V388-A390 PolarHBondContact O-N 2.84Å; V388-F420 CarbonylContact O-C 3.57Å; V388-F420 VanDerWaalsContact O-CA 3.26Å; V388-F420 WeakPolarHBondContact O-CA 3.46Å; V388-V421 HydrophobicContact CB-CG2 4.34Å; V388-V421 PolarHBondContact N-O 3.4Å; V388-V421 PolarHBondContact O-N 3.44Å; V388-Q423 HydrophobicContact CG2-CG 3.65Å
389	M	90.1	Very high	72.7	Confident	93 Å²	93	69.2 Å²	69.2	46%	0.458	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	112.7	170	-175.7	-178.1	69.7	0	0	108.8	Q418 F420	M389-Q418 HydrophobicContact SD-CB 4.42Å; M389-Q418 HydrophobicContact SD-CG 4Å; M389-F420 HydrophobicContact CB-CD1 4.04Å; M389-F420 HydrophobicContact CB-CE1 3.67Å; M389-F420 HydrophobicContact CB-CZ 4.11Å; M389-F420 HydrophobicContact CG-CE1 4.34Å; M389-F420 HydrophobicContact CG-CZ 4.3Å
390	A	91.3	Very high	74.2	Confident	25 Å²	25	74.6 Å²	74.6	21%	0.207	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-33.2	178.8	0	0	0	0	0	112.4	V388 V419 V421 T429	V388-A390 PolarHBondContact O-N 2.84Å; A390-V419 PolarHBondContact N-O 3.18Å; A390-V421 HydrophobicContact CB-CG1 3.78Å; A390-V421 HydrophobicContact CB-CG2 4.04Å; A390-T429 HydrophobicContact CB-CG2 3.86Å; A390-T429 VanDerWaalsContact O-CB 3.31Å; A390-T429 WeakPolarHBondContact O-CB 3.43Å; A390-T429 PolarHBondContact O-OG1 3.44Å
391	W	94	Very high	75.5	Confident	14 Å²	14	70 Å²	70	5%	0.053	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	157.7	-178.4	-179.5	86.4	0	0	0	112.5	G393 Q418 V419 T429 W432 P433 L436	W391-G393 VanDerWaalsContact CH2-CA 3.41Å; W391-Q418 CarbonylContact O-C 3.57Å; W391-Q418 WeakPolarHBondContact O-CA 3.12Å; W391-V419 HydrophobicContact CB-CB 4.26Å; W391-V419 HydrophobicContact CE3-CB 4.38Å; W391-V419 HydrophobicContact CE3-CG2 3.78Å; W391-V419 HydrophobicContact CZ3-CG2 4.35Å; W391-V419 PolarHBondContact N-O 2.83Å; W391-V419 PolarHBondContact O-N 3.49Å; W391-T429 HydrophobicContact CB-CG2 3.97Å; W391-W432 HydrophobicContact CB-CE3 4.36Å; W391-W432 AromaticContact CD2-CE3 3.99Å; W391-W432 HydrophobicContact CD2-CE3 3.99Å; W391-W432 HydrophobicContact CE3-CE3 4.38Å; W391-W432 HydrophobicContact CG-CB 4.31Å; W391-W432 AromaticContact CG-CE3 3.99Å; W391-W432 HydrophobicContact CG-CE3 3.99Å; W391-W432 PolarHBondContact NE1-O 3.24Å; W391-P433 VanDerWaalsContact CZ2-O 3.3Å; W391-P433 WeakPolarHBondContact CZ2-O 3.49Å; W391-L436 HydrophobicContact CE3-CD1 4.39Å; W391-L436 HydrophobicContact CH2-CD1 3.53Å; W391-L436 HydrophobicContact CH2-CG 3.74Å; W391-L436 HydrophobicContact CZ2-CD1 4.13Å; W391-L436 HydrophobicContact CZ2-CG 4.09Å; W391-L436 HydrophobicContact CZ3-CD1 3.69Å; W391-L436 HydrophobicContact CZ3-CG 4.41Å
392	T	94.7	Very high	76	Confident	65 Å²	65	73.2 Å²	73.2	40%	0.399	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	143.1	172.9	-177.4	0	0	0	0	110.2	C417	T392-C417 WeakPolarHBondContact CA-O 3.45Å
393	G	94.1	Very high	76.4	Confident	8 Å²	8	68.9 Å²	68.9	8%	0.082	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171	-155.7	179.4	0	0	0	0	0	112.2	W391 P416 C417 Q434	W391-G393 VanDerWaalsContact CH2-CA 3.41Å; G393-P416 CarbonylContact O-C 3.59Å; G393-P416 WeakPolarHBondContact O-CA 3.42Å; G393-C417 PolarHBondContact N-O 3.3Å; G393-C417 PolarHBondContact O-N 2.9Å; G393-C417 VanDerWaalsContact O-O 3.08Å; G393-Q434 WeakPolarHBondContact CA-O 3.41Å
394	V	94.9	Very high	76.4	Confident	49 Å²	49	71 Å²	71	30%	0.297	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	132.7	-174.7	-178.9	0	0	0	0	111.2	Q434 K435 L436	V394-Q434 PolarHBondContact N-O 3.22Å; V394-K435 CarbonylContact O-C 3.58Å; V394-K435 WeakPolarHBondContact O-CA 3.48Å; V394-L436 PolarHBondContact O-N 3.24Å
395	L	95.6	Very high	76	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	123.1	170.1	-171.1	72.6	0	0	0	109.8	S414 L415 L436 M438 F463 V486 L502	L395-S414 CarbonylContact O-C 3.52Å; L395-S414 VanDerWaalsContact O-CA 3.23Å; L395-S414 WeakPolarHBondContact O-CA 3.01Å; L395-L415 PolarHBondContact N-O 3.28Å; L395-L415 PolarHBondContact O-N 3.36Å; L395-L436 HydrophobicContact CD1-CB 3.79Å; L395-M438 HydrophobicContact CD1-CB 3.99Å; L395-M438 HydrophobicContact CD2-SD 3.89Å; L395-M438 HydrophobicContact CG-CB 4.26Å; L395-M438 HydrophobicContact CG-SD 4.48Å; L395-F463 HydrophobicContact CB-CE1 4.21Å; L395-F463 HydrophobicContact CD2-CE1 3.86Å; L395-F463 HydrophobicContact CD2-CZ 3.66Å; L395-V486 HydrophobicContact CD1-CG2 3.75Å; L395-L502 HydrophobicContact CD2-CD2 3.46Å; L395-L502 VanDerWaalsContact CD2-CD2 3.46Å
396	E	94.7	Very high	75.4	Confident	34 Å²	34	77.2 Å²	77.2	16%	0.159	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	142	178.1	177.3	174.1	88.8	0	0	111.9	T412 R413 K435 L436 I437 M438	E396-T412 VanDerWaalsContact CD-CG2 3.4Å; E396-T412 HydrophobicContact CG-CG2 3.51Å; E396-R413 CarbonylContact C-O 3.53Å; E396-R413 VanDerWaalsContact CA-O 3.28Å; E396-R413 WeakPolarHBondContact CA-O 3.35Å; E396-R413 WeakPolarHBondContact CG-O 3.41Å; E396-K435 WeakPolarHBondContact OE1-CE 3.28Å; E396-K435 IonicContact OE1-NZ 3Å; E396-K435 PolarHBondContact OE1-NZ 2.91Å; E396-K435 WeakPolarHBondContact OE2-CE 3.43Å; E396-K435 IonicContact OE2-NZ 2.83Å; E396-K435 PolarHBondContact OE2-NZ 3.25Å; E396-L436 PolarHBondContact N-O 3.32Å; E396-I437 HydrophobicContact CB-CD1 4.06Å; E396-I437 HydrophobicContact CG-CD1 4.48Å; E396-M438 WeakPolarHBondContact O-CB 3.35Å; E396-M438 PolarHBondContact O-N 2.86Å
397	W	93.5	Very high	74.1	Confident	1 Å²	1	77.6 Å²	77.6	0%	0.004	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	163.2	172.8	67.2	92.9	0	0	0	112.8	E399 T412 R413 L415 M438 L474	W397-E399 PolarHBondContact NE1-OE1 2.91Å; W397-T412 WeakPolarHBondContact O-CA 3.37Å; W397-R413 HydrophobicContact CD2-CB 4.16Å; W397-R413 HydrophobicContact CH2-CB 4.12Å; W397-R413 HydrophobicContact CZ2-CB 3.65Å; W397-R413 HydrophobicContact CZ2-CG 4.35Å; W397-R413 PolarHBondContact N-O 2.87Å; W397-R413 PolarHBondContact O-N 2.96Å; W397-L415 HydrophobicContact CH2-CD1 3.62Å; W397-L415 HydrophobicContact CH2-CG 3.77Å; W397-L415 HydrophobicContact CZ3-CB 4.41Å; W397-L415 HydrophobicContact CZ3-CD1 3.98Å; W397-L415 HydrophobicContact CZ3-CG 3.95Å; W397-M438 WeakPolarHBondContact CA-O 3.45Å; W397-M438 HydrophobicContact CB-CB 4.19Å; W397-M438 HydrophobicContact CB-CE 3.48Å; W397-M438 VanDerWaalsContact CB-CE 3.48Å; W397-M438 WeakPolarHBondContact CB-O 3.47Å; W397-M438 HydrophobicContact CD2-CE 3.74Å; W397-M438 HydrophobicContact CE3-CE 3.85Å; W397-M438 HydrophobicContact CG-CE 3.63Å; W397-L474 HydrophobicContact CD2-CD1 4.43Å; W397-L474 HydrophobicContact CE3-CD1 4.47Å; W397-L474 HydrophobicContact CH2-CB 3.89Å; W397-L474 HydrophobicContact CH2-CD1 4.15Å; W397-L474 HydrophobicContact CH2-CD2 4.06Å; W397-L474 HydrophobicContact CH2-CG 4.26Å; W397-L474 HydrophobicContact CZ2-CB 3.93Å; W397-L474 HydrophobicContact CZ2-CD1 4.09Å; W397-L474 HydrophobicContact CZ2-CG 4.47Å; W397-L474 HydrophobicContact CZ3-CD1 4.34Å; W397-L474 HydrophobicContact CZ3-CD2 4.16Å
398	Q	87.4	Confident	72.5	Confident	84 Å²	84	80.4 Å²	80.4	39%	0.393	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	118.6	174.2	-69	174.6	12.7	0	0	110	K410	Q398-K410 VanDerWaalsContact OE1-NZ 3.1Å
399	E	81.6	Confident	70.9	Confident	40 Å²	40	81.9 Å²	81.9	19%	0.187	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.7	167.7	-77.3	161	-140.6	0	0	109.7	W397 L411 R413 L440 I477	W397-E399 PolarHBondContact NE1-OE1 2.91Å; E399-L411 HydrophobicContact CB-CB 4.28Å; E399-L411 PolarHBondContact N-O 2.89Å; E399-L411 PolarHBondContact O-N 3.38Å; E399-R413 WeakPolarHBondContact OE1-CD 3.49Å; E399-R413 IonicContact OE1-CZ 2.97Å; E399-R413 IonicContact OE1-NE 3.63Å; E399-R413 PolarHBondContact OE1-NE 3.1Å; E399-R413 IonicContact OE2-NE 3.81Å; E399-R413 PolarHBondContact OE2-NE 3.48Å; E399-R413 IonicContact OE2-NH2 2.81Å; E399-L440 HydrophobicContact CG-CD1 4.41Å; E399-I477 HydrophobicContact CG-CD1 3.85Å; E399-I477 WeakPolarHBondContact OE1-CD1 3.39Å
400	K	64.2	Low	69.7	Low	186 Å²	186	83.6 Å²	83.6	81%	0.809	47%	0.471	S	S	*	.	P	Polyproline II helix	trans	-93.9	119.5	168.7	-73.7	-177.9	177.9	176.3	0	108.7
401	P	57.9	Low	69.2	Low	72 Å²	72	86.4 Å²	86.4	47%	0.468	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-56.5	151.6	171.5	-25.2	34.9	0	0	0	112.1
402	K	49.8	Very low	68.9	Low	187 Å²	187	88.8 Å²	88.8	81%	0.813	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-69.4	142.1	163.4	-70.3	-176.1	178	-179.5	0	108.3	S404	K402-S404 VanDerWaalsContact C-N 3.27Å; K402-S404 PolarHBondContact O-N 3.41Å
403	A	43.1	Very low	68.7	Low	117 Å²	117	89 Å²	89	97%	0.967	49%	0.492	S	S	*	.	S	Bend	trans	-76.6	72.3	-171.6	0	0	0	0	0	112.2
404	S	43.1	Very low	68.7	Low	111 Å²	111	91.5 Å²	91.5	78%	0.776	51%	0.508	S	S	*	.			trans	-142.9	15.9	-179.7	63.3	0	0	0	0	114.3	K402	K402-S404 VanDerWaalsContact C-N 3.27Å; K402-S404 PolarHBondContact O-N 3.41Å
405	S	38.5	Very low	68.7	Low	86 Å²	86	89.1 Å²	89.1	60%	0.601	49%	0.494	S	S	*	.	S	Bend	trans	-144.2	138	170.9	56.5	0	0	0	0	110.7	D407	S405-D407 VanDerWaalsContact C-N 3.25Å; S405-D407 PolarHBondContact O-N 3.03Å
406	M	40.9	Very low	68.6	Low	198 Å²	198	91.6 Å²	91.6	98%	0.975	51%	0.51	S	S	*	.	S	Bend	trans	-75.4	78.1	170	-82.3	-176.1	152.3	0	0	110.3
407	D	39.4	Very low	68.7	Low	126 Å²	126	90 Å²	90	67%	0.674	50%	0.502	S	S	*	.			trans	-172.2	100.7	148.1	-105.8	-31.2	0	0	0	108.8	S405 T409	S405-D407 VanDerWaalsContact C-N 3.25Å; S405-D407 PolarHBondContact O-N 3.03Å; D407-T409 PolarHBondContact O-N 3.37Å
408	S	45.5	Very low	68.7	Low	118 Å²	118	92.2 Å²	92.2	83%	0.825	51%	0.513	S	S	*	.			trans	-86.8	46.8	-172.3	66.7	0	0	0	0	113
409	T	54.6	Low	69.1	Low	106 Å²	106	88.2 Å²	88.2	65%	0.65	49%	0.494	S	S	*	.			trans	-70.1	128.8	170.7	50.3	0	0	0	0	109.5	D407 L411	D407-T409 PolarHBondContact O-N 3.37Å; T409-L411 PolarHBondContact O-N 3.38Å
410	K	65.3	Low	69.6	Low	129 Å²	129	87.4 Å²	87.4	56%	0.561	49%	0.49	S	S	*	.			trans	-76.5	123.8	175.1	-60.2	-174.1	-169.9	170	0	108.7	Q398 T412	Q398-K410 VanDerWaalsContact OE1-NZ 3.1Å; K410-T412 PolarHBondContact O-N 2.8Å
411	L	81.3	Confident	70.8	Confident	84 Å²	84	78.9 Å²	78.9	44%	0.44	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	102.6	177.5	-176.6	57.4	0	0	0	109.7	E399 T409	E399-L411 HydrophobicContact CB-CB 4.28Å; E399-L411 PolarHBondContact N-O 2.89Å; E399-L411 PolarHBondContact O-N 3.38Å; T409-L411 PolarHBondContact O-N 3.38Å
412	T	87.3	Confident	72	Confident	64 Å²	64	78.1 Å²	78.1	39%	0.393	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	134.2	172.8	-55.2	0	0	0	0	109.9	E396 W397 K410	E396-T412 VanDerWaalsContact CD-CG2 3.4Å; E396-T412 HydrophobicContact CG-CG2 3.51Å; W397-T412 WeakPolarHBondContact O-CA 3.37Å; K410-T412 PolarHBondContact O-N 2.8Å
413	R	90.4	Very high	72.8	Confident	69 Å²	69	75.2 Å²	75.2	26%	0.26	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	152	170.6	-65.7	-169.5	-168.1	-85.1	-6.2	110.6	E396 W397 E399 S470	E396-R413 CarbonylContact C-O 3.53Å; E396-R413 VanDerWaalsContact CA-O 3.28Å; E396-R413 WeakPolarHBondContact CA-O 3.35Å; E396-R413 WeakPolarHBondContact CG-O 3.41Å; W397-R413 HydrophobicContact CD2-CB 4.16Å; W397-R413 HydrophobicContact CH2-CB 4.12Å; W397-R413 HydrophobicContact CZ2-CB 3.65Å; W397-R413 HydrophobicContact CZ2-CG 4.35Å; W397-R413 PolarHBondContact N-O 2.87Å; W397-R413 PolarHBondContact O-N 2.96Å; E399-R413 WeakPolarHBondContact OE1-CD 3.49Å; E399-R413 IonicContact OE1-CZ 2.97Å; E399-R413 IonicContact OE1-NE 3.63Å; E399-R413 PolarHBondContact OE1-NE 3.1Å; E399-R413 IonicContact OE2-NE 3.81Å; E399-R413 PolarHBondContact OE2-NE 3.48Å; E399-R413 IonicContact OE2-NH2 2.81Å; R413-S470 PolarHBondContact NH1-OG 3.14Å; R413-S470 VanDerWaalsContact NH1-OG 3.16Å
414	S	93.1	Very high	73.8	Confident	60 Å²	60	73.1 Å²	73.1	42%	0.42	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	147.4	176.4	59	0	0	0	0	111.8	L395	L395-S414 CarbonylContact O-C 3.52Å; L395-S414 VanDerWaalsContact O-CA 3.23Å; L395-S414 WeakPolarHBondContact O-CA 3.01Å
415	L	95.1	Very high	75.1	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	137.8	174.1	-66	174.1	0	0	0	110.6	L395 W397 F463 S465 L471 L474	L395-L415 PolarHBondContact N-O 3.28Å; L395-L415 PolarHBondContact O-N 3.36Å; W397-L415 HydrophobicContact CH2-CD1 3.62Å; W397-L415 HydrophobicContact CH2-CG 3.77Å; W397-L415 HydrophobicContact CZ3-CB 4.41Å; W397-L415 HydrophobicContact CZ3-CD1 3.98Å; W397-L415 HydrophobicContact CZ3-CG 3.95Å; L415-F463 HydrophobicContact CB-CD1 3.57Å; L415-F463 HydrophobicContact CB-CE1 3.98Å; L415-F463 HydrophobicContact CD1-CD1 3.75Å; L415-F463 HydrophobicContact CD1-CE1 4.14Å; L415-F463 HydrophobicContact CD1-CG 4.22Å; L415-F463 HydrophobicContact CG-CD1 4.34Å; L415-S465 WeakPolarHBondContact CD2-OG 3.32Å; L415-L471 HydrophobicContact CD1-CB 4.05Å; L415-L471 HydrophobicContact CD1-CD1 3.97Å; L415-L471 HydrophobicContact CD2-CB 4.47Å; L415-L474 HydrophobicContact CD1-CD2 4.03Å
416	P	95	Very high	76.5	Confident	51 Å²	51	73.2 Å²	73.2	33%	0.331	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.1	138.7	164.3	29.6	-35.5	0	0	0	110.5	G393 T464	G393-P416 CarbonylContact O-C 3.59Å; G393-P416 WeakPolarHBondContact O-CA 3.42Å; P416-T464 PolarHBondContact O-N 2.97Å; P416-T464 VanDerWaalsContact O-N 3.16Å
417	C	94.8	Very high	78.6	Confident	0 Å²	0	64.6 Å²	64.6	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	153.5	-179.2	65.6	0	0	0	0	112.5	T392 G393 F461 L462 F463	T392-C417 WeakPolarHBondContact CA-O 3.45Å; G393-C417 PolarHBondContact N-O 3.3Å; G393-C417 PolarHBondContact O-N 2.9Å; G393-C417 VanDerWaalsContact O-O 3.08Å; C417-F461 HydrophobicContact CB-CD1 4.34Å; C417-L462 CarbonylContact C-O 3.54Å; C417-L462 VanDerWaalsContact CA-O 3.24Å; C417-L462 WeakPolarHBondContact CA-O 3.34Å; C417-F463 HydrophobicContact CB-CD1 3.58Å; C417-F463 HydrophobicContact CB-CE1 3.64Å; C417-F463 HydrophobicContact CB-CG 4.3Å; C417-F463 HydrophobicContact CB-CZ 4.38Å
418	Q	94.9	Very high	80.6	Confident	48 Å²	48	61.8 Å²	61.8	22%	0.224	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	141.7	174.2	-69.7	170.7	-22.1	0	0	108.7	M389 W391 F420 F461 L462 T464	M389-Q418 HydrophobicContact SD-CB 4.42Å; M389-Q418 HydrophobicContact SD-CG 4Å; W391-Q418 CarbonylContact O-C 3.57Å; W391-Q418 WeakPolarHBondContact O-CA 3.12Å; Q418-F420 HydrophobicContact CB-CD2 4.26Å; Q418-F420 HydrophobicContact CB-CE2 3.57Å; Q418-F420 HydrophobicContact CB-CZ 4.3Å; Q418-F461 WeakPolarHBondContact O-CA 3.38Å; Q418-L462 PolarHBondContact N-O 3.03Å; Q418-L462 PolarHBondContact O-N 3.44Å; Q418-T464 HydrophobicContact CG-CG2 4.26Å
419	V	94.4	Very high	82.5	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	124.5	177.6	175.2	0	0	0	0	108.7	A390 W391 W432 V459 Q460 F461	A390-V419 PolarHBondContact N-O 3.18Å; W391-V419 HydrophobicContact CB-CB 4.26Å; W391-V419 HydrophobicContact CE3-CB 4.38Å; W391-V419 HydrophobicContact CE3-CG2 3.78Å; W391-V419 HydrophobicContact CZ3-CG2 4.35Å; W391-V419 PolarHBondContact N-O 2.83Å; W391-V419 PolarHBondContact O-N 3.49Å; V419-W432 HydrophobicContact CG2-CZ3 4.39Å; V419-V459 HydrophobicContact CG1-CB 3.76Å; V419-V459 HydrophobicContact CG1-CG1 4.36Å; V419-V459 HydrophobicContact CG1-CG2 3.73Å; V419-Q460 WeakPolarHBondContact CA-O 3.19Å; V419-F461 HydrophobicContact CG2-CD1 3.88Å; V419-F461 HydrophobicContact CG2-CD2 4.1Å; V419-F461 HydrophobicContact CG2-CE1 3.55Å; V419-F461 HydrophobicContact CG2-CE2 3.78Å; V419-F461 HydrophobicContact CG2-CG 4.15Å; V419-F461 HydrophobicContact CG2-CZ 3.5Å; V419-F461 VanDerWaalsContact CG2-CZ 3.5Å
420	F	92.3	Very high	83.8	Confident	23 Å²	23	58.5 Å²	58.5	10%	0.101	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	136.8	-179.5	-69.6	-96.2	0	0	0	110.9	M384 K387 V388 M389 Q418 Q460 L462	M384-F420 HydrophobicContact CE-CD1 3.53Å; M384-F420 HydrophobicContact CE-CD2 3.74Å; M384-F420 HydrophobicContact CE-CE1 3.47Å; M384-F420 VanDerWaalsContact CE-CE1 3.47Å; M384-F420 HydrophobicContact CE-CE2 3.68Å; M384-F420 HydrophobicContact CE-CG 3.66Å; M384-F420 HydrophobicContact CE-CZ 3.56Å; K387-F420 HydrophobicContact CB-CB 4.33Å; K387-F420 HydrophobicContact CB-CD1 4.42Å; V388-F420 CarbonylContact O-C 3.57Å; V388-F420 VanDerWaalsContact O-CA 3.26Å; V388-F420 WeakPolarHBondContact O-CA 3.46Å; M389-F420 HydrophobicContact CB-CD1 4.04Å; M389-F420 HydrophobicContact CB-CE1 3.67Å; M389-F420 HydrophobicContact CB-CZ 4.11Å; M389-F420 HydrophobicContact CG-CE1 4.34Å; M389-F420 HydrophobicContact CG-CZ 4.3Å; Q418-F420 HydrophobicContact CB-CD2 4.26Å; Q418-F420 HydrophobicContact CB-CE2 3.57Å; Q418-F420 HydrophobicContact CB-CZ 4.3Å; F420-Q460 HydrophobicContact CB-CB 4.39Å; F420-Q460 PolarHBondContact N-O 2.88Å; F420-Q460 PolarHBondContact O-N 2.9Å; F420-L462 HydrophobicContact CD2-CB 4.2Å; F420-L462 HydrophobicContact CE2-CB 3.89Å; F420-L462 HydrophobicContact CE2-CD2 3.81Å; F420-L462 HydrophobicContact CZ-CD2 4.29Å
421	V	90.1	Very high	84.7	Confident	8 Å²	8	55.9 Å²	55.9	5%	0.048	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	161.9	173.5	-59.6	0	0	0	0	109.8	K387 V388 A390 E425 L427 V459	K387-V421 CarbonylContact C-O 3.6Å; K387-V421 VanDerWaalsContact CA-O 3.28Å; K387-V421 WeakPolarHBondContact CA-O 3.47Å; K387-V421 WeakPolarHBondContact CB-O 3.22Å; V388-V421 HydrophobicContact CB-CG2 4.34Å; V388-V421 PolarHBondContact N-O 3.4Å; V388-V421 PolarHBondContact O-N 3.44Å; A390-V421 HydrophobicContact CB-CG1 3.78Å; A390-V421 HydrophobicContact CB-CG2 4.04Å; V421-E425 HydrophobicContact CB-CB 4.31Å; V421-L427 HydrophobicContact CG1-CB 4.1Å; V421-L427 HydrophobicContact CG1-CD2 3.79Å; V421-V459 HydrophobicContact CG1-CG1 4.03Å
422	N	82.5	Confident	85	Confident	55 Å²	55	52.2 Å²	52.2	29%	0.294	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	148.4	177.3	-49.6	-71.3	0	0	0	109.9	K387 G424 E425	K387-N422 WeakPolarHBondContact CE-OD1 3.16Å; K387-N422 PolarHBondContact NZ-OD1 2.94Å; N422-G424 PolarHBondContact O-N 2.98Å; N422-G424 VanDerWaalsContact O-N 3.11Å; N422-E425 WeakPolarHBondContact CB-OE2 3.37Å; N422-E425 PolarHBondContact N-OE2 2.99Å; N422-E425 PolarHBondContact ND2-OE2 2.79Å; N422-E425 PolarHBondContact O-N 3.42Å; N422-E425 VanDerWaalsContact O-N 3.08Å
423	Q	67.3	Low	85.1	Confident	126 Å²	126	51.3 Å²	51.3	59%	0.589	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	116.8	178.3	-75.3	170.3	21.4	0	0	110.5	A385 N386 V388	A385-Q423 PolarHBondContact O-NE2 3.35Å; N386-Q423 WeakPolarHBondContact O-CG 3.5Å; N386-Q423 PolarHBondContact O-N 3.49Å; V388-Q423 HydrophobicContact CG2-CG 3.65Å
424	G	64.9	Low	85.1	Confident	73 Å²	73	54.2 Å²	54.2	75%	0.753	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	116.5	-23.8	-174.9	0	0	0	0	0	114.4	N422 N426	N422-G424 PolarHBondContact O-N 2.98Å; N422-G424 VanDerWaalsContact O-N 3.11Å; G424-N426 PolarHBondContact O-N 2.96Å
425	E	68.9	Low	85.1	Confident	50 Å²	50	56 Å²	56	23%	0.234	30%	0.303	C	S	.	.			trans	-78.1	113	177.5	-72	-175.9	99.8	0	0	112.2	V421 N422 L427 R457	V421-E425 HydrophobicContact CB-CB 4.31Å; N422-E425 WeakPolarHBondContact CB-OE2 3.37Å; N422-E425 PolarHBondContact N-OE2 2.99Å; N422-E425 PolarHBondContact ND2-OE2 2.79Å; N422-E425 PolarHBondContact O-N 3.42Å; N422-E425 VanDerWaalsContact O-N 3.08Å; E425-L427 PolarHBondContact O-N 2.7Å; E425-R457 WeakPolarHBondContact OE1-CG 3.45Å
426	N	68.4	Low	85	Confident	150 Å²	150	56.2 Å²	56.2	80%	0.802	30%	0.304	S	S	*	.			trans	-81.4	94.3	172.8	-81.2	-90.5	0	0	0	110.8	G424 R457	G424-N426 PolarHBondContact O-N 2.96Å; N426-R457 PolarHBondContact O-NH1 2.91Å
427	L	84.1	Confident	84.9	Confident	17 Å²	17	57.7 Å²	57.7	9%	0.089	31%	0.308	C	S	.	.			trans	-108.3	113.8	168.5	180	68.6	0	0	0	109.4	V421 E425 T429 W432 V459 V497 I515	V421-L427 HydrophobicContact CG1-CB 4.1Å; V421-L427 HydrophobicContact CG1-CD2 3.79Å; E425-L427 PolarHBondContact O-N 2.7Å; L427-T429 HydrophobicContact CD2-CG2 3.91Å; L427-T429 HydrophobicContact CG-CG2 3.93Å; L427-T429 PolarHBondContact O-N 2.95Å; L427-W432 HydrophobicContact CD1-CZ2 4.32Å; L427-W432 HydrophobicContact CD2-CH2 4.28Å; L427-W432 HydrophobicContact CD2-CZ2 3.99Å; L427-W432 HydrophobicContact CG-CZ2 4.41Å; L427-V459 HydrophobicContact CD2-CG1 3.91Å; L427-V497 HydrophobicContact CD1-CG2 4.38Å; L427-I515 HydrophobicContact CD1-CD1 3.91Å; L427-I515 HydrophobicContact CD2-CD1 4.05Å
428	N	81.4	Confident	84.8	Confident	66 Å²	66	57.9 Å²	57.9	35%	0.353	31%	0.309	S	S	.	.			trans	-74.6	123.6	171.8	-170.9	-82.1	0	0	0	110.4	D430 W432	N428-D430 PolarHBondContact ND2-OD2 3.18Å; N428-D430 PolarHBondContact OD1-N 2.65Å; N428-W432 PolarHBondContact O-NE1 3.47Å
429	T	85.6	Confident	84.6	Confident	16 Å²	16	61.1 Å²	61.1	10%	0.098	32%	0.324	C	S	.	.			trans	-121.9	-4	-176.8	48.4	0	0	0	0	113.6	A390 W391 L427 Q431 W432	A390-T429 HydrophobicContact CB-CG2 3.86Å; A390-T429 VanDerWaalsContact O-CB 3.31Å; A390-T429 WeakPolarHBondContact O-CB 3.43Å; A390-T429 PolarHBondContact O-OG1 3.44Å; W391-T429 HydrophobicContact CB-CG2 3.97Å; L427-T429 HydrophobicContact CD2-CG2 3.91Å; L427-T429 HydrophobicContact CG-CG2 3.93Å; L427-T429 PolarHBondContact O-N 2.95Å; T429-Q431 PolarHBondContact O-N 3.06Å; T429-Q431 VanDerWaalsContact O-N 3.13Å; T429-W432 HydrophobicContact CG2-CD2 4.24Å; T429-W432 HydrophobicContact CG2-CZ2 4.32Å; T429-W432 WeakPolarHBondContact O-CB 3.4Å; T429-W432 PolarHBondContact O-N 2.89Å
430	D	81.9	Confident	84.5	Confident	139 Å²	139	62.8 Å²	62.8	74%	0.743	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-30.4	-174.4	-53.6	-50	0	0	0	112.5	N428	N428-D430 PolarHBondContact ND2-OD2 3.18Å; N428-D430 PolarHBondContact OD1-N 2.65Å
431	Q	84.4	Confident	84.4	Confident	74 Å²	74	61.9 Å²	61.9	35%	0.346	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	6.2	179.5	-60.7	-177.1	78	0	0	114	T429 S493 P494	T429-Q431 PolarHBondContact O-N 3.06Å; T429-Q431 VanDerWaalsContact O-N 3.13Å; Q431-S493 PolarHBondContact OE1-OG 2.84Å; Q431-P494 PolarHBondContact NE2-O 3.19Å; Q431-P494 PolarHBondContact OE1-O 3.05Å
432	W	88.7	Confident	84.3	Confident	8 Å²	8	63.4 Å²	63.4	3%	0.03	34%	0.339	C	S	.	.	S	Bend	trans	-77.7	126.9	-179.5	-75.9	33.8	0	0	0	110.8	W391 V419 L427 N428 T429 Q434 L436 F488 V497 L500 I515	W391-W432 HydrophobicContact CB-CE3 4.36Å; W391-W432 AromaticContact CD2-CE3 3.99Å; W391-W432 HydrophobicContact CD2-CE3 3.99Å; W391-W432 HydrophobicContact CE3-CE3 4.38Å; W391-W432 HydrophobicContact CG-CB 4.31Å; W391-W432 AromaticContact CG-CE3 3.99Å; W391-W432 HydrophobicContact CG-CE3 3.99Å; W391-W432 PolarHBondContact NE1-O 3.24Å; V419-W432 HydrophobicContact CG2-CZ3 4.39Å; L427-W432 HydrophobicContact CD1-CZ2 4.32Å; L427-W432 HydrophobicContact CD2-CH2 4.28Å; L427-W432 HydrophobicContact CD2-CZ2 3.99Å; L427-W432 HydrophobicContact CG-CZ2 4.41Å; N428-W432 PolarHBondContact O-NE1 3.47Å; T429-W432 HydrophobicContact CG2-CD2 4.24Å; T429-W432 HydrophobicContact CG2-CZ2 4.32Å; T429-W432 WeakPolarHBondContact O-CB 3.4Å; T429-W432 PolarHBondContact O-N 2.89Å; W432-Q434 PolarHBondContact O-N 3.33Å; W432-L436 HydrophobicContact CE3-CD1 4.24Å; W432-L436 HydrophobicContact CZ3-CD1 4.35Å; W432-F488 HydrophobicContact CB-CE1 4.39Å; W432-F488 AromaticContact CD2-CE1 3.64Å; W432-F488 HydrophobicContact CD2-CE1 3.64Å; W432-F488 AromaticContact CD2-CZ 3.95Å; W432-F488 HydrophobicContact CD2-CZ 3.95Å; W432-F488 AromaticContact CE2-CE1 3.96Å; W432-F488 AromaticContact CE3-CE1 3.96Å; W432-F488 HydrophobicContact CE3-CE1 3.96Å; W432-F488 AromaticContact CE3-CZ 3.94Å; W432-F488 HydrophobicContact CE3-CZ 3.94Å; W432-F488 AromaticContact CG-CE1 3.82Å; W432-F488 HydrophobicContact CG-CE1 3.82Å; W432-F488 HydrophobicContact CH2-CZ 4.18Å; W432-F488 HydrophobicContact CZ2-CZ 4.19Å; W432-F488 HydrophobicContact CZ3-CZ 4.05Å; W432-V497 HydrophobicContact CZ2-CB 4.41Å; W432-V497 HydrophobicContact CZ2-CG2 4Å; W432-L500 HydrophobicContact CH2-CD1 3.85Å; W432-L500 HydrophobicContact CZ3-CD1 4.28Å; W432-I515 HydrophobicContact CH2-CD1 4.1Å; W432-I515 HydrophobicContact CZ2-CD1 4.09Å
433	P	88.3	Confident	84.5	Confident	44 Å²	44	64 Å²	64	29%	0.286	34%	0.34	S	S	.	.			trans	-66.3	135	-177.5	28.5	-34.8	0	0	0	110.5	W391 K435 L436 F488	W391-P433 VanDerWaalsContact CZ2-O 3.3Å; W391-P433 WeakPolarHBondContact CZ2-O 3.49Å; P433-K435 CarbonylContact O-C 3.48Å; P433-K435 PolarHBondContact O-N 2.96Å; P433-L436 HydrophobicContact CG-CD2 4.05Å; P433-F488 HydrophobicContact CG-CD1 4.49Å
434	Q	90.7	Very high	85.2	Confident	131 Å²	131	65.9 Å²	65.9	61%	0.612	35%	0.349	S	S	*	.	S	Bend	trans	-54.2	-15.9	-178.2	-70.9	-65.8	-52.6	0	0	114.9	G393 V394 W432	G393-Q434 WeakPolarHBondContact CA-O 3.41Å; V394-Q434 PolarHBondContact N-O 3.22Å; W432-Q434 PolarHBondContact O-N 3.33Å
435	K	92.9	Very high	86.1	Confident	98 Å²	98	63.5 Å²	63.5	43%	0.426	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	116.3	172.3	-172.8	-178.2	-177.9	-174.9	0	110.2	V394 E396 P433 I437	V394-K435 CarbonylContact O-C 3.58Å; V394-K435 WeakPolarHBondContact O-CA 3.48Å; E396-K435 WeakPolarHBondContact OE1-CE 3.28Å; E396-K435 IonicContact OE1-NZ 3Å; E396-K435 PolarHBondContact OE1-NZ 2.91Å; E396-K435 WeakPolarHBondContact OE2-CE 3.43Å; E396-K435 IonicContact OE2-NZ 2.83Å; E396-K435 PolarHBondContact OE2-NZ 3.25Å; P433-K435 CarbonylContact O-C 3.48Å; P433-K435 PolarHBondContact O-N 2.96Å; K435-I437 HydrophobicContact CD-CD1 4.16Å; K435-I437 HydrophobicContact CG-CD1 4.08Å
436	L	93.3	Very high	86.8	Confident	3 Å²	3	61.8 Å²	61.8	2%	0.016	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134	174.3	-66.8	175.4	0	0	0	110.1	W391 V394 L395 E396 W432 P433 V486 F488	W391-L436 HydrophobicContact CE3-CD1 4.39Å; W391-L436 HydrophobicContact CH2-CD1 3.53Å; W391-L436 HydrophobicContact CH2-CG 3.74Å; W391-L436 HydrophobicContact CZ2-CD1 4.13Å; W391-L436 HydrophobicContact CZ2-CG 4.09Å; W391-L436 HydrophobicContact CZ3-CD1 3.69Å; W391-L436 HydrophobicContact CZ3-CG 4.41Å; V394-L436 PolarHBondContact O-N 3.24Å; L395-L436 HydrophobicContact CD1-CB 3.79Å; E396-L436 PolarHBondContact N-O 3.32Å; W432-L436 HydrophobicContact CE3-CD1 4.24Å; W432-L436 HydrophobicContact CZ3-CD1 4.35Å; P433-L436 HydrophobicContact CG-CD2 4.05Å; L436-V486 HydrophobicContact CB-CG1 3.9Å; L436-V486 HydrophobicContact CD1-CG1 4.43Å; L436-V486 HydrophobicContact CD2-CG1 4Å; L436-V486 HydrophobicContact CG-CG1 4.33Å; L436-F488 HydrophobicContact CD2-CD1 4.11Å; L436-F488 HydrophobicContact CD2-CE1 3.58Å; L436-F488 HydrophobicContact CD2-CE2 4.36Å; L436-F488 HydrophobicContact CD2-CZ 3.72Å
437	I	92.4	Very high	87.4	Confident	82 Å²	82	59.6 Å²	59.6	42%	0.421	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	122.6	179.4	-50.9	-58.1	0	0	0	109.7	E396 K435 V486 H487	E396-I437 HydrophobicContact CB-CD1 4.06Å; E396-I437 HydrophobicContact CG-CD1 4.48Å; K435-I437 HydrophobicContact CD-CD1 4.16Å; K435-I437 HydrophobicContact CG-CD1 4.08Å; I437-V486 WeakPolarHBondContact O-CA 3.44Å; I437-H487 PolarHBondContact O-N 3.45Å
438	M	94.1	Very high	86.9	Confident	4 Å²	4	63 Å²	63	2%	0.02	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	122.9	-175.7	-173.9	-175.5	71.6	0	0	111.4	L395 E396 W397 L440 L474 M478 G484 V486 L502	L395-M438 HydrophobicContact CD1-CB 3.99Å; L395-M438 HydrophobicContact CD2-SD 3.89Å; L395-M438 HydrophobicContact CG-CB 4.26Å; L395-M438 HydrophobicContact CG-SD 4.48Å; E396-M438 WeakPolarHBondContact O-CB 3.35Å; E396-M438 PolarHBondContact O-N 2.86Å; W397-M438 WeakPolarHBondContact CA-O 3.45Å; W397-M438 HydrophobicContact CB-CB 4.19Å; W397-M438 HydrophobicContact CB-CE 3.48Å; W397-M438 VanDerWaalsContact CB-CE 3.48Å; W397-M438 WeakPolarHBondContact CB-O 3.47Å; W397-M438 HydrophobicContact CD2-CE 3.74Å; W397-M438 HydrophobicContact CE3-CE 3.85Å; W397-M438 HydrophobicContact CG-CE 3.63Å; M438-L440 HydrophobicContact CE-CD2 3.76Å; M438-L440 HydrophobicContact CE-CG 4.48Å; M438-L474 HydrophobicContact CE-CD1 3.79Å; M438-M478 HydrophobicContact CE-CE 4.36Å; M438-M478 HydrophobicContact SD-CE 4Å; M438-G484 VanDerWaalsContact CG-CA 3.41Å; M438-G484 WeakPolarHBondContact SD-CA 3.44Å; M438-V486 HydrophobicContact CB-CG2 4.01Å; M438-V486 HydrophobicContact CG-CG2 4.12Å; M438-L502 HydrophobicContact SD-CB 4.37Å; M438-L502 HydrophobicContact SD-CD2 3.94Å
439	Q	90.8	Very high	86.6	Confident	116 Å²	116	60.4 Å²	60.4	54%	0.542	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	125	170.3	-179.9	174.9	-35.5	0	0	110.5	C485	Q439-C485 PolarHBondContact N-O 3.38Å; Q439-C485 PolarHBondContact O-N 3.44Å
440	L	92.3	Very high	86.2	Confident	36 Å²	36	61 Å²	61	19%	0.188	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	130.2	175.1	-66.1	172.3	0	0	0	111.4	E399 M438 I477 F482 A483	E399-L440 HydrophobicContact CG-CD1 4.41Å; M438-L440 HydrophobicContact CE-CD2 3.76Å; M438-L440 HydrophobicContact CE-CG 4.48Å; L440-I477 HydrophobicContact CD1-CD1 4.4Å; L440-I477 HydrophobicContact CD1-CG2 3.86Å; L440-I477 HydrophobicContact CD2-CG2 3.69Å; L440-I477 HydrophobicContact CG-CG2 4.4Å; L440-F482 HydrophobicContact CB-CD1 4.23Å; L440-A483 WeakPolarHBondContact CA-O 3.41Å
441	I	89	Confident	85.9	Confident	3 Å²	3	60.2 Å²	60.2	2%	0.015	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	134.8	179	-55.6	175.7	0	0	0	109.1	Q443 L445 L446 F482 A483 C485 M501 I526 I530	I441-Q443 PolarHBondContact O-N 2.9Å; I441-L445 HydrophobicContact CG2-CB 4.45Å; I441-L445 HydrophobicContact CG2-CD1 4.26Å; I441-L446 HydrophobicContact CG2-CD2 4.01Å; I441-L446 HydrophobicContact CG2-CG 4.41Å; I441-F482 CarbonylContact O-C 3.56Å; I441-F482 WeakPolarHBondContact O-CA 3.4Å; I441-A483 PolarHBondContact N-O 3.48Å; I441-A483 PolarHBondContact O-N 3.18Å; I441-C485 HydrophobicContact CD1-CB 3.46Å; I441-C485 VanDerWaalsContact CD1-CB 3.46Å; I441-C485 HydrophobicContact CG1-CB 4.26Å; I441-M501 HydrophobicContact CD1-CE 4.3Å; I441-I526 HydrophobicContact CD1-CD1 4.13Å; I441-I526 HydrophobicContact CD1-CG2 3.69Å; I441-I530 HydrophobicContact CD1-CD1 3.89Å; I441-I530 HydrophobicContact CG1-CD1 4.17Å
442	P	88.6	Confident	85.3	Confident	40 Å²	40	57.6 Å²	57.6	26%	0.26	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	129.3	173	-18.8	30.7	0	0	0	111.9	Q444 L445 F482	P442-Q444 PolarHBondContact O-N 3.26Å; P442-L445 HydrophobicContact CB-CG 4.37Å; P442-L445 HydrophobicContact CG-CD1 4.46Å; P442-L445 WeakPolarHBondContact O-CB 3.48Å; P442-L445 PolarHBondContact O-N 3.32Å; P442-F482 HydrophobicContact CB-CE1 4.45Å; P442-F482 HydrophobicContact CG-CD1 4.33Å; P442-F482 HydrophobicContact CG-CE1 3.84Å; P442-F482 HydrophobicContact CG-CZ 4.38Å
443	Q	85.7	Confident	84.8	Confident	69 Å²	69	59 Å²	59	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-60.4	-26.4	-179.6	-70	177.1	22.7	0	0	112.9	I441 L445 L446 T447 M478 G481 F482 A483	I441-Q443 PolarHBondContact O-N 2.9Å; Q443-L445 PolarHBondContact O-N 3.11Å; Q443-L446 WeakPolarHBondContact O-CA 3.3Å; Q443-L446 WeakPolarHBondContact O-CB 3.28Å; Q443-L446 PolarHBondContact O-N 2.88Å; Q443-T447 PolarHBondContact O-N 3.34Å; Q443-M478 PolarHBondContact NE2-O 3.37Å; Q443-G481 WeakPolarHBondContact CB-O 3.43Å; Q443-G481 WeakPolarHBondContact CG-O 3.44Å; Q443-G481 PolarHBondContact N-O 3.48Å; Q443-F482 PolarHBondContact NE2-O 2.89Å; Q443-A483 HydrophobicContact CG-CB 3.94Å
444	Q	83.6	Confident	84.3	Confident	164 Å²	164	66.3 Å²	66.3	77%	0.766	33%	0.328	S	S	*	.	H	α-helix	trans	-55.6	-34.6	173.5	-70.5	-179.6	-27.2	0	0	112.5	P442 L446 T447	P442-Q444 PolarHBondContact O-N 3.26Å; Q444-L446 VanDerWaalsContact C-N 3.33Å; Q444-T447 WeakPolarHBondContact O-CG2 3.34Å; Q444-T447 PolarHBondContact O-OG1 2.88Å
445	L	83.1	Confident	83.9	Confident	24 Å²	24	64.3 Å²	64.3	13%	0.126	32%	0.322	C	S	.	.	H	α-helix	trans	-70.4	-32.5	175.8	-57.1	-169.7	0	0	0	112.2	I441 P442 Q443 T447 T448 V529 H533	I441-L445 HydrophobicContact CG2-CB 4.45Å; I441-L445 HydrophobicContact CG2-CD1 4.26Å; P442-L445 HydrophobicContact CB-CG 4.37Å; P442-L445 HydrophobicContact CG-CD1 4.46Å; P442-L445 WeakPolarHBondContact O-CB 3.48Å; P442-L445 PolarHBondContact O-N 3.32Å; Q443-L445 PolarHBondContact O-N 3.11Å; L445-T447 VanDerWaalsContact C-N 3.28Å; L445-T447 PolarHBondContact O-N 3.16Å; L445-T448 PolarHBondContact O-OG1 2.78Å; L445-T448 VanDerWaalsContact O-OG1 3.04Å; L445-V529 HydrophobicContact CB-CG1 3.66Å; L445-V529 HydrophobicContact CD1-CG1 4.46Å; L445-V529 HydrophobicContact CD2-CG1 4.05Å; L445-V529 HydrophobicContact CG-CG1 4.25Å; L445-H533 HydrophobicContact CD1-CB 4.16Å; L445-H533 HydrophobicContact CD2-CB 3.89Å
446	L	83	Confident	83.6	Confident	13 Å²	13	60.5 Å²	60.5	7%	0.068	31%	0.308	C	S	.	.	H	α-helix	trans	-75.7	-15	-175	-56.7	-172.4	0	0	0	113.4	I441 Q443 Q444 T448 L449 F453 A483 M501 I526	I441-L446 HydrophobicContact CG2-CD2 4.01Å; I441-L446 HydrophobicContact CG2-CG 4.41Å; Q443-L446 WeakPolarHBondContact O-CA 3.3Å; Q443-L446 WeakPolarHBondContact O-CB 3.28Å; Q443-L446 PolarHBondContact O-N 2.88Å; Q444-L446 VanDerWaalsContact C-N 3.33Å; L446-T448 VanDerWaalsContact C-N 3.28Å; L446-T448 PolarHBondContact O-N 3.07Å; L446-L449 HydrophobicContact CD2-CD1 4.36Å; L446-L449 PolarHBondContact O-N 3.43Å; L446-F453 HydrophobicContact CB-CE2 3.76Å; L446-F453 HydrophobicContact CB-CZ 4.02Å; L446-F453 HydrophobicContact CD1-CE2 4.49Å; L446-F453 HydrophobicContact CD1-CZ 3.91Å; L446-F453 HydrophobicContact CD2-CE2 4.48Å; L446-F453 HydrophobicContact CD2-CZ 4.11Å; L446-F453 HydrophobicContact CG-CE2 4.46Å; L446-F453 HydrophobicContact CG-CZ 4.23Å; L446-A483 HydrophobicContact CD1-CB 3.53Å; L446-M501 HydrophobicContact CD1-CE 3.88Å; L446-M501 HydrophobicContact CD1-SD 4.12Å; L446-M501 HydrophobicContact CD2-CE 4.12Å; L446-I526 HydrophobicContact CD2-CD1 3.35Å
447	T	81.1	Confident	83.3	Confident	104 Å²	104	63 Å²	63	64%	0.638	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-50.3	-46.6	174.9	55.2	0	0	0	0	112.5	Q443 Q444 L445 L449 G450	Q443-T447 PolarHBondContact O-N 3.34Å; Q444-T447 WeakPolarHBondContact O-CG2 3.34Å; Q444-T447 PolarHBondContact O-OG1 2.88Å; L445-T447 VanDerWaalsContact C-N 3.28Å; L445-T447 PolarHBondContact O-N 3.16Å; T447-L449 PolarHBondContact O-N 2.88Å; T447-G450 PolarHBondContact O-N 3.19Å
448	T	74.8	Confident	83.2	Confident	88 Å²	88	63.8 Å²	63.8	54%	0.54	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-64.7	-21.4	178.9	60.5	0	0	0	0	114	L445 L446	L445-T448 PolarHBondContact O-OG1 2.78Å; L445-T448 VanDerWaalsContact O-OG1 3.04Å; L446-T448 VanDerWaalsContact C-N 3.28Å; L446-T448 PolarHBondContact O-N 3.07Å
449	L	74.8	Confident	83.1	Confident	13 Å²	13	63.7 Å²	63.7	7%	0.068	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-99.8	12.8	-177.7	-54.6	177.5	0	0	0	112.4	L446 T447 H451 L452 F453 I526 V529	L446-L449 HydrophobicContact CD2-CD1 4.36Å; L446-L449 PolarHBondContact O-N 3.43Å; T447-L449 PolarHBondContact O-N 2.88Å; L449-H451 PolarHBondContact O-N 3.19Å; L449-L452 HydrophobicContact CD2-CD1 4.42Å; L449-L452 PolarHBondContact O-N 2.98Å; L449-F453 HydrophobicContact CB-CD2 4.45Å; L449-F453 HydrophobicContact CB-CE2 3.9Å; L449-F453 WeakPolarHBondContact O-CD2 3.23Å; L449-I526 HydrophobicContact CD1-CD1 3.6Å; L449-I526 HydrophobicContact CD1-CG1 3.91Å; L449-V529 HydrophobicContact CD2-CG2 4.41Å; L449-V529 HydrophobicContact CG-CG2 4.47Å
450	G	76.9	Confident	83.3	Confident	29 Å²	29	59.7 Å²	59.7	30%	0.299	30%	0.301	S	S	.	.	H	α-helix	trans	-50.9	-32.1	-175.3	0	0	0	0	0	115.5	T447 F453 R454	T447-G450 PolarHBondContact O-N 3.19Å; G450-F453 PolarHBondContact O-N 2.81Å; G450-R454 PolarHBondContact O-N 2.92Å
451	H	75.1	Confident	83.4	Confident	122 Å²	122	58.2 Å²	58.2	57%	0.565	29%	0.293	S	S	*	.	H	α-helix	trans	-65	-37.1	177.2	58.8	-82.2	0	0	0	112.8	L449 R454 N455	L449-H451 PolarHBondContact O-N 3.19Å; H451-R454 PolarHBondContact O-N 2.99Å; H451-N455 PolarHBondContact O-N 3.42Å
452	L	72.3	Confident	83.7	Confident	19 Å²	19	61.4 Å²	61.4	10%	0.099	31%	0.31	C	S	.	.	H	α-helix	trans	-74.4	-30.8	-180	-52.7	176.7	0	0	0	112.1	L449 R454 N455 S456 F522	L449-L452 HydrophobicContact CD2-CD1 4.42Å; L449-L452 PolarHBondContact O-N 2.98Å; L452-R454 VanDerWaalsContact C-N 3.33Å; L452-N455 CarbonylContact O-C 3.58Å; L452-N455 PolarHBondContact O-N 2.83Å; L452-S456 PolarHBondContact O-OG 2.72Å; L452-F522 HydrophobicContact CB-CD2 3.74Å; L452-F522 HydrophobicContact CB-CE2 4.37Å; L452-F522 HydrophobicContact CD1-CB 4.21Å; L452-F522 HydrophobicContact CD1-CD2 3.91Å; L452-F522 HydrophobicContact CG-CD2 4.48Å
453	F	78.6	Confident	83.8	Confident	36 Å²	36	60.4 Å²	60.4	16%	0.158	30%	0.301	C	S	.	.	H	α-helix	trans	-70.9	-26.3	174	-66.7	-65.7	0	0	0	113.6	L446 L449 G450 M501 L514 F522	L446-F453 HydrophobicContact CB-CE2 3.76Å; L446-F453 HydrophobicContact CB-CZ 4.02Å; L446-F453 HydrophobicContact CD1-CE2 4.49Å; L446-F453 HydrophobicContact CD1-CZ 3.91Å; L446-F453 HydrophobicContact CD2-CE2 4.48Å; L446-F453 HydrophobicContact CD2-CZ 4.11Å; L446-F453 HydrophobicContact CG-CE2 4.46Å; L446-F453 HydrophobicContact CG-CZ 4.23Å; L449-F453 HydrophobicContact CB-CD2 4.45Å; L449-F453 HydrophobicContact CB-CE2 3.9Å; L449-F453 WeakPolarHBondContact O-CD2 3.23Å; G450-F453 PolarHBondContact O-N 2.81Å; F453-M501 HydrophobicContact CE1-CB 3.85Å; F453-M501 HydrophobicContact CE1-CE 4.28Å; F453-M501 HydrophobicContact CE1-CG 3.75Å; F453-M501 HydrophobicContact CZ-CE 4.17Å; F453-M501 HydrophobicContact CZ-CG 4.39Å; F453-L514 HydrophobicContact CB-CD1 4.24Å; F453-L514 HydrophobicContact CD1-CD1 3.75Å; F453-L514 HydrophobicContact CG-CD1 4.43Å; F453-F522 HydrophobicContact CD1-CE2 4.01Å; F453-F522 HydrophobicContact CD1-CZ 4.41Å; F453-F522 AromaticContact CE1-CE2 3.4Å; F453-F522 HydrophobicContact CE1-CE2 3.4Å; F453-F522 AromaticContact CE1-CZ 3.47Å; F453-F522 HydrophobicContact CE1-CZ 3.47Å; F453-F522 VanDerWaalsContact CE1-CZ 3.47Å; F453-F522 HydrophobicContact CE2-CE2 4.16Å; F453-F522 AromaticContact CZ-CE2 3.48Å; F453-F522 HydrophobicContact CZ-CE2 3.48Å; F453-F522 VanDerWaalsContact CZ-CE2 3.48Å; F453-F522 AromaticContact CZ-CZ 3.62Å; F453-F522 HydrophobicContact CZ-CZ 3.62Å
454	R	78.3	Confident	83.7	Confident	198 Å²	198	60.3 Å²	60.3	75%	0.747	31%	0.306	S	S	*	.	H	α-helix	trans	-72.8	-42.9	171.4	-67.9	177.1	-176.9	-179.1	-0.3	111	G450 H451 L452 S456	G450-R454 PolarHBondContact O-N 2.92Å; H451-R454 PolarHBondContact O-N 2.99Å; L452-R454 VanDerWaalsContact C-N 3.33Å; R454-S456 PolarHBondContact O-N 2.86Å
455	N	80.6	Confident	83.3	Confident	89 Å²	89	53.6 Å²	53.6	48%	0.476	28%	0.277	S	S	.	.	S	Bend	trans	-84.5	58	175.2	-165.6	11.6	0	0	0	111.9	H451 L452 N517	H451-N455 PolarHBondContact O-N 3.42Å; L452-N455 CarbonylContact O-C 3.58Å; L452-N455 PolarHBondContact O-N 2.83Å; N455-N517 PolarHBondContact O-N 2.89Å; N455-N517 WeakPolarHBondContact OD1-CB 3.31Å; N455-N517 PolarHBondContact OD1-ND2 3.48Å
456	S	87.1	Confident	82.9	Confident	18 Å²	18	62.4 Å²	62.4	13%	0.126	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	132.8	-177.7	-70.6	0	0	0	0	112.2	L452 R454 I515 P516	L452-S456 PolarHBondContact O-OG 2.72Å; R454-S456 PolarHBondContact O-N 2.86Å; S456-I515 CarbonylContact C-O 3.56Å; S456-I515 VanDerWaalsContact CA-O 3.27Å; S456-I515 WeakPolarHBondContact CA-O 3.44Å; S456-P516 VanDerWaalsContact OG-CA 3.31Å; S456-P516 WeakPolarHBondContact OG-CA 3.47Å
457	R	87.9	Confident	82.9	Confident	57 Å²	57	65 Å²	65	22%	0.215	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	134	168.6	-160.3	-171.2	-49.2	-174.5	10.1	109.6	E425 N426 E496 I515	E425-R457 WeakPolarHBondContact OE1-CG 3.45Å; N426-R457 PolarHBondContact O-NH1 2.91Å; R457-E496 IonicContact CZ-OE1 3.79Å; R457-E496 IonicContact NH2-OE1 2.7Å; R457-E496 PolarHBondContact NH2-OE1 3.17Å; R457-I515 HydrophobicContact CB-CB 4.29Å; R457-I515 PolarHBondContact N-O 3.49Å; R457-I515 PolarHBondContact O-N 3.32Å
458	M	89.5	Confident	83.2	Confident	98 Å²	98	64.2 Å²	64.2	48%	0.483	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	123.9	-176	-171.9	-176.5	-63.1	0	0	112.1	M512 G513 L514	M458-M512 HydrophobicContact SD-SD 4.4Å; M458-G513 WeakPolarHBondContact CA-O 3.28Å; M458-L514 HydrophobicContact CB-CD2 4.1Å; M458-L514 HydrophobicContact CE-CD2 4.03Å; M458-L514 HydrophobicContact CG-CD2 4.05Å
459	V	92.9	Very high	83.8	Confident	2 Å²	2	64.9 Å²	64.9	1%	0.012	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	155.9	173.6	-52.7	0	0	0	0	110.5	V419 V421 L427 F461 L500 G513 I515	V419-V459 HydrophobicContact CG1-CB 3.76Å; V419-V459 HydrophobicContact CG1-CG1 4.36Å; V419-V459 HydrophobicContact CG1-CG2 3.73Å; V421-V459 HydrophobicContact CG1-CG1 4.03Å; L427-V459 HydrophobicContact CD2-CG1 3.91Å; V459-F461 HydrophobicContact CG2-CD2 4.14Å; V459-F461 HydrophobicContact CG2-CE2 3.75Å; V459-L500 HydrophobicContact CG2-CD1 4.29Å; V459-G513 PolarHBondContact N-O 3.46Å; V459-G513 PolarHBondContact O-N 3.32Å; V459-I515 HydrophobicContact CG1-CD1 3.87Å
460	Q	94	Very high	84.4	Confident	32 Å²	32	64.7 Å²	64.7	15%	0.15	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.3	178.4	-178.6	171.6	-16.6	0	0	111.1	V419 F420	V419-Q460 WeakPolarHBondContact CA-O 3.19Å; F420-Q460 HydrophobicContact CB-CB 4.39Å; F420-Q460 PolarHBondContact N-O 2.88Å; F420-Q460 PolarHBondContact O-N 2.9Å
461	F	95.2	Very high	85	Confident	4 Å²	4	63.8 Å²	63.8	2%	0.018	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	127.8	173.8	-83.1	-109.8	0	0	0	110.2	C417 Q418 V419 V459 F463 L500 L502 F511	C417-F461 HydrophobicContact CB-CD1 4.34Å; Q418-F461 WeakPolarHBondContact O-CA 3.38Å; V419-F461 HydrophobicContact CG2-CD1 3.88Å; V419-F461 HydrophobicContact CG2-CD2 4.1Å; V419-F461 HydrophobicContact CG2-CE1 3.55Å; V419-F461 HydrophobicContact CG2-CE2 3.78Å; V419-F461 HydrophobicContact CG2-CG 4.15Å; V419-F461 HydrophobicContact CG2-CZ 3.5Å; V419-F461 VanDerWaalsContact CG2-CZ 3.5Å; V459-F461 HydrophobicContact CG2-CD2 4.14Å; V459-F461 HydrophobicContact CG2-CE2 3.75Å; F461-F463 HydrophobicContact CB-CE2 4.32Å; F461-L500 HydrophobicContact CE2-CD1 3.91Å; F461-L500 HydrophobicContact CE2-CD2 3.87Å; F461-L500 HydrophobicContact CZ-CD1 3.96Å; F461-L500 HydrophobicContact CZ-CD2 3.89Å; F461-L502 HydrophobicContact CB-CD1 3.88Å; F461-L502 HydrophobicContact CD1-CD1 4.15Å; F461-L502 HydrophobicContact CD2-CD1 3.53Å; F461-L502 HydrophobicContact CE2-CD1 4.06Å; F461-L502 HydrophobicContact CG-CD1 3.58Å; F461-F511 HydrophobicContact CB-CB 3.82Å; F461-F511 PolarHBondContact N-O 3Å
462	L	93.5	Very high	85.8	Confident	70 Å²	70	64.7 Å²	64.7	37%	0.366	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	118	171.6	179.4	63.8	0	0	0	109	M384 C417 Q418 F420 T464	M384-L462 HydrophobicContact CE-CD2 4.44Å; C417-L462 CarbonylContact C-O 3.54Å; C417-L462 VanDerWaalsContact CA-O 3.24Å; C417-L462 WeakPolarHBondContact CA-O 3.34Å; Q418-L462 PolarHBondContact N-O 3.03Å; Q418-L462 PolarHBondContact O-N 3.44Å; F420-L462 HydrophobicContact CD2-CB 4.2Å; F420-L462 HydrophobicContact CE2-CB 3.89Å; F420-L462 HydrophobicContact CE2-CD2 3.81Å; F420-L462 HydrophobicContact CZ-CD2 4.29Å; L462-T464 HydrophobicContact CD2-CG2 4.5Å; L462-T464 HydrophobicContact CG-CG2 4.36Å
463	F	92.6	Very high	86.6	Confident	20 Å²	20	64.4 Å²	64.4	9%	0.088	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.5	175.5	-68.7	-82.2	0	0	0	110.1	L395 L415 C417 F461 L471 L474 L502 F511	L395-F463 HydrophobicContact CB-CE1 4.21Å; L395-F463 HydrophobicContact CD2-CE1 3.86Å; L395-F463 HydrophobicContact CD2-CZ 3.66Å; L415-F463 HydrophobicContact CB-CD1 3.57Å; L415-F463 HydrophobicContact CB-CE1 3.98Å; L415-F463 HydrophobicContact CD1-CD1 3.75Å; L415-F463 HydrophobicContact CD1-CE1 4.14Å; L415-F463 HydrophobicContact CD1-CG 4.22Å; L415-F463 HydrophobicContact CG-CD1 4.34Å; C417-F463 HydrophobicContact CB-CD1 3.58Å; C417-F463 HydrophobicContact CB-CE1 3.64Å; C417-F463 HydrophobicContact CB-CG 4.3Å; C417-F463 HydrophobicContact CB-CZ 4.38Å; F461-F463 HydrophobicContact CB-CE2 4.32Å; F463-L471 HydrophobicContact CB-CD1 3.86Å; F463-L471 HydrophobicContact CB-CD2 4.32Å; F463-L471 HydrophobicContact CD2-CD1 4.1Å; F463-L471 HydrophobicContact CG-CD1 4.03Å; F463-L474 HydrophobicContact CD2-CD2 4.44Å; F463-L474 HydrophobicContact CE1-CD2 4.09Å; F463-L474 HydrophobicContact CE2-CD2 3.8Å; F463-L474 HydrophobicContact CZ-CD2 3.6Å; F463-L502 HydrophobicContact CE2-CD2 4.44Å; F463-L502 HydrophobicContact CZ-CD2 3.99Å; F463-F511 AromaticContact CD2-CD2 3.48Å; F463-F511 HydrophobicContact CD2-CD2 3.48Å; F463-F511 VanDerWaalsContact CD2-CD2 3.48Å; F463-F511 AromaticContact CD2-CE2 3.48Å; F463-F511 HydrophobicContact CD2-CE2 3.48Å; F463-F511 VanDerWaalsContact CD2-CE2 3.48Å; F463-F511 HydrophobicContact CD2-CG 4.11Å; F463-F511 HydrophobicContact CD2-CZ 4.13Å; F463-F511 HydrophobicContact CE2-CB 4.18Å; F463-F511 AromaticContact CE2-CD1 3.99Å; F463-F511 HydrophobicContact CE2-CD1 3.99Å; F463-F511 AromaticContact CE2-CD2 3.52Å; F463-F511 HydrophobicContact CE2-CD2 3.52Å; F463-F511 HydrophobicContact CE2-CE1 4.17Å; F463-F511 AromaticContact CE2-CE2 3.71Å; F463-F511 HydrophobicContact CE2-CE2 3.71Å; F463-F511 AromaticContact CE2-CG 3.65Å; F463-F511 HydrophobicContact CE2-CG 3.65Å; F463-F511 HydrophobicContact CE2-CZ 4.03Å
464	T	81.8	Confident	87.3	Confident	67 Å²	67	62.7 Å²	62.7	41%	0.411	30%	0.299	S	S	.	.			trans	-103	17.4	-173.8	52	0	0	0	0	112.8	P416 Q418 L462	P416-T464 PolarHBondContact O-N 2.97Å; P416-T464 VanDerWaalsContact O-N 3.16Å; Q418-T464 HydrophobicContact CG-CG2 4.26Å; L462-T464 HydrophobicContact CD2-CG2 4.5Å; L462-T464 HydrophobicContact CG-CG2 4.36Å
465	S	75.8	Confident	87.9	Confident	23 Å²	23	56.8 Å²	56.8	16%	0.161	28%	0.277	C	S	.	.			trans	-72.3	146.1	-173.2	-163.1	0	0	0	0	113.7	L415 D467	L415-S465 WeakPolarHBondContact CD2-OG 3.32Å; S465-D467 PolarHBondContact OG-N 3.19Å
466	K	75.8	Confident	88.3	Confident	209 Å²	209	60.9 Å²	60.9	91%	0.909	29%	0.286	S	S	*	.	S	Bend	trans	-83	-17.8	163.3	-64.4	-177.1	179.9	179.7	0	112.6	M468	K466-M468 PolarHBondContact O-N 2.82Å
467	D	82.8	Confident	88.5	Confident	67 Å²	67	61.3 Å²	61.3	36%	0.358	29%	0.287	S	S	.	.			trans	-75.5	89.9	169.9	179.8	-0.8	0	0	0	109.6	S465 D469 S470 L471	S465-D467 PolarHBondContact OG-N 3.19Å; D467-D469 VanDerWaalsContact C-N 3.28Å; D467-D469 PolarHBondContact O-N 2.89Å; D467-D469 PolarHBondContact OD1-N 2.96Å; D467-S470 PolarHBondContact OD1-N 2.9Å; D467-S470 WeakPolarHBondContact OD2-CB 3.34Å; D467-S470 PolarHBondContact OD2-OG 3.2Å; D467-L471 PolarHBondContact O-N 2.99Å
468	M	86.1	Confident	88.7	Confident	87 Å²	87	58.8 Å²	58.8	43%	0.429	28%	0.277	S	S	.	.	H	α-helix	trans	-70.6	-21.5	175.9	-74.7	-56	-48.8	0	0	113.2	K466 L471 R472	K466-M468 PolarHBondContact O-N 2.82Å; M468-L471 HydrophobicContact CE-CD2 4.16Å; M468-L471 HydrophobicContact SD-CD2 4.23Å; M468-R472 VanDerWaalsContact O-CB 3.3Å; M468-R472 WeakPolarHBondContact O-CB 3.37Å; M468-R472 VanDerWaalsContact O-CD 3.26Å; M468-R472 WeakPolarHBondContact O-CD 3.48Å; M468-R472 WeakPolarHBondContact O-CG 3.26Å; M468-R472 PolarHBondContact O-N 2.86Å
469	D	87.3	Confident	88.5	Confident	103 Å²	103	57.3 Å²	57.3	55%	0.551	28%	0.281	S	S	*	.	H	α-helix	trans	-86.2	-35.7	-174	-72.6	-42.6	0	0	0	112.4	D467 L471 R472 G473	D467-D469 VanDerWaalsContact C-N 3.28Å; D467-D469 PolarHBondContact O-N 2.89Å; D467-D469 PolarHBondContact OD1-N 2.96Å; D469-L471 VanDerWaalsContact C-N 3.31Å; D469-R472 VanDerWaalsContact OD1-CD 3.28Å; D469-R472 WeakPolarHBondContact OD1-CD 3.47Å; D469-R472 IonicContact OD1-CZ 3.68Å; D469-R472 IonicContact OD1-NE 3.91Å; D469-R472 IonicContact OD1-NH1 2.71Å; D469-R472 PolarHBondContact OD1-NH1 2.82Å; D469-R472 IonicContact OD2-NH1 3.97Å; D469-G473 PolarHBondContact O-N 2.83Å
470	S	88.3	Confident	88.2	Confident	8 Å²	8	62.6 Å²	62.6	6%	0.056	31%	0.309	C	S	.	.	H	α-helix	trans	-67.1	-32.5	165.3	-63.5	0	0	0	0	112	R413 D467 G473 L474	R413-S470 PolarHBondContact NH1-OG 3.14Å; R413-S470 VanDerWaalsContact NH1-OG 3.16Å; D467-S470 PolarHBondContact OD1-N 2.9Å; D467-S470 WeakPolarHBondContact OD2-CB 3.34Å; D467-S470 PolarHBondContact OD2-OG 3.2Å; S470-G473 PolarHBondContact O-N 2.82Å; S470-L474 PolarHBondContact O-N 3.49Å
471	L	90.4	Very high	87.9	Confident	10 Å²	10	62.4 Å²	62.4	5%	0.052	32%	0.316	C	S	.	.	H	α-helix	trans	-70.8	-42.4	173.4	-179.3	57.4	0	0	0	112.6	L415 F463 D467 M468 D469 G473 L474 Y475 F511	L415-L471 HydrophobicContact CD1-CB 4.05Å; L415-L471 HydrophobicContact CD1-CD1 3.97Å; L415-L471 HydrophobicContact CD2-CB 4.47Å; F463-L471 HydrophobicContact CB-CD1 3.86Å; F463-L471 HydrophobicContact CB-CD2 4.32Å; F463-L471 HydrophobicContact CD2-CD1 4.1Å; F463-L471 HydrophobicContact CG-CD1 4.03Å; D467-L471 PolarHBondContact O-N 2.99Å; M468-L471 HydrophobicContact CE-CD2 4.16Å; M468-L471 HydrophobicContact SD-CD2 4.23Å; D469-L471 VanDerWaalsContact C-N 3.31Å; L471-G473 VanDerWaalsContact C-N 3.26Å; L471-G473 PolarHBondContact O-N 3.16Å; L471-L474 PolarHBondContact O-N 3.5Å; L471-Y475 HydrophobicContact CD1-CD2 4.33Å; L471-Y475 HydrophobicContact CD1-CE2 3.91Å; L471-Y475 HydrophobicContact CD2-CE2 4.24Å; L471-Y475 HydrophobicContact CG-CD2 4.14Å; L471-Y475 HydrophobicContact CG-CE2 3.71Å; L471-Y475 VanDerWaalsContact O-CD2 3.23Å; L471-Y475 WeakPolarHBondContact O-CD2 3.48Å; L471-Y475 PolarHBondContact O-N 3.37Å; L471-F511 HydrophobicContact CD1-CE2 4.01Å; L471-F511 HydrophobicContact CD1-CZ 4.13Å
472	R	90.2	Very high	87.7	Confident	141 Å²	141	65.9 Å²	65.9	53%	0.532	33%	0.331	S	S	.	.	H	α-helix	trans	-59.6	-37.9	168.5	-75	159.5	177.4	167.8	-1.7	111.5	M468 D469 R476	M468-R472 VanDerWaalsContact O-CB 3.3Å; M468-R472 WeakPolarHBondContact O-CB 3.37Å; M468-R472 VanDerWaalsContact O-CD 3.26Å; M468-R472 WeakPolarHBondContact O-CD 3.48Å; M468-R472 WeakPolarHBondContact O-CG 3.26Å; M468-R472 PolarHBondContact O-N 2.86Å; D469-R472 VanDerWaalsContact OD1-CD 3.28Å; D469-R472 WeakPolarHBondContact OD1-CD 3.47Å; D469-R472 IonicContact OD1-CZ 3.68Å; D469-R472 IonicContact OD1-NE 3.91Å; D469-R472 IonicContact OD1-NH1 2.71Å; D469-R472 PolarHBondContact OD1-NH1 2.82Å; D469-R472 IonicContact OD2-NH1 3.97Å; R472-R476 WeakPolarHBondContact O-CB 3.48Å; R472-R476 PolarHBondContact O-N 2.62Å
473	G	90.5	Very high	87.6	Confident	14 Å²	14	62.5 Å²	62.5	14%	0.144	31%	0.313	C	S	.	.	H	α-helix	trans	-57.9	-51.9	172	0	0	0	0	0	111.8	D469 S470 L471 Y475 R476 I477	D469-G473 PolarHBondContact O-N 2.83Å; S470-G473 PolarHBondContact O-N 2.82Å; L471-G473 VanDerWaalsContact C-N 3.26Å; L471-G473 PolarHBondContact O-N 3.16Å; G473-Y475 PolarHBondContact O-N 2.9Å; G473-R476 WeakPolarHBondContact O-CB 3.24Å; G473-R476 PolarHBondContact O-N 3.01Å; G473-I477 WeakPolarHBondContact O-CD1 3.37Å; G473-I477 VanDerWaalsContact O-CG1 3.31Å; G473-I477 WeakPolarHBondContact O-CG1 3.42Å; G473-I477 PolarHBondContact O-N 2.74Å
474	L	91.9	Very high	87.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-45.2	178	-173.2	62	0	0	0	112.5	W397 L415 M438 F463 S470 L471 R476 I477 M478 F511	W397-L474 HydrophobicContact CD2-CD1 4.43Å; W397-L474 HydrophobicContact CE3-CD1 4.47Å; W397-L474 HydrophobicContact CH2-CB 3.89Å; W397-L474 HydrophobicContact CH2-CD1 4.15Å; W397-L474 HydrophobicContact CH2-CD2 4.06Å; W397-L474 HydrophobicContact CH2-CG 4.26Å; W397-L474 HydrophobicContact CZ2-CB 3.93Å; W397-L474 HydrophobicContact CZ2-CD1 4.09Å; W397-L474 HydrophobicContact CZ2-CG 4.47Å; W397-L474 HydrophobicContact CZ3-CD1 4.34Å; W397-L474 HydrophobicContact CZ3-CD2 4.16Å; L415-L474 HydrophobicContact CD1-CD2 4.03Å; M438-L474 HydrophobicContact CE-CD1 3.79Å; F463-L474 HydrophobicContact CD2-CD2 4.44Å; F463-L474 HydrophobicContact CE1-CD2 4.09Å; F463-L474 HydrophobicContact CE2-CD2 3.8Å; F463-L474 HydrophobicContact CZ-CD2 3.6Å; S470-L474 PolarHBondContact O-N 3.49Å; L471-L474 PolarHBondContact O-N 3.5Å; L474-R476 VanDerWaalsContact C-N 3.35Å; L474-R476 PolarHBondContact O-N 3.39Å; L474-I477 PolarHBondContact O-N 3.5Å; L474-M478 HydrophobicContact CD1-CE 3.74Å; L474-M478 HydrophobicContact CD1-SD 4.38Å; L474-M478 HydrophobicContact CG-CE 4.39Å; L474-M478 PolarHBondContact O-N 2.81Å; L474-F511 HydrophobicContact CD2-CE1 3.94Å; L474-F511 HydrophobicContact CD2-CZ 3.99Å; L474-F511 HydrophobicContact CG-CE1 3.95Å; L474-F511 HydrophobicContact CG-CZ 4.15Å
475	Y	91.3	Very high	88.3	Confident	74 Å²	74	59 Å²	59	29%	0.29	29%	0.294	S	S	.	.	H	α-helix	trans	-57	-46.3	172.8	-75.4	-51.9	0	0	0	111.9	L471 G473 A479 Y504 F511	L471-Y475 HydrophobicContact CD1-CD2 4.33Å; L471-Y475 HydrophobicContact CD1-CE2 3.91Å; L471-Y475 HydrophobicContact CD2-CE2 4.24Å; L471-Y475 HydrophobicContact CG-CD2 4.14Å; L471-Y475 HydrophobicContact CG-CE2 3.71Å; L471-Y475 VanDerWaalsContact O-CD2 3.23Å; L471-Y475 WeakPolarHBondContact O-CD2 3.48Å; L471-Y475 PolarHBondContact O-N 3.37Å; G473-Y475 PolarHBondContact O-N 2.9Å; Y475-A479 WeakPolarHBondContact O-CB 3.31Å; Y475-A479 PolarHBondContact O-N 2.75Å; Y475-Y504 HydrophobicContact CD1-CD1 4.22Å; Y475-Y504 AromaticContact CD1-CD2 3.8Å; Y475-Y504 HydrophobicContact CD1-CD2 3.8Å; Y475-Y504 AromaticContact CD1-CE1 3.88Å; Y475-Y504 HydrophobicContact CD1-CE1 3.88Å; Y475-Y504 AromaticContact CD1-CE2 3.44Å; Y475-Y504 HydrophobicContact CD1-CE2 3.44Å; Y475-Y504 VanDerWaalsContact CD1-CE2 3.44Å; Y475-Y504 HydrophobicContact CD1-CG 4.19Å; Y475-Y504 AromaticContact CD1-CZ 3.46Å; Y475-Y504 VanDerWaalsContact CD1-CZ 3.46Å; Y475-Y504 AromaticContact CE1-CD2 3.81Å; Y475-Y504 HydrophobicContact CE1-CD2 3.81Å; Y475-Y504 AromaticContact CE1-CE2 3.27Å; Y475-Y504 HydrophobicContact CE1-CE2 3.27Å; Y475-Y504 AromaticContact CE1-CZ 3.67Å; Y475-F511 HydrophobicContact CD1-CE1 4.18Å; Y475-F511 AromaticContact CD1-CE2 3.85Å; Y475-F511 HydrophobicContact CD1-CE2 3.85Å; Y475-F511 AromaticContact CD1-CZ 3.38Å; Y475-F511 HydrophobicContact CD1-CZ 3.38Å; Y475-F511 HydrophobicContact CE1-CD2 4.15Å; Y475-F511 HydrophobicContact CE1-CE1 4.27Å; Y475-F511 AromaticContact CE1-CE2 3.16Å; Y475-F511 HydrophobicContact CE1-CE2 3.16Å; Y475-F511 AromaticContact CE1-CZ 3.25Å; Y475-F511 HydrophobicContact CE1-CZ 3.25Å; Y475-F511 HydrophobicContact CG-CZ 4.18Å; Y475-F511 AromaticContact CZ-CE2 3.61Å; Y475-F511 AromaticContact CZ-CZ 3.97Å
476	R	90.3	Very high	89.1	Confident	175 Å²	175	58 Å²	58	66%	0.66	29%	0.286	S	S	*	.	H	α-helix	trans	-63.4	-43.1	178.2	-178.4	-175.9	-68.6	163	-1.5	111.8	R472 G473 L474 N480	R472-R476 WeakPolarHBondContact O-CB 3.48Å; R472-R476 PolarHBondContact O-N 2.62Å; G473-R476 WeakPolarHBondContact O-CB 3.24Å; G473-R476 PolarHBondContact O-N 3.01Å; L474-R476 VanDerWaalsContact C-N 3.35Å; L474-R476 PolarHBondContact O-N 3.39Å; R476-N480 VanDerWaalsContact O-CB 3.27Å; R476-N480 WeakPolarHBondContact O-CB 3.44Å; R476-N480 PolarHBondContact O-N 3.47Å; R476-N480 PolarHBondContact O-ND2 3.33Å
477	I	91.3	Very high	89.6	Confident	26 Å²	26	52.2 Å²	52.2	13%	0.133	26%	0.263	C	S	.	.	H	α-helix	trans	-60.3	-50.4	178.2	-74.2	159.2	0	0	0	110.5	E399 L440 G473 L474 N480 F482	E399-I477 HydrophobicContact CG-CD1 3.85Å; E399-I477 WeakPolarHBondContact OE1-CD1 3.39Å; L440-I477 HydrophobicContact CD1-CD1 4.4Å; L440-I477 HydrophobicContact CD1-CG2 3.86Å; L440-I477 HydrophobicContact CD2-CG2 3.69Å; L440-I477 HydrophobicContact CG-CG2 4.4Å; G473-I477 WeakPolarHBondContact O-CD1 3.37Å; G473-I477 VanDerWaalsContact O-CG1 3.31Å; G473-I477 WeakPolarHBondContact O-CG1 3.42Å; G473-I477 PolarHBondContact O-N 2.74Å; L474-I477 PolarHBondContact O-N 3.5Å; I477-N480 PolarHBondContact O-N 3.33Å; I477-F482 HydrophobicContact CG2-CB 3.78Å; I477-F482 HydrophobicContact CG2-CG 4.26Å; I477-F482 WeakPolarHBondContact O-CB 3.48Å; I477-F482 PolarHBondContact O-N 3.37Å
478	M	91.1	Very high	89.7	Confident	4 Å²	4	49.2 Å²	49.2	2%	0.02	25%	0.247	C	C	.	.	H	α-helix	trans	-73.7	-33.8	-177.5	-66	-175.9	174.4	0	0	113.2	M438 Q443 L474 N480 G481 F482 L502 F511	M438-M478 HydrophobicContact CE-CE 4.36Å; M438-M478 HydrophobicContact SD-CE 4Å; Q443-M478 PolarHBondContact NE2-O 3.37Å; L474-M478 HydrophobicContact CD1-CE 3.74Å; L474-M478 HydrophobicContact CD1-SD 4.38Å; L474-M478 HydrophobicContact CG-CE 4.39Å; L474-M478 PolarHBondContact O-N 2.81Å; M478-N480 VanDerWaalsContact C-N 3.27Å; M478-N480 PolarHBondContact O-N 3.45Å; M478-G481 PolarHBondContact O-N 2.7Å; M478-G481 VanDerWaalsContact O-N 3.17Å; M478-F482 WeakPolarHBondContact CA-O 3.48Å; M478-L502 HydrophobicContact CE-CB 4.16Å; M478-L502 HydrophobicContact CE-CD2 3.8Å; M478-L502 HydrophobicContact CE-CG 3.82Å; M478-F511 HydrophobicContact SD-CD1 3.8Å; M478-F511 HydrophobicContact SD-CE1 3.68Å
479	A	85.7	Confident	89.1	Confident	67 Å²	67	48.8 Å²	48.8	55%	0.554	25%	0.25	S	S	*	.	H	α-helix	trans	-64	-31.4	170.8	0	0	0	0	0	112.5	Y475 G481	Y475-A479 WeakPolarHBondContact O-CB 3.31Å; Y475-A479 PolarHBondContact O-N 2.75Å; A479-G481 PolarHBondContact O-N 2.96Å; A479-G481 VanDerWaalsContact O-N 3.11Å
480	N	87.4	Confident	87.9	Confident	114 Å²	114	49.6 Å²	49.6	61%	0.61	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	22.2	172.6	-70	-14.6	0	0	0	113.5	R476 I477 M478	R476-N480 VanDerWaalsContact O-CB 3.27Å; R476-N480 WeakPolarHBondContact O-CB 3.44Å; R476-N480 PolarHBondContact O-N 3.47Å; R476-N480 PolarHBondContact O-ND2 3.33Å; I477-N480 PolarHBondContact O-N 3.33Å; M478-N480 VanDerWaalsContact C-N 3.27Å; M478-N480 PolarHBondContact O-N 3.45Å
481	G	86.6	Confident	86.3	Confident	28 Å²	28	53.7 Å²	53.7	29%	0.289	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	30.5	173.3	0	0	0	0	0	114.9	Q443 M478 A479	Q443-G481 WeakPolarHBondContact CB-O 3.43Å; Q443-G481 WeakPolarHBondContact CG-O 3.44Å; Q443-G481 PolarHBondContact N-O 3.48Å; M478-G481 PolarHBondContact O-N 2.7Å; M478-G481 VanDerWaalsContact O-N 3.17Å; A479-G481 PolarHBondContact O-N 2.96Å; A479-G481 VanDerWaalsContact O-N 3.11Å
482	F	91.2	Very high	84.4	Confident	76 Å²	76	60.5 Å²	60.5	33%	0.333	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	153.8	168.6	-73.1	-99.7	0	0	0	112	L440 I441 P442 Q443 I477 M478	L440-F482 HydrophobicContact CB-CD1 4.23Å; I441-F482 CarbonylContact O-C 3.56Å; I441-F482 WeakPolarHBondContact O-CA 3.4Å; P442-F482 HydrophobicContact CB-CE1 4.45Å; P442-F482 HydrophobicContact CG-CD1 4.33Å; P442-F482 HydrophobicContact CG-CE1 3.84Å; P442-F482 HydrophobicContact CG-CZ 4.38Å; Q443-F482 PolarHBondContact NE2-O 2.89Å; I477-F482 HydrophobicContact CG2-CB 3.78Å; I477-F482 HydrophobicContact CG2-CG 4.26Å; I477-F482 WeakPolarHBondContact O-CB 3.48Å; I477-F482 PolarHBondContact O-N 3.37Å; M478-F482 WeakPolarHBondContact CA-O 3.48Å
483	A	92.3	Very high	82.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	159.6	172.5	0	0	0	0	0	109.8	L440 I441 Q443 L446 M501 L503	L440-A483 WeakPolarHBondContact CA-O 3.41Å; I441-A483 PolarHBondContact N-O 3.48Å; I441-A483 PolarHBondContact O-N 3.18Å; Q443-A483 HydrophobicContact CG-CB 3.94Å; L446-A483 HydrophobicContact CD1-CB 3.53Å; A483-M501 HydrophobicContact CB-CG 4.31Å; A483-M501 HydrophobicContact CB-SD 3.64Å; A483-L503 HydrophobicContact CB-CD2 3.49Å; A483-L503 VanDerWaalsContact CB-CD2 3.49Å
484	G	94.1	Very high	81.1	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	101.3	-175.1	0	0	0	0	0	113.3	M438 V486 M501 L502	M438-G484 VanDerWaalsContact CG-CA 3.41Å; M438-G484 WeakPolarHBondContact SD-CA 3.44Å; G484-V486 PolarHBondContact O-N 3.22Å; G484-M501 VanDerWaalsContact C-SD 3.51Å; G484-L502 PolarHBondContact N-O 3.29Å; G484-L502 PolarHBondContact O-N 3.23Å
485	C	93.2	Very high	79.8	Confident	14 Å²	14	62.8 Å²	62.8	10%	0.095	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	110.8	175.7	-172.6	0	0	0	0	110.4	Q439 I441 M501	Q439-C485 PolarHBondContact N-O 3.38Å; Q439-C485 PolarHBondContact O-N 3.44Å; I441-C485 HydrophobicContact CD1-CB 3.46Å; I441-C485 VanDerWaalsContact CD1-CB 3.46Å; I441-C485 HydrophobicContact CG1-CB 4.26Å; C485-M501 HydrophobicContact CB-CE 3.73Å; C485-M501 HydrophobicContact CB-SD 3.99Å
486	V	93.3	Very high	78.7	Confident	0 Å²	0	64 Å²	64	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	131	173.6	179.2	0	0	0	0	109	L395 L436 I437 M438 G484 F488 V499 L500	L395-V486 HydrophobicContact CD1-CG2 3.75Å; L436-V486 HydrophobicContact CB-CG1 3.9Å; L436-V486 HydrophobicContact CD1-CG1 4.43Å; L436-V486 HydrophobicContact CD2-CG1 4Å; L436-V486 HydrophobicContact CG-CG1 4.33Å; I437-V486 WeakPolarHBondContact O-CA 3.44Å; M438-V486 HydrophobicContact CB-CG2 4.01Å; M438-V486 HydrophobicContact CG-CG2 4.12Å; G484-V486 PolarHBondContact O-N 3.22Å; V486-F488 HydrophobicContact CG1-CD2 4.36Å; V486-F488 HydrophobicContact CG1-CE2 3.95Å; V486-V499 WeakPolarHBondContact O-CA 3.33Å; V486-V499 WeakPolarHBondContact O-CG2 3.35Å; V486-L500 HydrophobicContact CB-CB 4.27Å; V486-L500 HydrophobicContact CB-CD2 4.35Å; V486-L500 HydrophobicContact CG2-CD2 4.17Å; V486-L500 PolarHBondContact N-O 3.49Å; V486-L500 PolarHBondContact O-N 3.38Å
487	H	86.1	Confident	78.4	Confident	89 Å²	89	55.8 Å²	55.8	41%	0.412	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.8	177.2	-178.4	-77.2	0	0	0	110.6	I437 H490	I437-H487 PolarHBondContact O-N 3.45Å; H487-H490 AromaticContact CE1-CE1 3.88Å; H487-H490 AromaticContact CE1-ND1 3.8Å; H487-H490 AromaticContact NE2-CE1 3.91Å
488	F	85.8	Confident	78	Confident	4 Å²	4	61 Å²	61	2%	0.018	35%	0.345	C	S	.	.			trans	-89.6	129.9	-176.6	-69	-112.2	0	0	0	110.3	W432 P433 L436 V486 H490 V497 R498 L500	W432-F488 HydrophobicContact CB-CE1 4.39Å; W432-F488 AromaticContact CD2-CE1 3.64Å; W432-F488 HydrophobicContact CD2-CE1 3.64Å; W432-F488 AromaticContact CD2-CZ 3.95Å; W432-F488 HydrophobicContact CD2-CZ 3.95Å; W432-F488 AromaticContact CE2-CE1 3.96Å; W432-F488 AromaticContact CE3-CE1 3.96Å; W432-F488 HydrophobicContact CE3-CE1 3.96Å; W432-F488 AromaticContact CE3-CZ 3.94Å; W432-F488 HydrophobicContact CE3-CZ 3.94Å; W432-F488 AromaticContact CG-CE1 3.82Å; W432-F488 HydrophobicContact CG-CE1 3.82Å; W432-F488 HydrophobicContact CH2-CZ 4.18Å; W432-F488 HydrophobicContact CZ2-CZ 4.19Å; W432-F488 HydrophobicContact CZ3-CZ 4.05Å; P433-F488 HydrophobicContact CG-CD1 4.49Å; L436-F488 HydrophobicContact CD2-CD1 4.11Å; L436-F488 HydrophobicContact CD2-CE1 3.58Å; L436-F488 HydrophobicContact CD2-CE2 4.36Å; L436-F488 HydrophobicContact CD2-CZ 3.72Å; V486-F488 HydrophobicContact CG1-CD2 4.36Å; V486-F488 HydrophobicContact CG1-CE2 3.95Å; F488-H490 PolarHBondContact O-N 3.09Å; F488-H490 PolarHBondContact O-ND1 2.81Å; F488-H490 VanDerWaalsContact O-ND1 3.17Å; F488-V497 WeakPolarHBondContact CB-O 3.34Å; F488-V497 HydrophobicContact CD2-CG1 3.92Å; F488-V497 HydrophobicContact CE2-CB 4.35Å; F488-V497 HydrophobicContact CE2-CG1 3.54Å; F488-V497 WeakPolarHBondContact CG-O 3.45Å; F488-V497 HydrophobicContact CZ-CB 4.34Å; F488-V497 HydrophobicContact CZ-CG1 3.9Å; F488-R498 PolarHBondContact N-O 3.27Å; F488-L500 HydrophobicContact CE2-CB 4.08Å
489	P	73.6	Confident	78	Confident	78 Å²	78	60.9 Å²	60.9	51%	0.506	35%	0.345	S	S	.	.			trans	-59.2	132.2	178.1	-24.5	34.8	0	0	0	112.1	T491	P489-T491 PolarHBondContact O-N 2.7Å
490	H	61.8	Low	78.4	Confident	119 Å²	119	57.7 Å²	57.7	55%	0.551	32%	0.319	S	S	*	.			trans	-82	46.4	178.3	-72.1	39.3	0	0	0	111.8	H487 F488 R498	H487-H490 AromaticContact CE1-CE1 3.88Å; H487-H490 AromaticContact CE1-ND1 3.8Å; H487-H490 AromaticContact NE2-CE1 3.91Å; F488-H490 PolarHBondContact O-N 3.09Å; F488-H490 PolarHBondContact O-ND1 2.81Å; F488-H490 VanDerWaalsContact O-ND1 3.17Å; H490-R498 PolarHBondContact NE2-NH1 3.28Å
491	T	54.7	Low	78.7	Confident	95 Å²	95	52.3 Å²	52.3	58%	0.583	29%	0.29	S	S	*	.			trans	-116.1	119.6	-172	51.6	0	0	0	0	112.2	P489 S493	P489-T491 PolarHBondContact O-N 2.7Å; T491-S493 PolarHBondContact O-N 2.8Å; T491-S493 VanDerWaalsContact O-N 3.15Å
492	T	50.9	Low	79.1	Confident	153 Å²	153	51 Å²	51	94%	0.939	28%	0.276	S	S	*	.	S	Bend	trans	67.7	-6	162.1	49.1	0	0	0	0	120.6
493	S	53.8	Low	79.2	Confident	63 Å²	63	49.1 Å²	49.1	44%	0.441	27%	0.269	S	S	.	.	S	Bend	trans	-152.3	158.3	168.2	80.9	0	0	0	0	113.6	Q431 T491 C495	Q431-S493 PolarHBondContact OE1-OG 2.84Å; T491-S493 PolarHBondContact O-N 2.8Å; T491-S493 VanDerWaalsContact O-N 3.15Å; S493-C495 VanDerWaalsContact C-N 3.32Å; S493-C495 PolarHBondContact O-N 3.23Å
494	P	57	Low	79.3	Confident	113 Å²	113	50.9 Å²	50.9	73%	0.734	28%	0.276	S	S	*	.			trans	-79.1	78.5	178.1	33.6	-34.8	0	0	0	111.2	Q431 E496	Q431-P494 PolarHBondContact NE2-O 3.19Å; Q431-P494 PolarHBondContact OE1-O 3.05Å; P494-E496 PolarHBondContact O-N 3.44Å
495	C	63.6	Low	79	Confident	27 Å²	27	52 Å²	52	18%	0.182	28%	0.284	C	S	.	.			trans	-65.1	123.6	164.4	-156.3	0	0	0	0	109.2	S493 V497	S493-C495 VanDerWaalsContact C-N 3.32Å; S493-C495 PolarHBondContact O-N 3.23Å; C495-V497 PolarHBondContact O-N 3.15Å
496	E	70.1	Confident	78.6	Confident	100 Å²	100	55 Å²	55	47%	0.467	31%	0.305	S	S	.	.	S	Bend	trans	-58.1	-36	178.1	-173.2	-172.1	147.2	0	0	111.2	R457 P494	R457-E496 IonicContact CZ-OE1 3.79Å; R457-E496 IonicContact NH2-OE1 2.7Å; R457-E496 PolarHBondContact NH2-OE1 3.17Å; P494-E496 PolarHBondContact O-N 3.44Å
497	V	82.9	Confident	78.2	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.006	35%	0.345	C	S	.	.			trans	-98.5	126.5	-178.6	-174.9	0	0	0	0	110.8	L427 W432 F488 C495 V499 I515	L427-V497 HydrophobicContact CD1-CG2 4.38Å; W432-V497 HydrophobicContact CZ2-CB 4.41Å; W432-V497 HydrophobicContact CZ2-CG2 4Å; F488-V497 WeakPolarHBondContact CB-O 3.34Å; F488-V497 HydrophobicContact CD2-CG1 3.92Å; F488-V497 HydrophobicContact CE2-CB 4.35Å; F488-V497 HydrophobicContact CE2-CG1 3.54Å; F488-V497 WeakPolarHBondContact CG-O 3.45Å; F488-V497 HydrophobicContact CZ-CB 4.34Å; F488-V497 HydrophobicContact CZ-CG1 3.9Å; C495-V497 PolarHBondContact O-N 3.15Å; V497-V499 WeakPolarHBondContact CG1-O 3.31Å; V497-I515 HydrophobicContact CG1-CG2 4.04Å; V497-I515 HydrophobicContact CG2-CD1 4.35Å; V497-I515 HydrophobicContact CG2-CG2 3.83Å
498	R	84.1	Confident	78	Confident	136 Å²	136	67.5 Å²	67.5	51%	0.513	36%	0.358	S	S	.	.	S	Bend	trans	-104.8	-29.2	173.9	-58.8	-175.3	-174.6	-154.4	9.2	112.4	F488 H490	F488-R498 PolarHBondContact N-O 3.27Å; H490-R498 PolarHBondContact NE2-NH1 3.28Å
499	V	90.4	Very high	78.1	Confident	2 Å²	2	73.7 Å²	73.7	1%	0.012	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	142.6	-176.2	68.3	0	0	0	0	112	V486 V497 P516 Q519 F522 V523	V486-V499 WeakPolarHBondContact O-CA 3.33Å; V486-V499 WeakPolarHBondContact O-CG2 3.35Å; V497-V499 WeakPolarHBondContact CG1-O 3.31Å; V499-P516 HydrophobicContact CG1-CG 4.47Å; V499-Q519 PolarHBondContact O-NE2 3.33Å; V499-Q519 PolarHBondContact O-OE1 3.45Å; V499-F522 HydrophobicContact CB-CD1 4.39Å; V499-F522 HydrophobicContact CG1-CB 4.36Å; V499-F522 HydrophobicContact CG1-CD1 3.72Å; V499-F522 HydrophobicContact CG1-CG 4.4Å; V499-F522 HydrophobicContact CG2-CD1 3.72Å; V499-F522 HydrophobicContact CG2-CE1 3.84Å; V499-V523 HydrophobicContact CB-CG2 3.86Å; V499-V523 HydrophobicContact CG1-CG2 3.89Å; V499-V523 HydrophobicContact CG2-CG2 4.23Å
500	L	93.4	Very high	78.9	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	140.7	175.3	176.5	157.4	0	0	0	108.9	W432 V459 F461 V486 F488 L514 I515	W432-L500 HydrophobicContact CH2-CD1 3.85Å; W432-L500 HydrophobicContact CZ3-CD1 4.28Å; V459-L500 HydrophobicContact CG2-CD1 4.29Å; F461-L500 HydrophobicContact CE2-CD1 3.91Å; F461-L500 HydrophobicContact CE2-CD2 3.87Å; F461-L500 HydrophobicContact CZ-CD1 3.96Å; F461-L500 HydrophobicContact CZ-CD2 3.89Å; V486-L500 HydrophobicContact CB-CB 4.27Å; V486-L500 HydrophobicContact CB-CD2 4.35Å; V486-L500 HydrophobicContact CG2-CD2 4.17Å; V486-L500 PolarHBondContact N-O 3.49Å; V486-L500 PolarHBondContact O-N 3.38Å; F488-L500 HydrophobicContact CE2-CB 4.08Å; L500-L514 CarbonylContact C-O 3.59Å; L500-L514 VanDerWaalsContact CA-O 3.32Å; L500-L514 WeakPolarHBondContact CA-O 3.33Å; L500-I515 HydrophobicContact CB-CG1 4.37Å; L500-I515 HydrophobicContact CD1-CD1 4.16Å; L500-I515 HydrophobicContact CD1-CG1 3.74Å; L500-I515 HydrophobicContact CG-CG1 4.07Å
501	M	94.1	Very high	80.4	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.4	173	-173.1	69.1	68	0	0	111.1	I441 L446 F453 A483 G484 C485 L503 G513 L514 F522 I526	I441-M501 HydrophobicContact CD1-CE 4.3Å; L446-M501 HydrophobicContact CD1-CE 3.88Å; L446-M501 HydrophobicContact CD1-SD 4.12Å; L446-M501 HydrophobicContact CD2-CE 4.12Å; F453-M501 HydrophobicContact CE1-CB 3.85Å; F453-M501 HydrophobicContact CE1-CE 4.28Å; F453-M501 HydrophobicContact CE1-CG 3.75Å; F453-M501 HydrophobicContact CZ-CE 4.17Å; F453-M501 HydrophobicContact CZ-CG 4.39Å; A483-M501 HydrophobicContact CB-CG 4.31Å; A483-M501 HydrophobicContact CB-SD 3.64Å; G484-M501 VanDerWaalsContact C-SD 3.51Å; C485-M501 HydrophobicContact CB-CE 3.73Å; C485-M501 HydrophobicContact CB-SD 3.99Å; M501-L503 HydrophobicContact CG-CD2 4.23Å; M501-L503 HydrophobicContact CG-CG 4.28Å; M501-G513 CarbonylContact O-C 3.38Å; M501-G513 WeakPolarHBondContact O-CA 3.4Å; M501-L514 PolarHBondContact N-O 3.32Å; M501-L514 PolarHBondContact O-N 2.76Å; M501-F522 HydrophobicContact CB-CZ 4.12Å; M501-F522 HydrophobicContact CE-CE1 3.98Å; M501-F522 HydrophobicContact CE-CZ 3.62Å; M501-I526 HydrophobicContact CE-CD1 3.75Å
502	L	95.4	Very high	82.3	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	125	174.5	-169.8	63.4	0	0	0	110.8	L395 M438 F461 F463 M478 G484 F511	L395-L502 HydrophobicContact CD2-CD2 3.46Å; L395-L502 VanDerWaalsContact CD2-CD2 3.46Å; M438-L502 HydrophobicContact SD-CB 4.37Å; M438-L502 HydrophobicContact SD-CD2 3.94Å; F461-L502 HydrophobicContact CB-CD1 3.88Å; F461-L502 HydrophobicContact CD1-CD1 4.15Å; F461-L502 HydrophobicContact CD2-CD1 3.53Å; F461-L502 HydrophobicContact CE2-CD1 4.06Å; F461-L502 HydrophobicContact CG-CD1 3.58Å; F463-L502 HydrophobicContact CE2-CD2 4.44Å; F463-L502 HydrophobicContact CZ-CD2 3.99Å; M478-L502 HydrophobicContact CE-CB 4.16Å; M478-L502 HydrophobicContact CE-CD2 3.8Å; M478-L502 HydrophobicContact CE-CG 3.82Å; G484-L502 PolarHBondContact N-O 3.29Å; G484-L502 PolarHBondContact O-N 3.23Å; L502-F511 HydrophobicContact CD1-CB 4.01Å
503	L	93.2	Very high	84.4	Confident	37 Å²	37	56.7 Å²	56.7	19%	0.194	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	149.9	177.8	-62.5	174.7	0	0	0	110.3	A483 M501 F511 M512 L514	A483-L503 HydrophobicContact CB-CD2 3.49Å; A483-L503 VanDerWaalsContact CB-CD2 3.49Å; M501-L503 HydrophobicContact CG-CD2 4.23Å; M501-L503 HydrophobicContact CG-CG 4.28Å; L503-F511 CarbonylContact O-C 3.58Å; L503-F511 WeakPolarHBondContact O-CA 3.35Å; L503-M512 HydrophobicContact CB-CE 4.29Å; L503-M512 PolarHBondContact N-O 3.16Å; L503-M512 PolarHBondContact O-N 3.43Å; L503-L514 HydrophobicContact CD1-CD1 3.71Å
504	Y	93.9	Very high	86.3	Confident	37 Å²	37	54.4 Å²	54.4	15%	0.145	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	125.4	173.2	175.2	-121.4	0	0	0	111.2	Y475 S506 K509 I510 F511	Y475-Y504 HydrophobicContact CD1-CD1 4.22Å; Y475-Y504 AromaticContact CD1-CD2 3.8Å; Y475-Y504 HydrophobicContact CD1-CD2 3.8Å; Y475-Y504 AromaticContact CD1-CE1 3.88Å; Y475-Y504 HydrophobicContact CD1-CE1 3.88Å; Y475-Y504 AromaticContact CD1-CE2 3.44Å; Y475-Y504 HydrophobicContact CD1-CE2 3.44Å; Y475-Y504 VanDerWaalsContact CD1-CE2 3.44Å; Y475-Y504 HydrophobicContact CD1-CG 4.19Å; Y475-Y504 AromaticContact CD1-CZ 3.46Å; Y475-Y504 VanDerWaalsContact CD1-CZ 3.46Å; Y475-Y504 AromaticContact CE1-CD2 3.81Å; Y475-Y504 HydrophobicContact CE1-CD2 3.81Å; Y475-Y504 AromaticContact CE1-CE2 3.27Å; Y475-Y504 HydrophobicContact CE1-CE2 3.27Å; Y475-Y504 AromaticContact CE1-CZ 3.67Å; Y504-S506 PolarHBondContact O-N 3.11Å; Y504-K509 VanDerWaalsContact OH-CD 3.3Å; Y504-K509 WeakPolarHBondContact OH-CD 3.28Å; Y504-I510 WeakPolarHBondContact CD2-O 3.24Å; Y504-F511 HydrophobicContact CD2-CD1 4.05Å; Y504-F511 HydrophobicContact CD2-CD2 4.49Å; Y504-F511 HydrophobicContact CD2-CE1 4.01Å; Y504-F511 HydrophobicContact CD2-CE2 4.46Å; Y504-F511 HydrophobicContact CD2-CG 4.3Å; Y504-F511 HydrophobicContact CD2-CZ 4.24Å; Y504-F511 HydrophobicContact CG-CD1 4.4Å; Y504-F511 HydrophobicContact CG-CE1 4.22Å
505	S	87.8	Confident	87.9	Confident	24 Å²	24	49.2 Å²	49.2	17%	0.168	23%	0.232	C	C	.	.			trans	-88.2	103.1	170.2	-172.9	0	0	0	0	110.2	K507 K508 K509 I510	S505-K507 PolarHBondContact O-N 3.09Å; S505-K508 PolarHBondContact O-N 2.89Å; S505-K508 PolarHBondContact OG-N 3.12Å; S505-K508 VanDerWaalsContact OG-N 3.1Å; S505-K509 VanDerWaalsContact O-CA 3.26Å; S505-K509 WeakPolarHBondContact O-CA 3.47Å; S505-K509 PolarHBondContact O-N 3Å; S505-I510 PolarHBondContact N-O 2.74Å
506	S	84.9	Confident	89.2	Confident	76 Å²	76	48 Å²	48	53%	0.531	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-26	173.3	60.5	0	0	0	0	113.2	Y504 K509	Y504-S506 PolarHBondContact O-N 3.11Å; S506-K509 WeakPolarHBondContact O-CD 3.31Å; S506-K509 WeakPolarHBondContact O-CE 3.18Å; S506-K509 PolarHBondContact O-NZ 3.35Å
507	K	84.6	Confident	89.9	Confident	194 Å²	194	47.7 Å²	47.7	84%	0.843	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-54.2	174.9	-175.4	176.2	-179.5	178.3	0	112.1	S505	S505-K507 PolarHBondContact O-N 3.09Å
508	K	83	Confident	90.1	Very high	158 Å²	158	50.8 Å²	50.8	69%	0.687	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-7.5	-178.1	-69.1	-171.8	176.8	-173.8	0	114.2	S505 I510	S505-K508 PolarHBondContact O-N 2.89Å; S505-K508 PolarHBondContact OG-N 3.12Å; S505-K508 VanDerWaalsContact OG-N 3.1Å; K508-I510 HydrophobicContact CB-CD1 4.05Å; K508-I510 HydrophobicContact CB-CG1 3.82Å; K508-I510 HydrophobicContact CD-CD1 4.15Å; K508-I510 PolarHBondContact O-N 2.72Å
509	K	86.4	Confident	90.2	Very high	135 Å²	135	45.4 Å²	45.4	59%	0.587	22%	0.222	S	C	*	.			trans	57.7	20.7	-174.8	-55	-58.5	-176.6	-159.3	0	115.5	Y504 S505 S506	Y504-K509 VanDerWaalsContact OH-CD 3.3Å; Y504-K509 WeakPolarHBondContact OH-CD 3.28Å; S505-K509 VanDerWaalsContact O-CA 3.26Å; S505-K509 WeakPolarHBondContact O-CA 3.47Å; S505-K509 PolarHBondContact O-N 3Å; S506-K509 WeakPolarHBondContact O-CD 3.31Å; S506-K509 WeakPolarHBondContact O-CE 3.18Å; S506-K509 PolarHBondContact O-NZ 3.35Å
510	I	90.5	Very high	90	Very high	45 Å²	45	48.9 Å²	48.9	23%	0.231	25%	0.247	C	C	.	.			trans	-108.9	154.5	179.2	60.7	177.9	0	0	0	112.1	Y504 S505 K508 M512	Y504-I510 WeakPolarHBondContact CD2-O 3.24Å; S505-I510 PolarHBondContact N-O 2.74Å; K508-I510 HydrophobicContact CB-CD1 4.05Å; K508-I510 HydrophobicContact CB-CG1 3.82Å; K508-I510 HydrophobicContact CD-CD1 4.15Å; K508-I510 PolarHBondContact O-N 2.72Å; I510-M512 HydrophobicContact CD1-CG 3.9Å; I510-M512 HydrophobicContact CD1-SD 4.2Å; I510-M512 HydrophobicContact CG1-CG 3.92Å; I510-M512 HydrophobicContact CG1-SD 4.37Å
511	F	94.6	Very high	89.6	Confident	5 Å²	5	49.9 Å²	49.9	2%	0.022	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	133.6	162.1	-64	-89.3	0	0	0	110	F461 F463 L471 L474 Y475 M478 L502 L503 Y504	F461-F511 HydrophobicContact CB-CB 3.82Å; F461-F511 PolarHBondContact N-O 3Å; F463-F511 AromaticContact CD2-CD2 3.48Å; F463-F511 HydrophobicContact CD2-CD2 3.48Å; F463-F511 VanDerWaalsContact CD2-CD2 3.48Å; F463-F511 AromaticContact CD2-CE2 3.48Å; F463-F511 HydrophobicContact CD2-CE2 3.48Å; F463-F511 VanDerWaalsContact CD2-CE2 3.48Å; F463-F511 HydrophobicContact CD2-CG 4.11Å; F463-F511 HydrophobicContact CD2-CZ 4.13Å; F463-F511 HydrophobicContact CE2-CB 4.18Å; F463-F511 AromaticContact CE2-CD1 3.99Å; F463-F511 HydrophobicContact CE2-CD1 3.99Å; F463-F511 AromaticContact CE2-CD2 3.52Å; F463-F511 HydrophobicContact CE2-CD2 3.52Å; F463-F511 HydrophobicContact CE2-CE1 4.17Å; F463-F511 AromaticContact CE2-CE2 3.71Å; F463-F511 HydrophobicContact CE2-CE2 3.71Å; F463-F511 AromaticContact CE2-CG 3.65Å; F463-F511 HydrophobicContact CE2-CG 3.65Å; F463-F511 HydrophobicContact CE2-CZ 4.03Å; L471-F511 HydrophobicContact CD1-CE2 4.01Å; L471-F511 HydrophobicContact CD1-CZ 4.13Å; L474-F511 HydrophobicContact CD2-CE1 3.94Å; L474-F511 HydrophobicContact CD2-CZ 3.99Å; L474-F511 HydrophobicContact CG-CE1 3.95Å; L474-F511 HydrophobicContact CG-CZ 4.15Å; Y475-F511 HydrophobicContact CD1-CE1 4.18Å; Y475-F511 AromaticContact CD1-CE2 3.85Å; Y475-F511 HydrophobicContact CD1-CE2 3.85Å; Y475-F511 AromaticContact CD1-CZ 3.38Å; Y475-F511 HydrophobicContact CD1-CZ 3.38Å; Y475-F511 HydrophobicContact CE1-CD2 4.15Å; Y475-F511 HydrophobicContact CE1-CE1 4.27Å; Y475-F511 AromaticContact CE1-CE2 3.16Å; Y475-F511 HydrophobicContact CE1-CE2 3.16Å; Y475-F511 AromaticContact CE1-CZ 3.25Å; Y475-F511 HydrophobicContact CE1-CZ 3.25Å; Y475-F511 HydrophobicContact CG-CZ 4.18Å; Y475-F511 AromaticContact CZ-CE2 3.61Å; Y475-F511 AromaticContact CZ-CZ 3.97Å; M478-F511 HydrophobicContact SD-CD1 3.8Å; M478-F511 HydrophobicContact SD-CE1 3.68Å; L502-F511 HydrophobicContact CD1-CB 4.01Å; L503-F511 CarbonylContact O-C 3.58Å; L503-F511 WeakPolarHBondContact O-CA 3.35Å; Y504-F511 HydrophobicContact CD2-CD1 4.05Å; Y504-F511 HydrophobicContact CD2-CD2 4.49Å; Y504-F511 HydrophobicContact CD2-CE1 4.01Å; Y504-F511 HydrophobicContact CD2-CE2 4.46Å; Y504-F511 HydrophobicContact CD2-CG 4.3Å; Y504-F511 HydrophobicContact CD2-CZ 4.24Å; Y504-F511 HydrophobicContact CG-CD1 4.4Å; Y504-F511 HydrophobicContact CG-CE1 4.22Å
512	M	94.2	Very high	89.3	Confident	38 Å²	38	49.9 Å²	49.9	19%	0.187	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.2	-175.8	-54	174.7	-56.3	0	0	107.7	M458 L503 I510	M458-M512 HydrophobicContact SD-SD 4.4Å; L503-M512 HydrophobicContact CB-CE 4.29Å; L503-M512 PolarHBondContact N-O 3.16Å; L503-M512 PolarHBondContact O-N 3.43Å; I510-M512 HydrophobicContact CD1-CG 3.9Å; I510-M512 HydrophobicContact CD1-SD 4.2Å; I510-M512 HydrophobicContact CG1-CG 3.92Å; I510-M512 HydrophobicContact CG1-SD 4.37Å
513	G	94.3	Very high	88.8	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	133.9	166.8	0	0	0	0	0	109.6	M458 V459 M501	M458-G513 WeakPolarHBondContact CA-O 3.28Å; V459-G513 PolarHBondContact N-O 3.46Å; V459-G513 PolarHBondContact O-N 3.32Å; M501-G513 CarbonylContact O-C 3.38Å; M501-G513 WeakPolarHBondContact O-CA 3.4Å
514	L	93.2	Very high	88.5	Confident	14 Å²	14	54.1 Å²	54.1	7%	0.073	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	125.8	171.8	-65	178.9	0	0	0	108.5	F453 M458 L500 M501 L503 P516	F453-L514 HydrophobicContact CB-CD1 4.24Å; F453-L514 HydrophobicContact CD1-CD1 3.75Å; F453-L514 HydrophobicContact CG-CD1 4.43Å; M458-L514 HydrophobicContact CB-CD2 4.1Å; M458-L514 HydrophobicContact CE-CD2 4.03Å; M458-L514 HydrophobicContact CG-CD2 4.05Å; L500-L514 CarbonylContact C-O 3.59Å; L500-L514 VanDerWaalsContact CA-O 3.32Å; L500-L514 WeakPolarHBondContact CA-O 3.33Å; M501-L514 PolarHBondContact N-O 3.32Å; M501-L514 PolarHBondContact O-N 2.76Å; L503-L514 HydrophobicContact CD1-CD1 3.71Å; L514-P516 WeakPolarHBondContact O-CD 3.3Å
515	I	92.1	Very high	88.1	Confident	5 Å²	5	52.7 Å²	52.7	3%	0.026	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	100.1	176.1	-61.7	169.6	0	0	0	106.5	L427 W432 S456 R457 V459 V497 L500 N517	L427-I515 HydrophobicContact CD1-CD1 3.91Å; L427-I515 HydrophobicContact CD2-CD1 4.05Å; W432-I515 HydrophobicContact CH2-CD1 4.1Å; W432-I515 HydrophobicContact CZ2-CD1 4.09Å; S456-I515 CarbonylContact C-O 3.56Å; S456-I515 VanDerWaalsContact CA-O 3.27Å; S456-I515 WeakPolarHBondContact CA-O 3.44Å; R457-I515 HydrophobicContact CB-CB 4.29Å; R457-I515 PolarHBondContact N-O 3.49Å; R457-I515 PolarHBondContact O-N 3.32Å; V459-I515 HydrophobicContact CG1-CD1 3.87Å; V497-I515 HydrophobicContact CG1-CG2 4.04Å; V497-I515 HydrophobicContact CG2-CD1 4.35Å; V497-I515 HydrophobicContact CG2-CG2 3.83Å; L500-I515 HydrophobicContact CB-CG1 4.37Å; L500-I515 HydrophobicContact CD1-CD1 4.16Å; L500-I515 HydrophobicContact CD1-CG1 3.74Å; L500-I515 HydrophobicContact CG-CG1 4.07Å; I515-N517 PolarHBondContact O-N 3.12Å
516	P	89.4	Confident	88.1	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.013	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	136.1	-178.3	-24.1	34.5	0	0	0	111.7	S456 V499 L514 Q519 F522	S456-P516 VanDerWaalsContact OG-CA 3.31Å; S456-P516 WeakPolarHBondContact OG-CA 3.47Å; V499-P516 HydrophobicContact CG1-CG 4.47Å; L514-P516 WeakPolarHBondContact O-CD 3.3Å; P516-Q519 WeakPolarHBondContact O-CG 3.47Å; P516-Q519 PolarHBondContact O-N 3.35Å; P516-Q519 PolarHBondContact O-NE2 3.02Å; P516-F522 HydrophobicContact CB-CB 3.99Å; P516-F522 HydrophobicContact CB-CD2 4.12Å; P516-F522 HydrophobicContact CB-CG 4.07Å; P516-F522 HydrophobicContact CG-CB 4Å; P516-F522 HydrophobicContact CG-CD1 3.89Å; P516-F522 HydrophobicContact CG-CD2 3.58Å; P516-F522 HydrophobicContact CG-CE1 4.21Å; P516-F522 HydrophobicContact CG-CE2 3.93Å; P516-F522 HydrophobicContact CG-CG 3.54Å; P516-F522 HydrophobicContact CG-CZ 4.22Å
517	N	86.5	Confident	88.1	Confident	93 Å²	93	56.2 Å²	56.2	50%	0.497	28%	0.277	S	S	.	.	S	Bend	trans	-69.7	-41.7	176.7	-68.1	-28	0	0	0	110.3	N455 I515 Q519	N455-N517 PolarHBondContact O-N 2.89Å; N455-N517 WeakPolarHBondContact OD1-CB 3.31Å; N455-N517 PolarHBondContact OD1-ND2 3.48Å; I515-N517 PolarHBondContact O-N 3.12Å; N517-Q519 VanDerWaalsContact C-N 3.34Å; N517-Q519 PolarHBondContact O-N 3.25Å; N517-Q519 VanDerWaalsContact O-N 3.14Å
518	D	86.3	Confident	88.2	Confident	65 Å²	65	53.7 Å²	53.7	35%	0.348	27%	0.269	S	S	.	.	S	Bend	trans	-83.2	82	159.7	-179	18.1	0	0	0	111.1	S520 G521 F522	D518-S520 PolarHBondContact O-N 3.11Å; D518-S520 WeakPolarHBondContact OD1-CA 3.38Å; D518-S520 WeakPolarHBondContact OD1-CB 3.31Å; D518-S520 PolarHBondContact OD1-N 3.17Å; D518-S520 PolarHBondContact OD1-OG 3Å; D518-G521 PolarHBondContact OD1-N 2.81Å; D518-G521 WeakPolarHBondContact OD2-CA 3.11Å; D518-G521 PolarHBondContact OD2-N 3.04Å; D518-F522 WeakPolarHBondContact O-CB 3.37Å; D518-F522 PolarHBondContact O-N 3.49Å
519	Q	86.5	Confident	88.2	Confident	23 Å²	23	47.5 Å²	47.5	11%	0.107	24%	0.244	C	C	.	.	H	α-helix	trans	-53.8	-28.1	169.5	-68.4	-76.3	-58.6	0	0	113.2	V499 P516 N517 V523	V499-Q519 PolarHBondContact O-NE2 3.33Å; V499-Q519 PolarHBondContact O-OE1 3.45Å; P516-Q519 WeakPolarHBondContact O-CG 3.47Å; P516-Q519 PolarHBondContact O-N 3.35Å; P516-Q519 PolarHBondContact O-NE2 3.02Å; N517-Q519 VanDerWaalsContact C-N 3.34Å; N517-Q519 PolarHBondContact O-N 3.25Å; N517-Q519 VanDerWaalsContact O-N 3.14Å; Q519-V523 WeakPolarHBondContact O-CG2 3.35Å; Q519-V523 PolarHBondContact O-N 3.12Å
520	S	85.6	Confident	88.1	Confident	75 Å²	75	43.7 Å²	43.7	52%	0.524	23%	0.229	S	C	.	.	H	α-helix	trans	-88.7	-51.2	-168.6	75.4	0	0	0	0	113	D518 F522 V523 N524	D518-S520 PolarHBondContact O-N 3.11Å; D518-S520 WeakPolarHBondContact OD1-CA 3.38Å; D518-S520 WeakPolarHBondContact OD1-CB 3.31Å; D518-S520 PolarHBondContact OD1-N 3.17Å; D518-S520 PolarHBondContact OD1-OG 3Å; S520-F522 PolarHBondContact O-N 3.41Å; S520-V523 PolarHBondContact O-N 3.27Å; S520-N524 PolarHBondContact O-N 3.49Å; S520-N524 VanDerWaalsContact O-N 3.12Å; S520-N524 PolarHBondContact O-ND2 2.9Å
521	G	85.6	Confident	87.8	Confident	22 Å²	22	44.7 Å²	44.7	23%	0.227	24%	0.237	C	C	.	.	H	α-helix	trans	-62.1	-31.3	172.1	0	0	0	0	0	111.7	D518 N524 G525	D518-G521 PolarHBondContact OD1-N 2.81Å; D518-G521 WeakPolarHBondContact OD2-CA 3.11Å; D518-G521 PolarHBondContact OD2-N 3.04Å; G521-N524 PolarHBondContact O-N 3.08Å; G521-G525 PolarHBondContact O-N 3.35Å
522	F	86.3	Confident	87.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-62.9	-51.1	173.5	-166.5	-95.1	0	0	0	113.3	L452 F453 V499 M501 P516 D518 S520 N524 G525 I526	L452-F522 HydrophobicContact CB-CD2 3.74Å; L452-F522 HydrophobicContact CB-CE2 4.37Å; L452-F522 HydrophobicContact CD1-CB 4.21Å; L452-F522 HydrophobicContact CD1-CD2 3.91Å; L452-F522 HydrophobicContact CG-CD2 4.48Å; F453-F522 HydrophobicContact CD1-CE2 4.01Å; F453-F522 HydrophobicContact CD1-CZ 4.41Å; F453-F522 AromaticContact CE1-CE2 3.4Å; F453-F522 HydrophobicContact CE1-CE2 3.4Å; F453-F522 AromaticContact CE1-CZ 3.47Å; F453-F522 HydrophobicContact CE1-CZ 3.47Å; F453-F522 VanDerWaalsContact CE1-CZ 3.47Å; F453-F522 HydrophobicContact CE2-CE2 4.16Å; F453-F522 AromaticContact CZ-CE2 3.48Å; F453-F522 HydrophobicContact CZ-CE2 3.48Å; F453-F522 VanDerWaalsContact CZ-CE2 3.48Å; F453-F522 AromaticContact CZ-CZ 3.62Å; F453-F522 HydrophobicContact CZ-CZ 3.62Å; V499-F522 HydrophobicContact CB-CD1 4.39Å; V499-F522 HydrophobicContact CG1-CB 4.36Å; V499-F522 HydrophobicContact CG1-CD1 3.72Å; V499-F522 HydrophobicContact CG1-CG 4.4Å; V499-F522 HydrophobicContact CG2-CD1 3.72Å; V499-F522 HydrophobicContact CG2-CE1 3.84Å; M501-F522 HydrophobicContact CB-CZ 4.12Å; M501-F522 HydrophobicContact CE-CE1 3.98Å; M501-F522 HydrophobicContact CE-CZ 3.62Å; P516-F522 HydrophobicContact CB-CB 3.99Å; P516-F522 HydrophobicContact CB-CD2 4.12Å; P516-F522 HydrophobicContact CB-CG 4.07Å; P516-F522 HydrophobicContact CG-CB 4Å; P516-F522 HydrophobicContact CG-CD1 3.89Å; P516-F522 HydrophobicContact CG-CD2 3.58Å; P516-F522 HydrophobicContact CG-CE1 4.21Å; P516-F522 HydrophobicContact CG-CE2 3.93Å; P516-F522 HydrophobicContact CG-CG 3.54Å; P516-F522 HydrophobicContact CG-CZ 4.22Å; D518-F522 WeakPolarHBondContact O-CB 3.37Å; D518-F522 PolarHBondContact O-N 3.49Å; S520-F522 PolarHBondContact O-N 3.41Å; F522-N524 VanDerWaalsContact C-N 3.25Å; F522-N524 PolarHBondContact O-N 3.41Å; F522-G525 PolarHBondContact O-N 2.91Å; F522-I526 HydrophobicContact CD1-CG1 3.88Å; F522-I526 HydrophobicContact CE1-CD1 4.03Å; F522-I526 HydrophobicContact CE1-CG1 3.62Å; F522-I526 HydrophobicContact CE2-CG1 4.46Å; F522-I526 HydrophobicContact CG-CG1 4.42Å; F522-I526 HydrophobicContact CZ-CD1 3.93Å; F522-I526 HydrophobicContact CZ-CG1 3.94Å; F522-I526 WeakPolarHBondContact O-CB 3.41Å; F522-I526 WeakPolarHBondContact O-CG1 3.27Å; F522-I526 PolarHBondContact O-N 3.01Å
523	V	86.7	Confident	86.6	Confident	31 Å²	31	50.8 Å²	50.8	19%	0.188	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-38.1	176.7	170.5	0	0	0	0	111.2	V499 Q519 S520 R527	V499-V523 HydrophobicContact CB-CG2 3.86Å; V499-V523 HydrophobicContact CG1-CG2 3.89Å; V499-V523 HydrophobicContact CG2-CG2 4.23Å; Q519-V523 WeakPolarHBondContact O-CG2 3.35Å; Q519-V523 PolarHBondContact O-N 3.12Å; S520-V523 PolarHBondContact O-N 3.27Å; V523-R527 VanDerWaalsContact O-CB 3.25Å; V523-R527 WeakPolarHBondContact O-CB 3.34Å; V523-R527 PolarHBondContact O-N 3.49Å; V523-R527 VanDerWaalsContact O-N 3.07Å
524	N	86.2	Confident	85.9	Confident	94 Å²	94	57 Å²	57	50%	0.503	30%	0.295	S	S	.	.	H	α-helix	trans	-69.1	-47.2	178.3	-71.3	-31	0	0	0	112.6	S520 G521 F522 R527 Q528	S520-N524 PolarHBondContact O-N 3.49Å; S520-N524 VanDerWaalsContact O-N 3.12Å; S520-N524 PolarHBondContact O-ND2 2.9Å; G521-N524 PolarHBondContact O-N 3.08Å; F522-N524 VanDerWaalsContact C-N 3.25Å; F522-N524 PolarHBondContact O-N 3.41Å; N524-R527 WeakPolarHBondContact O-CB 3.49Å; N524-R527 PolarHBondContact O-N 2.96Å; N524-Q528 WeakPolarHBondContact O-CB 3.25Å; N524-Q528 PolarHBondContact O-N 3.32Å
525	G	86.4	Confident	85.2	Confident	8 Å²	8	61.9 Å²	61.9	8%	0.082	32%	0.318	C	S	.	.	H	α-helix	trans	-62.2	-46	177.3	0	0	0	0	0	112.4	G521 F522 R527 Q528 V529	G521-G525 PolarHBondContact O-N 3.35Å; F522-G525 PolarHBondContact O-N 2.91Å; G525-R527 VanDerWaalsContact C-N 3.32Å; G525-R527 PolarHBondContact O-N 3.43Å; G525-Q528 PolarHBondContact O-N 2.98Å; G525-V529 WeakPolarHBondContact O-CG2 3.29Å; G525-V529 PolarHBondContact O-N 2.9Å
526	I	86.8	Confident	84.5	Confident	15 Å²	15	65.8 Å²	65.8	8%	0.077	34%	0.342	C	S	.	.	H	α-helix	trans	-56.4	-46.9	173.6	-69.6	-72.8	0	0	0	110.9	I441 L446 L449 M501 F522 Q528 I530	I441-I526 HydrophobicContact CD1-CD1 4.13Å; I441-I526 HydrophobicContact CD1-CG2 3.69Å; L446-I526 HydrophobicContact CD2-CD1 3.35Å; L449-I526 HydrophobicContact CD1-CD1 3.6Å; L449-I526 HydrophobicContact CD1-CG1 3.91Å; M501-I526 HydrophobicContact CE-CD1 3.75Å; F522-I526 HydrophobicContact CD1-CG1 3.88Å; F522-I526 HydrophobicContact CE1-CD1 4.03Å; F522-I526 HydrophobicContact CE1-CG1 3.62Å; F522-I526 HydrophobicContact CE2-CG1 4.46Å; F522-I526 HydrophobicContact CG-CG1 4.42Å; F522-I526 HydrophobicContact CZ-CD1 3.93Å; F522-I526 HydrophobicContact CZ-CG1 3.94Å; F522-I526 WeakPolarHBondContact O-CB 3.41Å; F522-I526 WeakPolarHBondContact O-CG1 3.27Å; F522-I526 PolarHBondContact O-N 3.01Å; I526-Q528 PolarHBondContact O-N 3.45Å; I526-I530 HydrophobicContact CG2-CD1 3.73Å; I526-I530 WeakPolarHBondContact O-CB 3.43Å; I526-I530 VanDerWaalsContact O-CG1 3.27Å; I526-I530 WeakPolarHBondContact O-CG1 3.26Å; I526-I530 PolarHBondContact O-N 3.47Å; I526-I530 VanDerWaalsContact O-N 3.1Å
527	R	85.8	Confident	83.8	Confident	158 Å²	158	71.5 Å²	71.5	60%	0.596	37%	0.368	S	S	*	.	H	α-helix	trans	-62.3	-40.7	177.7	-173.4	-175	-60.4	-164.5	1.1	112.2	V523 N524 G525 T531	V523-R527 VanDerWaalsContact O-CB 3.25Å; V523-R527 WeakPolarHBondContact O-CB 3.34Å; V523-R527 PolarHBondContact O-N 3.49Å; V523-R527 VanDerWaalsContact O-N 3.07Å; N524-R527 WeakPolarHBondContact O-CB 3.49Å; N524-R527 PolarHBondContact O-N 2.96Å; G525-R527 VanDerWaalsContact C-N 3.32Å; G525-R527 PolarHBondContact O-N 3.43Å; R527-T531 WeakPolarHBondContact O-CB 3.37Å; R527-T531 PolarHBondContact O-N 3.49Å; R527-T531 VanDerWaalsContact O-N 3.1Å; R527-T531 PolarHBondContact O-OG1 3.17Å
528	Q	84.9	Confident	82.9	Confident	142 Å²	142	72.4 Å²	72.4	66%	0.664	37%	0.369	S	S	*	.	H	α-helix	trans	-65.4	-49.5	179.6	-172.5	178.9	9.1	0	0	111.5	N524 G525 I526 T531 N532	N524-Q528 WeakPolarHBondContact O-CB 3.25Å; N524-Q528 PolarHBondContact O-N 3.32Å; G525-Q528 PolarHBondContact O-N 2.98Å; I526-Q528 PolarHBondContact O-N 3.45Å; Q528-T531 PolarHBondContact O-N 3.25Å; Q528-N532 WeakPolarHBondContact O-CB 3.38Å; Q528-N532 PolarHBondContact O-N 3.4Å
529	V	84.6	Confident	82	Confident	27 Å²	27	75.3 Å²	75.3	16%	0.164	38%	0.381	C	S	.	.	H	α-helix	trans	-70.2	-37.8	-176.6	-172.1	0	0	0	0	111.8	L445 L449 G525 T531 N532 H533	L445-V529 HydrophobicContact CB-CG1 3.66Å; L445-V529 HydrophobicContact CD1-CG1 4.46Å; L445-V529 HydrophobicContact CD2-CG1 4.05Å; L445-V529 HydrophobicContact CG-CG1 4.25Å; L449-V529 HydrophobicContact CD2-CG2 4.41Å; L449-V529 HydrophobicContact CG-CG2 4.47Å; G525-V529 WeakPolarHBondContact O-CG2 3.29Å; G525-V529 PolarHBondContact O-N 2.9Å; V529-T531 VanDerWaalsContact C-N 3.33Å; V529-T531 PolarHBondContact O-N 2.91Å; V529-N532 PolarHBondContact O-N 2.8Å; V529-H533 WeakPolarHBondContact O-CB 3.36Å; V529-H533 PolarHBondContact O-N 3.47Å
530	I	83.7	Confident	81	Confident	55 Å²	55	84.2 Å²	84.2	28%	0.282	41%	0.413	S	S	.	.	H	α-helix	trans	-60.4	-44.2	172.5	-69.4	170.6	0	0	0	110.9	I441 I526 K534	I441-I530 HydrophobicContact CD1-CD1 3.89Å; I441-I530 HydrophobicContact CG1-CD1 4.17Å; I526-I530 HydrophobicContact CG2-CD1 3.73Å; I526-I530 WeakPolarHBondContact O-CB 3.43Å; I526-I530 VanDerWaalsContact O-CG1 3.27Å; I526-I530 WeakPolarHBondContact O-CG1 3.26Å; I526-I530 PolarHBondContact O-N 3.47Å; I526-I530 VanDerWaalsContact O-N 3.1Å; I530-K534 WeakPolarHBondContact O-CB 3.34Å; I530-K534 PolarHBondContact O-N 3.12Å
531	T	84.5	Confident	79.7	Confident	66 Å²	66	84.4 Å²	84.4	41%	0.405	42%	0.42	S	S	.	.	H	α-helix	trans	-63.8	-47.7	178.7	-60.2	0	0	0	0	111.5	R527 Q528 V529 K534 Q535	R527-T531 WeakPolarHBondContact O-CB 3.37Å; R527-T531 PolarHBondContact O-N 3.49Å; R527-T531 VanDerWaalsContact O-N 3.1Å; R527-T531 PolarHBondContact O-OG1 3.17Å; Q528-T531 PolarHBondContact O-N 3.25Å; V529-T531 VanDerWaalsContact C-N 3.33Å; V529-T531 PolarHBondContact O-N 2.91Å; T531-K534 PolarHBondContact O-N 2.78Å; T531-Q535 WeakPolarHBondContact O-CG 3.37Å; T531-Q535 PolarHBondContact O-N 3.04Å
532	N	82.8	Confident	78.4	Confident	92 Å²	92	91.3 Å²	91.3	49%	0.492	45%	0.446	S	S	.	.	H	α-helix	trans	-59.9	-51.4	178.5	-173.7	-13.7	0	0	0	111.2	Q528 V529 K534 Q535 V536	Q528-N532 WeakPolarHBondContact O-CB 3.38Å; Q528-N532 PolarHBondContact O-N 3.4Å; V529-N532 PolarHBondContact O-N 2.8Å; N532-K534 VanDerWaalsContact C-N 3.28Å; N532-K534 PolarHBondContact O-N 3.15Å; N532-Q535 PolarHBondContact O-N 3.3Å; N532-Q535 VanDerWaalsContact O-N 3.08Å; N532-V536 WeakPolarHBondContact O-CG2 3.47Å; N532-V536 PolarHBondContact O-N 2.96Å
533	H	80	Confident	77	Confident	80 Å²	80	97.9 Å²	97.9	37%	0.37	48%	0.48	S	S	.	.	H	α-helix	trans	-57.7	-40	176.9	-177.7	-85.4	0	0	0	112.4	L445 V529 Q537	L445-H533 HydrophobicContact CD1-CB 4.16Å; L445-H533 HydrophobicContact CD2-CB 3.89Å; V529-H533 WeakPolarHBondContact O-CB 3.36Å; V529-H533 PolarHBondContact O-N 3.47Å; H533-Q537 PolarHBondContact CE1-OE1 2.89Å; H533-Q537 VanDerWaalsContact CE1-OE1 3.32Å; H533-Q537 VanDerWaalsContact O-CB 3.22Å; H533-Q537 WeakPolarHBondContact O-CB 3.37Å; H533-Q537 PolarHBondContact O-N 2.94Å
534	K	80.8	Confident	75	Confident	130 Å²	130	99.7 Å²	99.7	57%	0.565	51%	0.505	S	S	*	.	H	α-helix	trans	-62	-44.8	175.6	-169.4	-168.1	172	-167.7	0	111.7	I530 T531 N532 Q537 Q538	I530-K534 WeakPolarHBondContact O-CB 3.34Å; I530-K534 PolarHBondContact O-N 3.12Å; T531-K534 PolarHBondContact O-N 2.78Å; N532-K534 VanDerWaalsContact C-N 3.28Å; N532-K534 PolarHBondContact O-N 3.15Å; K534-Q537 PolarHBondContact O-N 3.2Å; K534-Q538 WeakPolarHBondContact O-CG 3.17Å; K534-Q538 PolarHBondContact O-N 3.15Å
535	Q	78.2	Confident	73	Confident	117 Å²	117	99 Å²	99	55%	0.547	52%	0.52	S	S	.	.	H	α-helix	trans	-63	-47.3	178	-70.8	178.2	6.1	0	0	112	T531 N532 Q537 Q538 H539	T531-Q535 WeakPolarHBondContact O-CG 3.37Å; T531-Q535 PolarHBondContact O-N 3.04Å; N532-Q535 PolarHBondContact O-N 3.3Å; N532-Q535 VanDerWaalsContact O-N 3.08Å; Q535-Q537 VanDerWaalsContact C-N 3.32Å; Q535-Q537 PolarHBondContact O-N 2.98Å; Q535-Q538 PolarHBondContact O-N 2.81Å; Q535-H539 PolarHBondContact O-N 3.27Å
536	V	77.3	Confident	70.9	Confident	86 Å²	86	102.8 Å²	102.8	52%	0.521	55%	0.551	S	S	.	*	H	α-helix	trans	-60.8	-41.3	176.8	174.3	0	0	0	0	111.2	N532 Q538 H539 R540	N532-V536 WeakPolarHBondContact O-CG2 3.47Å; N532-V536 PolarHBondContact O-N 2.96Å; V536-Q538 VanDerWaalsContact C-N 3.34Å; V536-Q538 PolarHBondContact O-N 3.1Å; V536-H539 PolarHBondContact O-N 3.21Å; V536-R540 WeakPolarHBondContact O-CB 3.49Å; V536-R540 PolarHBondContact O-N 3.12Å
537	Q	73.9	Confident	68.7	Low	123 Å²	123	106 Å²	106	58%	0.575	59%	0.588	S	S	*	*	H	α-helix	trans	-67.1	-33.6	177.7	-168.3	171.3	15.2	0	0	112.5	H533 K534 Q535 A541	H533-Q537 PolarHBondContact CE1-OE1 2.89Å; H533-Q537 VanDerWaalsContact CE1-OE1 3.32Å; H533-Q537 VanDerWaalsContact O-CB 3.22Å; H533-Q537 WeakPolarHBondContact O-CB 3.37Å; H533-Q537 PolarHBondContact O-N 2.94Å; K534-Q537 PolarHBondContact O-N 3.2Å; Q535-Q537 VanDerWaalsContact C-N 3.32Å; Q535-Q537 PolarHBondContact O-N 2.98Å; Q537-A541 PolarHBondContact O-N 3.03Å
538	Q	68.5	Low	66.3	Low	111 Å²	111	104.5 Å²	104.5	52%	0.519	60%	0.596	S	S	.	*	H	α-helix	trans	-71.9	-42.9	173.5	-71.7	-179.5	-86.6	0	0	112	K534 Q535 V536 R540 A541 Q542	K534-Q538 WeakPolarHBondContact O-CG 3.17Å; K534-Q538 PolarHBondContact O-N 3.15Å; Q535-Q538 PolarHBondContact O-N 2.81Å; V536-Q538 VanDerWaalsContact C-N 3.34Å; V536-Q538 PolarHBondContact O-N 3.1Å; Q538-R540 PolarHBondContact O-N 3.22Å; Q538-A541 WeakPolarHBondContact O-CB 3.27Å; Q538-A541 PolarHBondContact O-N 3.47Å; Q538-Q542 PolarHBondContact O-N 3.42Å
539	H	66.4	Low	64.3	Low	127 Å²	127	104 Å²	104	59%	0.588	61%	0.605	S	S	*	*	H	α-helix	trans	-59.7	-44.3	174.2	-108.8	79.9	0	0	0	112	Q535 V536 A541 Q542 L543	Q535-H539 PolarHBondContact O-N 3.27Å; V536-H539 PolarHBondContact O-N 3.21Å; H539-A541 PolarHBondContact O-N 3.14Å; H539-Q542 PolarHBondContact O-N 2.82Å; H539-L543 PolarHBondContact O-N 2.98Å
540	R	65.1	Low	62.1	Low	209 Å²	209	111.1 Å²	111.1	79%	0.789	64%	0.639	S	S	*	*	H	α-helix	trans	-67.8	-22.5	178.3	-157.3	172.5	82	173.1	5.6	113.3	V536 Q538	V536-R540 WeakPolarHBondContact O-CB 3.49Å; V536-R540 PolarHBondContact O-N 3.12Å; Q538-R540 PolarHBondContact O-N 3.22Å
541	A	59.8	Low	59.7	Low	80 Å²	80	117 Å²	117	66%	0.661	67%	0.665	S	S	*	*	H	α-helix	trans	-76	-33.6	173.8	0	0	0	0	0	112.7	Q537 Q538 H539	Q537-A541 PolarHBondContact O-N 3.03Å; Q538-A541 WeakPolarHBondContact O-CB 3.27Å; Q538-A541 PolarHBondContact O-N 3.47Å; H539-A541 PolarHBondContact O-N 3.14Å
542	Q	57.8	Low	57.6	Low	166 Å²	166	120.1 Å²	120.1	78%	0.776	69%	0.686	S	S	*	*	H	α-helix	trans	-76.5	-27.7	179.2	-74.3	-178.4	-29.4	0	0	113.7	Q538 H539	Q538-Q542 PolarHBondContact O-N 3.42Å; H539-Q542 PolarHBondContact O-N 2.82Å
543	L	56.6	Low	55.2	Low	138 Å²	138	122.9 Å²	122.9	72%	0.723	70%	0.701	S	S	*	*	S	Bend	trans	-89.5	-4.1	178.5	-75.9	160.5	0	0	0	114.3	H539 G545	H539-L543 PolarHBondContact O-N 2.98Å; L543-G545 PolarHBondContact O-N 3.1Å
544	G	45.8	Very low	52.9	Low	69 Å²	69	128 Å²	128	71%	0.711	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	20.4	-174	0	0	0	0	0	116.7
545	G	44.1	Very low	50.7	Low	79 Å²	79	128.1 Å²	128.1	81%	0.814	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-15	-171.4	0	0	0	0	0	116.5	L543	L543-G545 PolarHBondContact O-N 3.1Å
546	A	40.8	Very low	48.7	Very low	88 Å²	88	128.2 Å²	128.2	73%	0.727	75%	0.748	S	S	*	*	S	Bend	trans	-136.3	120.7	-178	0	0	0	0	0	111.3
547	G	41.4	Very low	46.5	Very low	84 Å²	84	130 Å²	130	87%	0.866	76%	0.758	S	S	*	*			trans	-88.2	115.8	-178.9	0	0	0	0	0	112.6
548	V	35.3	Very low	44.6	Very low	125 Å²	125	131.5 Å²	131.5	76%	0.758	77%	0.771	S	S	*	*			trans	-135.2	125.2	164.8	-175.5	0	0	0	0	108.4	M550	V548-M550 PolarHBondContact O-N 3.1Å
549	P	43.5	Very low	43	Very low	132 Å²	132	134.4 Å²	134.4	86%	0.857	78%	0.784	S	S	*	*			trans	-78.7	119.8	175	30.8	-31.7	0	0	0	110.2
550	M	37.5	Very low	41.7	Very low	177 Å²	177	135.2 Å²	135.2	87%	0.872	79%	0.793	S	S	*	*			trans	-106.7	139.3	176.3	-159.8	170.7	-170.6	0	0	110.9	V548	V548-M550 PolarHBondContact O-N 3.1Å
551	Q	33.7	Very low	40.4	Very low	178 Å²	178	135.1 Å²	135.1	83%	0.832	80%	0.798	S	S	*	*			trans	-72.7	143.3	-175.4	-68.5	177.4	-12.3	0	0	112.5	N553	Q551-N553 PolarHBondContact O-N 3.1Å; Q551-N553 VanDerWaalsContact O-N 3.12Å
552	P	39.5	Very low	39.6	Very low	131 Å²	131	139.9 Å²	139.9	85%	0.851	81%	0.812	S	S	*	*	S	Bend	trans	-87.5	70.3	-176.3	36.3	-36.7	0	0	0	112.8
553	N	33.6	Very low	38.3	Very low	151 Å²	151	139.6 Å²	139.6	81%	0.807	82%	0.816	S	S	*	*			trans	-151.4	34.1	171.8	-146.3	96.8	0	0	0	116.5	Q551	Q551-N553 PolarHBondContact O-N 3.1Å; Q551-N553 VanDerWaalsContact O-N 3.12Å
554	Q	31.6	Very low	37.2	Very low	186 Å²	186	144.5 Å²	144.5	87%	0.869	83%	0.825	S	S	*	*			trans	-137.6	129.7	164.5	-69.5	-169.6	-2.1	0	0	110.9
555	V	34.9	Very low	36.5	Very low	133 Å²	133	145 Å²	145	81%	0.806	82%	0.822	S	S	*	*			trans	-107.1	121.4	176.2	-164.2	0	0	0	0	108	T557	V555-T557 PolarHBondContact O-N 2.91Å
556	P	35.4	Very low	36.3	Very low	120 Å²	120	147.6 Å²	147.6	78%	0.779	82%	0.824	S	S	*	*			trans	-64.9	117.1	178.9	-22.6	34	0	0	0	111.6	N558	P556-N558 PolarHBondContact O-N 3.27Å
557	T	31.1	Very low	35.8	Very low	122 Å²	122	146.5 Å²	146.5	75%	0.748	82%	0.822	S	S	*	*			trans	-73.3	109.6	177.9	-46.8	0	0	0	0	110.4	V555 Q559	V555-T557 PolarHBondContact O-N 2.91Å; T557-Q559 VanDerWaalsContact C-N 3.34Å; T557-Q559 HydrophobicContact CG2-CG 4.35Å; T557-Q559 PolarHBondContact O-N 3.09Å
558	N	35.1	Very low	35.5	Very low	156 Å²	156	148.7 Å²	148.7	83%	0.834	82%	0.821	S	S	*	*			trans	-86.8	68.6	-176.6	-158	0.6	0	0	0	111.9	P556	P556-N558 PolarHBondContact O-N 3.27Å
559	Q	34	Very low	35.4	Very low	172 Å²	172	149.9 Å²	149.9	80%	0.804	82%	0.821	S	S	*	*			trans	-85.1	108	168.2	-82.9	-167.8	44	0	0	110	T557	T557-Q559 VanDerWaalsContact C-N 3.34Å; T557-Q559 HydrophobicContact CG2-CG 4.35Å; T557-Q559 PolarHBondContact O-N 3.09Å
560	N	38.9	Very low	34.9	Very low	143 Å²	143	149.3 Å²	149.3	77%	0.765	82%	0.818	S	S	*	*			trans	-156.3	47.6	168.3	-127.9	-19.4	0	0	0	114.4
561	F	37	Very low	34.8	Very low	207 Å²	207	146.4 Å²	146.4	91%	0.908	81%	0.81	S	S	*	*	S	Bend	trans	-136.5	151.2	162.4	-84.4	-82.3	0	0	0	109.3
562	L	43.7	Very low	34.6	Very low	180 Å²	180	143.6 Å²	143.6	94%	0.942	81%	0.81	S	S	*	*	S	Bend	trans	68.9	63.9	-178.2	-62.8	160.2	0	0	0	116.6
563	N	31.8	Very low	34.2	Very low	160 Å²	160	146 Å²	146	86%	0.856	81%	0.809	S	S	*	*			trans	-150.9	117.4	137.6	-156.6	0.2	0	0	0	112.6
564	R	33	Very low	33.9	Very low	241 Å²	241	142.6 Å²	142.6	91%	0.909	81%	0.81	S	S	*	*			trans	-150.3	106.7	166.3	-172.5	177.3	-175.6	-176.1	2	109.7
565	A	31.5	Very low	33.7	Very low	79 Å²	79	141.3 Å²	141.3	65%	0.653	81%	0.809	S	S	*	*			trans	-71.3	151.4	172.9	0	0	0	0	0	111.6
566	P	37.9	Very low	33.5	Very low	134 Å²	134	140.8 Å²	140.8	87%	0.87	81%	0.806	S	S	*	*			trans	-74.4	140.2	177.7	30.3	-34.3	0	0	0	112.2
567	G	30.9	Very low	33.1	Very low	65 Å²	65	143.9 Å²	143.9	67%	0.67	81%	0.81	S	S	*	*			trans	-115.9	160.8	171.2	0	0	0	0	0	111.4
568	P	36.1	Very low	33.1	Very low	130 Å²	130	146 Å²	146	84%	0.844	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-75.3	157.8	-161.5	29.1	-36.2	0	0	0	115.6
569	I	33.3	Very low	32.9	Very low	150 Å²	150	147 Å²	147	77%	0.769	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-88.6	131.8	-178.3	-50	165.4	0	0	0	110.4	V571	I569-V571 HydrophobicContact CG2-CG2 4.04Å
570	P	31.6	Very low	32.6	Very low	121 Å²	121	144 Å²	144	79%	0.786	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-101	126.5	152.2	32.4	-24.1	0	0	0	110.4
571	V	35.8	Very low	32.2	Very low	116 Å²	116	143.7 Å²	143.7	70%	0.703	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-91.4	135.7	178.6	-177.6	0	0	0	0	110.1	I569	I569-V571 HydrophobicContact CG2-CG2 4.04Å
572	S	29	Very low	31.8	Very low	119 Å²	119	140.8 Å²	140.8	83%	0.832	81%	0.811	S	S	*	*			trans	-157.3	155.7	164.7	-81.4	0	0	0	0	111.3
573	H	31.3	Very low	31.1	Very low	181 Å²	181	139.1 Å²	139.1	84%	0.838	81%	0.808	S	S	*	*			trans	-104.4	152	-160.9	-72.7	-121.3	0	0	0	114.8
574	G	28.3	Very low	30.9	Very low	80 Å²	80	134.8 Å²	134.8	83%	0.825	80%	0.801	S	S	*	*			trans	76.9	155.4	153.5	0	0	0	0	0	116.2
575	N	27.4	Very low	30.7	Very low	159 Å²	159	131.8 Å²	131.8	85%	0.85	80%	0.8	S	S	*	*			cis	-148.6	173	9.6	-170.6	21	0	0	0	110.5
576	V	29.7	Very low	31.8	Very low	122 Å²	122	133 Å²	133	74%	0.739	80%	0.801	S	S	*	*			trans	-105.9	134.5	-179	-172.2	0	0	0	0	111.2
577	Q	28.2	Very low	32.1	Very low	185 Å²	185	132.8 Å²	132.8	86%	0.864	80%	0.799	S	S	*	*			trans	-150.2	170.5	162.3	-117.1	167.1	-5.6	0	0	111.9
578	Q	30.9	Very low	32	Very low	165 Å²	165	135.6 Å²	135.6	77%	0.771	80%	0.803	S	S	*	*			trans	-123	-179.2	-148.8	-56.5	174.1	-51.5	0	0	114.6
579	Q	30.3	Very low	31.7	Very low	178 Å²	178	134.6 Å²	134.6	83%	0.832	80%	0.799	S	S	*	*			trans	74.8	152.8	159.4	-66.2	172.8	-16.4	0	0	117.8
580	S	27.9	Very low	31.4	Very low	108 Å²	108	136.7 Å²	136.7	76%	0.755	81%	0.806	S	S	*	*			cis	-165	166.8	-27.4	51.1	0	0	0	0	110.9
581	V	29.8	Very low	31.3	Very low	137 Å²	137	137.4 Å²	137.4	83%	0.83	81%	0.808	S	S	*	*			trans	-61.4	149.1	-178.9	-75.4	0	0	0	0	116.3
582	V	28.7	Very low	30.9	Very low	146 Å²	146	136.7 Å²	136.7	89%	0.885	81%	0.808	S	S	*	*			trans	-168.4	161.8	132.4	132.6	0	0	0	0	113.1
583	V	30.5	Very low	31	Very low	145 Å²	145	138.8 Å²	138.8	88%	0.879	81%	0.808	S	S	*	*			trans	-78.6	150.8	-169.3	175.3	0	0	0	0	114.9
584	G	27.1	Very low	31	Very low	70 Å²	70	139.2 Å²	139.2	72%	0.722	81%	0.813	S	S	*	*			trans	-176.2	139.7	162.8	0	0	0	0	0	116.3
585	M	28.1	Very low	31.1	Very low	177 Å²	177	143.9 Å²	143.9	87%	0.872	81%	0.813	S	S	*	*			trans	-144.3	170.4	171.8	-69.3	173.8	63.6	0	0	108.7
586	P	54.5	Low	31.2	Very low	106 Å²	106	144.7 Å²	144.7	69%	0.688	81%	0.812	S	S	*	*				-111.1	-152.3	-50.9	37.4	-20.2	0	0	0	108.8
587	P	44.8	Very low	31.2	Very low	128 Å²	128	146.5 Å²	146.5	83%	0.831	81%	0.812	S	S	*	*				-146.7	-153	65	40.9	-18.1	0	0	0	114.6
588	V	29.6	Very low	31.4	Very low	124 Å²	124	146 Å²	146	75%	0.752	81%	0.81	S	S	*	*			trans	-119.4	150.8	-152.5	164.7	0	0	0	0	113.9
589	S	29.6	Very low	31.4	Very low	109 Å²	109	148.4 Å²	148.4	76%	0.762	81%	0.812	S	S	*	*			trans	68.5	129.5	160.8	-75.7	0	0	0	0	120.7
590	Q	27.3	Very low	32.6	Very low	194 Å²	194	145.3 Å²	145.3	91%	0.907	81%	0.807	S	S	*	*				-170	168	99	-100.9	-175.8	4.5	0	0	112.5
591	V	28.6	Very low	32.7	Very low	136 Å²	136	145.2 Å²	145.2	82%	0.824	81%	0.807	S	S	*	*			trans	-140.7	127.2	174.7	174.9	0	0	0	0	108.7
592	S	26.7	Very low	33.2	Very low	101 Å²	101	143.6 Å²	143.6	71%	0.706	80%	0.802	S	S	*	*			trans	167.9	157.7	137.8	-77.9	0	0	0	0	113.4
593	I	32.3	Very low	33.3	Very low	164 Å²	164	145.2 Å²	145.2	84%	0.841	80%	0.801	S	S	*	*			trans	44.4	118.7	154.2	63.3	-176.5	0	0	0	121.5
594	M	31.8	Very low	33.7	Very low	189 Å²	189	146.3 Å²	146.3	93%	0.931	80%	0.799	S	S	*	*				-150.5	158.5	116.1	-148.5	165.8	80.5	0	0	109.9
595	E	30.4	Very low	34	Very low	179 Å²	179	148.4 Å²	148.4	84%	0.836	80%	0.798	S	S	*	*			trans	-132.1	158.8	-172.1	-174	170.3	71.8	0	0	110.5
596	E	29.2	Very low	34.2	Very low	176 Å²	176	148.4 Å²	148.4	82%	0.822	80%	0.798	S	S	*	*			trans	63.7	133.3	166.8	-155.9	176.4	98.3	0	0	119.3
597	Q	29.3	Very low	33.2	Very low	160 Å²	160	154.6 Å²	154.6	75%	0.748	81%	0.808	S	S	*	*				-174.1	149.1	124.3	-165.7	131.9	76.7	0	0	112.1
598	Q	31.1	Very low	32.5	Very low	175 Å²	175	153.1 Å²	153.1	82%	0.818	81%	0.806	S	S	*	*			trans	79.6	86.4	162	-80.6	159.1	28.2	0	0	121.2
599	R	32.4	Very low	32.5	Very low	214 Å²	214	152.3 Å²	152.3	81%	0.808	81%	0.813	S	S	*	*				-82.1	177.4	127.7	-126.1	-165.5	176.3	122.9	-3.7	108.9
600	P	55.2	Low	32.5	Very low	113 Å²	113	150.8 Å²	150.8	73%	0.734	81%	0.814	S	S	*	*			cis	-129.7	-163	35.9	32.4	-6.8	0	0	0	112.2
601	S	30.5	Very low	33.5	Very low	107 Å²	107	147 Å²	147	75%	0.748	81%	0.806	S	S	*	*			cis	-151.6	-179.7	21.3	-62.7	0	0	0	0	112.7
602	S	38.8	Very low	33.5	Very low	103 Å²	103	147.1 Å²	147.1	72%	0.72	81%	0.807	S	S	*	*			trans	-141.1	149.7	-174.3	-48.1	0	0	0	0	113.8
603	M	31.4	Very low	33.5	Very low	179 Å²	179	148.4 Å²	148.4	88%	0.882	81%	0.806	S	S	*	*			trans	-159.1	137.7	147.3	-81.1	-156.8	-165.5	0	0	108.5
604	M	38.1	Very low	33.3	Very low	169 Å²	169	149.3 Å²	149.3	83%	0.833	81%	0.807	S	S	*	*				68.8	136.9	73.1	-110.9	-179.8	-176.9	0	0	113.4
605	T	33.6	Very low	33.4	Very low	113 Å²	113	149.4 Å²	149.4	69%	0.693	81%	0.805	S	S	*	*			cis	-151.8	163.5	9.8	-33.5	0	0	0	0	108.6
606	M	33.1	Very low	34.1	Very low	178 Å²	178	146 Å²	146	88%	0.877	80%	0.799	S	S	*	*				171.9	-175.2	87.8	-124	-51	-148.1	0	0	112.4
607	R	32.8	Very low	34.6	Very low	236 Å²	236	143.5 Å²	143.5	89%	0.891	80%	0.798	S	S	*	*			trans	-145.2	126.5	-157.1	168.5	-170.1	177	-173.2	0.8	115.2
608	A	30.1	Very low	34.7	Very low	96 Å²	96	142 Å²	142	79%	0.793	80%	0.799	S	S	*	*			trans	-163.6	143.8	157.4	0	0	0	0	0	108.4
609	A	30.3	Very low	34.7	Very low	108 Å²	108	139.7 Å²	139.7	89%	0.893	80%	0.802	S	S	*	*			cis	96.7	102.6	23.8	0	0	0	0	0	114.6
610	G	29.9	Very low	34.5	Very low	76 Å²	76	133.5 Å²	133.5	78%	0.784	81%	0.805	S	S	*	*			trans	163.4	128.5	177.2	0	0	0	0	0	113
611	P	48.3	Very low	33.3	Very low	116 Å²	116	132.8 Å²	132.8	75%	0.753	81%	0.808	S	S	*	*			trans	-120	-167.3	-170.7	41.8	-31.1	0	0	0	116
612	T	27.4	Very low	33.7	Very low	138 Å²	138	133.3 Å²	133.3	85%	0.847	81%	0.81	S	S	*	*			trans	81.4	150.9	172.7	67.9	0	0	0	0	117.9
613	N	26.6	Very low	34.1	Very low	128 Å²	128	134 Å²	134	68%	0.684	81%	0.812	S	S	*	*			cis	-172.4	129.2	-26.8	172.2	33.4	0	0	0	109.9
614	Q	29.7	Very low	34.1	Very low	183 Å²	183	132.1 Å²	132.1	86%	0.855	81%	0.805	S	S	*	*			trans	166.7	161.1	135.9	-92.4	156.6	109.4	0	0	113.9
615	Q	33.1	Very low	33.8	Very low	190 Å²	190	133.1 Å²	133.1	89%	0.888	81%	0.808	S	S	*	*			trans	-116.5	168.1	-179.4	-102.2	-177.8	-35.3	0	0	111.9
616	P	46.1	Very low	33.6	Very low	108 Å²	108	133.8 Å²	133.8	70%	0.701	81%	0.812	S	S	*	*			trans	-93.2	164.8	-172.6	37.8	-36.8	0	0	0	114.3
617	P	38.6	Very low	33.4	Very low	124 Å²	124	129.8 Å²	129.8	81%	0.805	81%	0.806	S	S	*	*			trans	-93.4	164	161.5	36.8	-32.1	0	0	0	112.7
618	V	32.3	Very low	33.2	Very low	129 Å²	129	128.2 Å²	128.2	78%	0.782	81%	0.809	S	S	*	*			trans	-139.6	164.7	178.9	-73	0	0	0	0	111.6
619	S	30.5	Very low	33.1	Very low	126 Å²	126	127.7 Å²	127.7	88%	0.881	81%	0.814	S	S	*	*			trans	77.9	134.2	163	-54.7	0	0	0	0	118.8
620	G	27.1	Very low	33	Very low	84 Å²	84	126.5 Å²	126.5	87%	0.866	81%	0.811	S	S	*	*			trans	167.9	99.1	170.9	0	0	0	0	0	115.3
621	A	30.9	Very low	33	Very low	97 Å²	97	132.3 Å²	132.3	80%	0.802	82%	0.818	S	S	*	*			trans	-114.5	165.2	156.5	0	0	0	0	0	106.9
622	P	38.6	Very low	32.2	Very low	119 Å²	119	132.5 Å²	132.5	77%	0.773	82%	0.82	S	S	*	*			cis	-148	-134.6	41.9	44	-20.1	0	0	0	111.1
623	P	47.8	Very low	32.2	Very low	118 Å²	118	134.6 Å²	134.6	77%	0.766	82%	0.82	S	S	*	*			cis	-125	-171.6	-32.9	37.4	-19.8	0	0	0	114
624	N	31.6	Very low	32.6	Very low	139 Å²	139	134.7 Å²	134.7	74%	0.743	83%	0.827	S	S	*	*			trans	-91	151.3	-179.4	-173.1	25	0	0	0	113.7
625	Q	30.5	Very low	32.5	Very low	189 Å²	189	135.7 Å²	135.7	88%	0.883	83%	0.832	S	S	*	*			trans	-147.6	161.4	166.8	-76.6	-159.5	3.1	0	0	112.3
626	V	29.3	Very low	32.4	Very low	128 Å²	128	129.6 Å²	129.6	78%	0.776	82%	0.82	S	S	*	*			trans	-132.1	129.3	-160.7	-170.6	0	0	0	0	113.9
627	A	30.6	Very low	31.6	Very low	93 Å²	93	129.8 Å²	129.8	77%	0.769	82%	0.824	S	S	*	*			trans	15.7	136.6	160	0	0	0	0	0	123.3
628	Q	28.7	Very low	31.4	Very low	203 Å²	203	132 Å²	132	95%	0.949	83%	0.827	S	S	*	*			trans	-154.3	132.2	137.4	-119.6	-179.2	22	0	0	115.2
629	G	28	Very low	31.7	Very low	86 Å²	86	133.2 Å²	133.2	89%	0.887	83%	0.828	S	S	*	*			trans	37	120.4	149.8	0	0	0	0	0	124.3
630	G	27.4	Very low	32.2	Very low	82 Å²	82	135.1 Å²	135.1	85%	0.845	82%	0.816	S	S	*	*			trans	-167.1	137.4	157.2	0	0	0	0	0	111.9
631	Q	29.3	Very low	32.5	Very low	199 Å²	199	137.9 Å²	137.9	93%	0.93	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-88.7	158.3	-173.1	-89.9	-176.8	-65.3	0	0	114.4
632	P	32.2	Very low	32.7	Very low	120 Å²	120	138.5 Å²	138.5	78%	0.779	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-85.3	148.4	-167.7	33.6	-36.5	0	0	0	114.9
633	Q	28	Very low	32.9	Very low	182 Å²	182	136.2 Å²	136.2	85%	0.85	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-99.3	155.3	162	-82.2	-175.2	-54.6	0	0	111
634	P	34.1	Very low	32.7	Very low	129 Å²	129	136.8 Å²	136.8	84%	0.838	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-70.7	139.9	-171.7	27.9	-35.4	0	0	0	113.2	G636	P634-G636 PolarHBondContact O-N 2.84Å
635	Q	28.9	Very low	33.5	Very low	205 Å²	205	132.4 Å²	132.4	96%	0.958	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-72.3	122.2	177.8	-69.4	177.7	-46.2	0	0	111.7
636	G	29.8	Very low	34.8	Very low	61 Å²	61	124.3 Å²	124.3	63%	0.629	74%	0.744	S	S	*	*			trans	-117.7	136	167	0	0	0	0	0	110.9	P634	P634-G636 PolarHBondContact O-N 2.84Å
637	S	30.6	Very low	36.3	Very low	113 Å²	113	119.9 Å²	119.9	79%	0.79	72%	0.716	S	S	*	*			trans	52.1	105.1	176.7	52.9	0	0	0	0	117.1	L639	S637-L639 PolarHBondContact O-N 2.97Å; S637-L639 VanDerWaalsContact O-N 3.14Å
638	I	33.3	Very low	38	Very low	171 Å²	171	120 Å²	120	88%	0.877	71%	0.71	S	S	*	*			trans	-67.7	108.2	160.9	-63.5	173.8	0	0	0	108.4	R640	I638-R640 PolarHBondContact O-N 3.16Å
639	L	37.9	Very low	39.9	Very low	153 Å²	153	116.1 Å²	116.1	80%	0.801	69%	0.691	S	S	*	*			trans	-71.8	105.1	167.1	-84.3	162.3	0	0	0	109.1	S637 L641	S637-L639 PolarHBondContact O-N 2.97Å; S637-L639 VanDerWaalsContact O-N 3.14Å; L639-L641 PolarHBondContact O-N 2.82Å; L639-L641 VanDerWaalsContact O-N 3.13Å
640	R	40.9	Very low	41.9	Very low	166 Å²	166	112 Å²	112	63%	0.626	65%	0.649	S	S	*	*			trans	-54.1	113.6	176.9	-169.2	174.6	-175.9	178.2	0.3	108.9	E106 I638	E106-R640 IonicContact OE1-CZ 2.8Å; E106-R640 IonicContact OE1-NH1 2.7Å; E106-R640 PolarHBondContact OE1-NH1 2.85Å; E106-R640 IonicContact OE1-NH2 3.88Å; I638-R640 PolarHBondContact O-N 3.16Å
641	L	34.1	Very low	44	Very low	143 Å²	143	112.1 Å²	112.1	75%	0.749	62%	0.624	S	S	*	*			trans	-53	150.2	-175.7	-89.5	73.8	0	0	0	112.1	L639 N643	L639-L641 PolarHBondContact O-N 2.82Å; L639-L641 VanDerWaalsContact O-N 3.13Å; L641-N643 PolarHBondContact O-N 3.28Å
642	P	35.2	Very low	46.1	Very low	110 Å²	110	106.3 Å²	106.3	71%	0.714	61%	0.605	S	S	*	*			trans	-69.8	90.8	-179.6	29	-34.8	0	0	0	111.4	P644	P642-P644 WeakPolarHBondContact O-CD 3.35Å
643	N	42	Very low	48.2	Very low	71 Å²	71	103.7 Å²	103.7	38%	0.38	58%	0.584	S	S	.	*			trans	-59.7	119.7	168.5	-174.6	-19.2	0	0	0	109.8	L641 G645 R651	L641-N643 PolarHBondContact O-N 3.28Å; N643-G645 PolarHBondContact OD1-N 3.16Å; N643-G645 VanDerWaalsContact OD1-N 3.16Å; N643-R651 PolarHBondContact O-NH1 2.82Å
644	P	43.7	Very low	50.4	Low	129 Å²	129	96.2 Å²	96.2	84%	0.838	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-7.1	-172.8	34.1	-36.6	0	0	0	114.6	P642	P642-P644 WeakPolarHBondContact O-CD 3.35Å
645	G	49.5	Very low	52	Low	48 Å²	48	95.3 Å²	95.3	50%	0.495	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-6.4	-176.1	0	0	0	0	0	115.9	N643	N643-G645 PolarHBondContact OD1-N 3.16Å; N643-G645 VanDerWaalsContact OD1-N 3.16Å
646	A	56.4	Low	53.8	Low	18 Å²	18	89.2 Å²	89.2	15%	0.149	52%	0.517	C	S	.	.	S	Bend	trans	-88.8	142	-177	0	0	0	0	0	112.1	Y78 P648	Y78-A646 VanDerWaalsContact OH-CA 3.31Å; Y78-A646 WeakPolarHBondContact OH-CA 3.05Å; Y78-A646 VanDerWaalsContact OH-CB 3.3Å; Y78-A646 WeakPolarHBondContact OH-CB 3.3Å; A646-P648 WeakPolarHBondContact O-CD 3.26Å
647	N	62.8	Low	55.2	Low	35 Å²	35	92 Å²	92	19%	0.187	51%	0.514	C	S	.	.			trans	-59.9	121.9	176.7	-175.9	-28.1	0	0	0	109.9	Y78 Q649 R651	Y78-N647 HydrophobicContact CE2-CB 3.63Å; Y78-N647 PolarHBondContact OH-N 2.97Å; N647-Q649 PolarHBondContact O-N 2.85Å; N647-Q649 WeakPolarHBondContact OD1-CB 3.09Å; N647-Q649 PolarHBondContact OD1-N 3.18Å; N647-R651 WeakPolarHBondContact O-CB 3.23Å; N647-R651 PolarHBondContact O-N 2.94Å; N647-R651 VanDerWaalsContact O-N 3.16Å
648	P	64.8	Low	56.1	Low	97 Å²	97	93.2 Å²	93.2	63%	0.63	51%	0.507	S	S	*	.	H	α-helix	trans	-63.6	-24.3	-177	25.8	-34.9	0	0	0	113.2	A646 S652	A646-P648 WeakPolarHBondContact O-CD 3.26Å; P648-S652 WeakPolarHBondContact O-CB 3.3Å; P648-S652 PolarHBondContact O-N 2.87Å
649	Q	68.4	Low	56.1	Low	120 Å²	120	92.4 Å²	92.4	56%	0.561	50%	0.5	S	S	*	.	H	α-helix	trans	-71	-55.7	179.5	-60.4	178.3	-80.7	0	0	111.5	N647 R651 S652 L653	N647-Q649 PolarHBondContact O-N 2.85Å; N647-Q649 WeakPolarHBondContact OD1-CB 3.09Å; N647-Q649 PolarHBondContact OD1-N 3.18Å; Q649-R651 VanDerWaalsContact C-N 3.26Å; Q649-R651 PolarHBondContact O-N 3.43Å; Q649-S652 PolarHBondContact O-N 2.61Å; Q649-S652 VanDerWaalsContact O-N 3.11Å; Q649-L653 WeakPolarHBondContact O-CG 3.31Å; Q649-L653 PolarHBondContact O-N 2.82Å
650	L	71.6	Confident	56.1	Low	0 Å²	0	90.6 Å²	90.6	0%	0	50%	0.497	C	S	.	.	H	α-helix	trans	-57.8	-41	175.1	-80.7	165.9	0	0	0	111.6	V71 Y78 L110 L150 V153 L653 L654	V71-L650 HydrophobicContact CG1-CB 4.44Å; Y78-L650 HydrophobicContact CD2-CD1 3.62Å; Y78-L650 HydrophobicContact CE2-CD1 3.57Å; Y78-L650 HydrophobicContact CG-CD1 4.46Å; L110-L650 HydrophobicContact CD2-CD2 4.28Å; L150-L650 HydrophobicContact CB-CD2 4.34Å; L150-L650 HydrophobicContact CD1-CD2 3.88Å; V153-L650 HydrophobicContact CG1-CD2 4.41Å; V153-L650 HydrophobicContact CG1-CG 4.42Å; V153-L650 HydrophobicContact CG2-CD1 3.78Å; V153-L650 HydrophobicContact CG2-CD2 4.37Å; V153-L650 HydrophobicContact CG2-CG 3.69Å; L650-L653 PolarHBondContact O-N 3.44Å; L650-L654 PolarHBondContact O-N 2.94Å
651	R	71.8	Confident	55.7	Low	85 Å²	85	89.7 Å²	89.7	32%	0.321	51%	0.51	S	S	.	.	H	α-helix	trans	-62.4	-43	175.6	-170.2	171.5	-175.3	165.5	3.9	112.1	N643 N647 Q649 L654 L655	N643-R651 PolarHBondContact O-NH1 2.82Å; N647-R651 WeakPolarHBondContact O-CB 3.23Å; N647-R651 PolarHBondContact O-N 2.94Å; N647-R651 VanDerWaalsContact O-N 3.16Å; Q649-R651 VanDerWaalsContact C-N 3.26Å; Q649-R651 PolarHBondContact O-N 3.43Å; R651-L654 PolarHBondContact O-N 3.37Å; R651-L655 HydrophobicContact CG-CD1 4.1Å; R651-L655 WeakPolarHBondContact O-CD1 3.32Å; R651-L655 PolarHBondContact O-N 3.5Å
652	S	72.6	Confident	55.5	Low	77 Å²	77	94.3 Å²	94.3	54%	0.538	52%	0.517	S	S	.	.	H	α-helix	trans	-66	-40.5	176.6	-176.8	0	0	0	0	112.2	P648 Q649 L655 S656	P648-S652 WeakPolarHBondContact O-CB 3.3Å; P648-S652 PolarHBondContact O-N 2.87Å; Q649-S652 PolarHBondContact O-N 2.61Å; Q649-S652 VanDerWaalsContact O-N 3.11Å; S652-L655 PolarHBondContact O-N 3.27Å; S652-S656 PolarHBondContact O-N 2.91Å
653	L	75.4	Confident	55.5	Low	65 Å²	65	92.8 Å²	92.8	34%	0.34	51%	0.514	S	S	.	.	H	α-helix	trans	-63.5	-41.3	175.7	-67.9	168.3	0	0	0	111.8	L150 P151 Q649 L650 S656 Q657	L150-L653 HydrophobicContact CD2-CB 3.64Å; P151-L653 HydrophobicContact CG-CD1 4.33Å; Q649-L653 WeakPolarHBondContact O-CG 3.31Å; Q649-L653 PolarHBondContact O-N 2.82Å; L650-L653 PolarHBondContact O-N 3.44Å; L653-S656 WeakPolarHBondContact O-CB 3.44Å; L653-S656 PolarHBondContact O-N 3.02Å; L653-Q657 WeakPolarHBondContact O-CG 3.27Å; L653-Q657 PolarHBondContact O-N 3.45Å
654	L	74	Confident	55	Low	24 Å²	24	96.2 Å²	96.2	13%	0.126	54%	0.538	C	S	.	.	H	α-helix	trans	-64.3	-42	173.1	-81.4	175.7	0	0	0	113.3	V71 Y148 L150 L650 R651 S656 Q657 Q658	V71-L654 HydrophobicContact CB-CD1 3.87Å; V71-L654 HydrophobicContact CG1-CD1 3.55Å; V71-L654 HydrophobicContact CG2-CD1 3.34Å; Y148-L654 HydrophobicContact CD1-CD2 3.93Å; Y148-L654 HydrophobicContact CE1-CD1 4.46Å; Y148-L654 HydrophobicContact CE1-CD2 3.91Å; L150-L654 HydrophobicContact CD1-CD1 4.45Å; L150-L654 HydrophobicContact CD1-CD2 3.89Å; L150-L654 HydrophobicContact CD1-CG 3.86Å; L650-L654 PolarHBondContact O-N 2.94Å; R651-L654 PolarHBondContact O-N 3.37Å; L654-S656 VanDerWaalsContact C-N 3.27Å; L654-S656 PolarHBondContact O-N 2.8Å; L654-Q657 PolarHBondContact O-N 3.44Å; L654-Q658 WeakPolarHBondContact O-CG 3.28Å; L654-Q658 PolarHBondContact O-N 3.2Å; L654-Q658 VanDerWaalsContact O-N 3.12Å
655	L	69.1	Low	54.4	Low	110 Å²	110	98.9 Å²	98.9	58%	0.576	54%	0.539	S	S	*	.	H	α-helix	trans	-63.6	-33.8	174.1	-90.4	143.1	0	0	0	111.8	R651 S652 Q658	R651-L655 HydrophobicContact CG-CD1 4.1Å; R651-L655 WeakPolarHBondContact O-CD1 3.32Å; R651-L655 PolarHBondContact O-N 3.5Å; S652-L655 PolarHBondContact O-N 3.27Å; L655-Q658 PolarHBondContact O-N 3.02Å
656	S	65.7	Low	53.5	Low	77 Å²	77	102.3 Å²	102.3	54%	0.538	56%	0.556	S	S	.	*	H	α-helix	trans	-65.4	-40	171.8	-164.7	0	0	0	0	112.2	S652 L653 L654 Q658	S652-S656 PolarHBondContact O-N 2.91Å; L653-S656 WeakPolarHBondContact O-CB 3.44Å; L653-S656 PolarHBondContact O-N 3.02Å; L654-S656 VanDerWaalsContact C-N 3.27Å; L654-S656 PolarHBondContact O-N 2.8Å; S656-Q658 VanDerWaalsContact C-N 3.25Å; S656-Q658 PolarHBondContact O-N 3.03Å
657	Q	59.3	Low	52.2	Low	121 Å²	121	107.3 Å²	107.3	57%	0.565	59%	0.588	S	S	*	*	H	α-helix	trans	-72.7	-11.2	176.2	-71.8	-73.4	90.2	0	0	113.9	L653 L654	L653-Q657 WeakPolarHBondContact O-CG 3.27Å; L653-Q657 PolarHBondContact O-N 3.45Å; L654-Q657 PolarHBondContact O-N 3.44Å
658	Q	50.7	Low	50.7	Low	138 Å²	138	115 Å²	115	65%	0.645	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	15.9	-179.3	-76.8	179.8	28.4	0	0	114.5	L654 L655 S656	L654-Q658 WeakPolarHBondContact O-CG 3.28Å; L654-Q658 PolarHBondContact O-N 3.2Å; L654-Q658 VanDerWaalsContact O-N 3.12Å; L655-Q658 PolarHBondContact O-N 3.02Å; S656-Q658 VanDerWaalsContact C-N 3.25Å; S656-Q658 PolarHBondContact O-N 3.03Å
659	Q	31.6	Very low	49.1	Very low	153 Å²	153	120.5 Å²	120.5	72%	0.715	64%	0.635	S	S	*	*	S	Bend	trans	-64.3	146.2	165.7	-66.5	-165.9	1.7	0	0	110.7	V661	Q659-V661 PolarHBondContact O-N 2.71Å; Q659-V661 VanDerWaalsContact O-N 3.08Å
660	P	39.3	Very low	47.3	Very low	115 Å²	115	123.5 Å²	123.5	75%	0.747	65%	0.651	S	S	*	*			trans	-84	99	-139.7	30	-37.4	0	0	0	115.5	R662	P660-R662 PolarHBondContact O-N 3.13Å
661	V	31.7	Very low	45.5	Very low	148 Å²	148	131 Å²	131	90%	0.897	69%	0.69	S	S	*	*			trans	-94.7	66.2	153.6	-169.3	0	0	0	0	109.4	Q659 A663	Q659-V661 PolarHBondContact O-N 2.71Å; Q659-V661 VanDerWaalsContact O-N 3.08Å; V661-A663 PolarHBondContact O-N 3.14Å
662	R	30.4	Very low	43.7	Very low	239 Å²	239	134.5 Å²	134.5	90%	0.902	72%	0.715	S	S	*	*			trans	-91.1	91.3	174	-83.7	-166	-175.4	167.1	3	111.6	P660	P660-R662 PolarHBondContact O-N 3.13Å
663	A	35	Very low	41.7	Very low	78 Å²	78	140.8 Å²	140.8	65%	0.645	73%	0.733	S	S	*	*	S	Bend	trans	-164.4	154.5	145.2	0	0	0	0	0	112.2	V661	V661-A663 PolarHBondContact O-N 3.14Å
664	T	31.6	Very low	39.6	Very low	143 Å²	143	146.3 Å²	146.3	88%	0.877	76%	0.757	S	S	*	*	S	Bend	trans	72	23.8	156.4	64.9	0	0	0	0	123
665	E	31.1	Very low	37.5	Very low	185 Å²	185	153 Å²	153	86%	0.864	79%	0.791	S	S	*	*	S	Bend	trans	-123.3	-8.2	157.2	-71.9	-158.9	140.2	0	0	115.4	C667	E665-C667 PolarHBondContact O-N 3.43Å
666	S	30.3	Very low	36.1	Very low	121 Å²	121	153 Å²	153	85%	0.846	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	9.7	-171.6	-159.6	0	0	0	0	116.3
667	C	29.3	Very low	34.6	Very low	123 Å²	123	154.4 Å²	154.4	83%	0.831	81%	0.814	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	-8.4	-172.2	-71.5	0	0	0	0	115.7	E665	E665-C667 PolarHBondContact O-N 3.43Å
668	F	31.7	Very low	33	Very low	196 Å²	196	154.7 Å²	154.7	86%	0.86	83%	0.829	S	S	*	*	S	Bend	trans	-93.5	-6	-173.7	-118.5	-84.6	0	0	0	115.6
669	F	31.8	Very low	32.1	Very low	213 Å²	213	159 Å²	159	93%	0.934	84%	0.839	S	S	*	*	S	Bend	trans	-110.1	8.2	-171.3	-107.9	-80.2	0	0	0	116.1
670	M	29.8	Very low	32.3	Very low	182 Å²	182	163.4 Å²	163.4	90%	0.897	87%	0.865	S	S	*	*	S	Bend	trans	-112.5	17.9	-177.9	-145.4	174.1	-171.3	0	0	114.8
671	L	33.6	Very low	31.9	Very low	157 Å²	157	165.8 Å²	165.8	82%	0.822	87%	0.87	S	S	*	*	S	Bend	trans	-140	80.1	174.5	-77.4	173.5	0	0	0	111.4
672	N	33.6	Very low	31.9	Very low	160 Å²	160	166.7 Å²	166.7	86%	0.856	87%	0.869	S	S	*	*			trans	176.2	66.5	146.7	-96.1	-44	0	0	0	112.5
673	F	31.8	Very low	32	Very low	208 Å²	208	162.7 Å²	162.7	91%	0.912	87%	0.867	S	S	*	*			trans	-148.2	61.7	167.4	-110.9	-71.7	0	0	0	111.8
674	Q	30.7	Very low	31.9	Very low	181 Å²	181	167.7 Å²	167.7	85%	0.846	88%	0.88	S	S	*	*			trans	-155	68.6	176	-164.8	73.1	28.3	0	0	112.8
675	I	30.5	Very low	31.9	Very low	164 Å²	164	169.3 Å²	169.3	84%	0.841	88%	0.88	S	S	*	*			trans	-129.1	130.4	158.4	-66.5	-173.8	0	0	0	107.7
676	P	38.4	Very low	31.9	Very low	110 Å²	110	168.2 Å²	168.2	71%	0.714	88%	0.882	S	S	*	*			trans	-89	165.4	-168.7	36.1	-37	0	0	0	113.3
677	A	34.3	Very low	32	Very low	107 Å²	107	171.6 Å²	171.6	88%	0.884	88%	0.884	S	S	*	*			trans	-67.5	135.6	165.4	0	0	0	0	0	111
678	C	26.9	Very low	32.2	Very low	128 Å²	128	175.3 Å²	175.3	87%	0.865	89%	0.888	S	S	*	*			trans	-141.2	142.9	161.8	-161	0	0	0	0	109.5
679	R	31.8	Very low	32.3	Very low	229 Å²	229	173.6 Å²	173.6	86%	0.864	89%	0.891	S	S	*	*			trans	-85.6	143	170.9	-63.8	174.9	176.9	171	-3.4	109.4
680	I	34.5	Very low	32.3	Very low	244 Å²	244	170 Å²	170	100%	1.251	89%	0.887	S	S	*	*				-128.5	0	120.3	-62.1	-171.8	0	0	0	105.8

Retrieved 680 of 680 residues in 102.1 ms (Link to these results)

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