A0A3Q0KG27_SCHMA Loading...

Stork_head domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KG27, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 675 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	33	Very low	51.8	Low	235 Å²	235	98.8 Å²	98.8	100%	1.158	56%	0.56	S	S	*	*				0	116.6	0	-72.3	172	167.6	0	0	107.6
2	S	26.9	Very low	55.2	Low	117 Å²	117	91.1 Å²	91.1	82%	0.818	52%	0.518	S	S	*	.			trans	-87.6	107.2	171.7	46.1	0	0	0	0	108.6	S4	S2-S4 PolarHBondContact O-N 3.39Å; S2-S4 VanDerWaalsContact O-N 3.08Å
3	L	31.4	Very low	58.3	Low	172 Å²	172	84.1 Å²	84.1	90%	0.901	48%	0.478	S	S	*	.			trans	-71.4	102.9	166.9	-80.5	100.5	0	0	0	108.1	S5	L3-S5 PolarHBondContact O-N 3.24Å
4	S	29.8	Very low	60.8	Low	100 Å²	100	80.4 Å²	80.4	70%	0.699	46%	0.458	S	S	*	.			trans	-72.7	115.3	175.6	49.5	0	0	0	0	110.4	S2	S2-S4 PolarHBondContact O-N 3.39Å; S2-S4 VanDerWaalsContact O-N 3.08Å
5	S	34.6	Very low	63	Low	100 Å²	100	75.7 Å²	75.7	70%	0.699	43%	0.43	S	S	*	.			trans	46.5	75.6	142.1	63.1	0	0	0	0	117.6	L3	L3-S5 PolarHBondContact O-N 3.24Å
6	D	47.6	Very low	64.6	Low	138 Å²	138	74.5 Å²	74.5	74%	0.738	43%	0.427	S	S	*	.				-118.3	105.6	127.5	-108.2	-40.6	0	0	0	107.1	T8	D6-T8 PolarHBondContact O-N 3.34Å
7	L	54.6	Low	65.8	Low	121 Å²	121	73.5 Å²	73.5	63%	0.634	42%	0.415	S	S	*	.			trans	-71.9	121.9	177.8	-122.5	75.1	0	0	0	107.9	K9	L7-K9 WeakPolarHBondContact O-CG 3.44Å; L7-K9 PolarHBondContact O-N 3.34Å
8	T	56.6	Low	66.3	Low	35 Å²	35	76.8 Å²	76.8	22%	0.215	43%	0.426	C	S	.	.			trans	-66.8	109.3	-178.7	53.4	0	0	0	0	109.3	D6 D100	D6-T8 PolarHBondContact O-N 3.34Å; T8-D100 HydrophobicContact CG2-CB 3.67Å; T8-D100 VanDerWaalsContact CG2-CG 3.48Å; T8-D100 WeakPolarHBondContact CG2-OD1 3.41Å
9	K	76	Confident	66.2	Low	69 Å²	69	79.2 Å²	79.2	30%	0.3	44%	0.438	S	S	.	.			trans	-90.6	-24.7	-170.9	-45.8	-174.6	-170.4	167.5	0	113.1	L7 L75 S149	L7-K9 WeakPolarHBondContact O-CG 3.44Å; L7-K9 PolarHBondContact O-N 3.34Å; K9-L75 WeakPolarHBondContact O-CD1 3.38Å; K9-S149 VanDerWaalsContact CB-O 3.27Å; K9-S149 WeakPolarHBondContact CB-O 3.47Å; K9-S149 WeakPolarHBondContact CD-O 3.33Å
10	C	87.5	Confident	65.5	Low	0 Å²	0	83.9 Å²	83.9	0%	0	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	145.5	-178.3	175	0	0	0	0	109.6	I58 I68 V101 L106	C10-I58 HydrophobicContact CB-CD1 3.78Å; C10-I58 VanDerWaalsContact SG-CD1 3.51Å; C10-I68 WeakPolarHBondContact CA-O 3.25Å; C10-V101 HydrophobicContact CB-CB 3.96Å; C10-V101 HydrophobicContact CB-CG2 4.33Å; C10-V101 PolarHBondContact O-N 2.96Å; C10-L106 HydrophobicContact CB-CD1 4.32Å
11	L	92.1	Very high	64.8	Low	0 Å²	0	85.4 Å²	85.4	0%	0	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122.4	-179.5	-169.1	73.3	0	0	0	108.9	I68 L75 I78 K79 V98	L11-I68 PolarHBondContact N-O 3.16Å; L11-I68 PolarHBondContact O-N 3.38Å; L11-L75 HydrophobicContact CB-CD2 3.99Å; L11-I78 HydrophobicContact CD2-CB 4.02Å; L11-I78 HydrophobicContact CD2-CG2 3.73Å; L11-K79 HydrophobicContact CD1-CB 4.33Å; L11-V98 HydrophobicContact CD1-CG1 3.85Å; L11-V98 HydrophobicContact CD2-CG1 3.66Å; L11-V98 HydrophobicContact CG-CG1 3.82Å
12	A	92.9	Very high	65.4	Low	6 Å²	6	77.2 Å²	77.2	5%	0.05	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.5	172.4	0	0	0	0	0	109.2	L65 L66 L67 V98 S99 V101	A12-L65 HydrophobicContact CB-CD2 4.04Å; A12-L65 HydrophobicContact CB-CG 4.48Å; A12-L66 WeakPolarHBondContact CA-O 3.22Å; A12-L67 HydrophobicContact CB-CD2 4.11Å; A12-V98 WeakPolarHBondContact O-CA 3.33Å; A12-S99 PolarHBondContact N-O 3.33Å; A12-S99 PolarHBondContact O-N 3.14Å; A12-V101 HydrophobicContact CB-CG2 3.63Å
13	I	95	Very high	66.4	Low	0 Å²	0	82.8 Å²	82.8	0%	0	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	115.9	168.8	-53.1	-168.5	0	0	0	107.9	F15 F35 L66 I68 I78 L87 I95 S97 V98	I13-F15 HydrophobicContact CB-CE2 3.92Å; I13-F15 HydrophobicContact CB-CZ 4.22Å; I13-F15 HydrophobicContact CG2-CD2 4.15Å; I13-F15 HydrophobicContact CG2-CE1 4.07Å; I13-F15 HydrophobicContact CG2-CE2 3.45Å; I13-F15 VanDerWaalsContact CG2-CE2 3.45Å; I13-F15 HydrophobicContact CG2-CZ 3.42Å; I13-F15 VanDerWaalsContact CG2-CZ 3.42Å; I13-F35 HydrophobicContact CD1-CE1 3.92Å; I13-F35 HydrophobicContact CD1-CE2 4.13Å; I13-F35 HydrophobicContact CD1-CZ 3.45Å; I13-F35 VanDerWaalsContact CD1-CZ 3.45Å; I13-L66 PolarHBondContact N-O 3.37Å; I13-L66 PolarHBondContact O-N 3Å; I13-I68 HydrophobicContact CD1-CD1 3.72Å; I13-I68 HydrophobicContact CG1-CD1 4.09Å; I13-I78 HydrophobicContact CD1-CG2 4.21Å; I13-L87 HydrophobicContact CD1-CD2 4.46Å; I13-I95 HydrophobicContact CG2-CG1 4.26Å; I13-I95 HydrophobicContact CG2-CG2 3.95Å; I13-S97 WeakPolarHBondContact CA-O 3.45Å; I13-V98 HydrophobicContact CD1-CG2 4.35Å; I13-V98 HydrophobicContact CG1-CG1 4.34Å; I13-V98 HydrophobicContact CG1-CG2 4.14Å; I13-V98 HydrophobicContact CG2-CG2 4.1Å
14	T	93.7	Very high	67.1	Low	33 Å²	33	76.7 Å²	76.7	20%	0.202	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	137.7	172.3	66.7	0	0	0	0	109.9	L65 N96 S97	T14-L65 HydrophobicContact CG2-CB 4.27Å; T14-L65 HydrophobicContact CG2-CD1 3.89Å; T14-L65 HydrophobicContact CG2-CG 3.87Å; T14-N96 PolarHBondContact O-N 3.27Å; T14-N96 WeakPolarHBondContact OG1-CB 3.28Å; T14-S97 WeakPolarHBondContact CG2-OG 3.36Å; T14-S97 PolarHBondContact N-O 2.79Å; T14-S97 PolarHBondContact OG1-N 2.95Å; T14-S97 PolarHBondContact OG1-OG 3.06Å
15	F	92.9	Very high	68.3	Low	10 Å²	10	76.6 Å²	76.6	4%	0.044	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	152.3	172.8	-57.5	-97.1	0	0	0	110.3	I13 L31 F35 Y64 L66 P90 F93 S94 I95	I13-F15 HydrophobicContact CB-CE2 3.92Å; I13-F15 HydrophobicContact CB-CZ 4.22Å; I13-F15 HydrophobicContact CG2-CD2 4.15Å; I13-F15 HydrophobicContact CG2-CE1 4.07Å; I13-F15 HydrophobicContact CG2-CE2 3.45Å; I13-F15 VanDerWaalsContact CG2-CE2 3.45Å; I13-F15 HydrophobicContact CG2-CZ 3.42Å; I13-F15 VanDerWaalsContact CG2-CZ 3.42Å; F15-L31 HydrophobicContact CB-CD2 4.49Å; F15-L31 HydrophobicContact CD2-CD2 3.86Å; F15-L31 HydrophobicContact CE2-CD2 4.34Å; F15-L31 HydrophobicContact CG-CD2 4.21Å; F15-F35 HydrophobicContact CE1-CD2 4.04Å; F15-F35 HydrophobicContact CZ-CB 4.35Å; F15-F35 AromaticContact CZ-CD2 3.84Å; F15-F35 HydrophobicContact CZ-CD2 3.84Å; F15-F35 HydrophobicContact CZ-CE2 4.34Å; F15-F35 HydrophobicContact CZ-CG 4.1Å; F15-Y64 PolarHBondContact N-O 3.01Å; F15-Y64 WeakPolarHBondContact O-CB 3.28Å; F15-L66 HydrophobicContact CD2-CD1 4.45Å; F15-L66 HydrophobicContact CD2-CG 4.27Å; F15-L66 HydrophobicContact CE2-CB 4.32Å; F15-L66 HydrophobicContact CE2-CD1 3.59Å; F15-L66 HydrophobicContact CE2-CG 3.74Å; F15-L66 HydrophobicContact CZ-CD1 4.18Å; F15-P90 HydrophobicContact CD1-CG 4.43Å; F15-P90 VanDerWaalsContact CE1-CD 3.42Å; F15-P90 HydrophobicContact CE1-CG 4.02Å; F15-F93 HydrophobicContact CB-CB 4.38Å; F15-F93 HydrophobicContact CB-CD1 3.96Å; F15-F93 HydrophobicContact CD1-CB 4.34Å; F15-S94 CarbonylContact C-O 3.54Å; F15-S94 WeakPolarHBondContact CA-O 3.38Å; F15-S94 WeakPolarHBondContact CB-O 3.34Å; F15-I95 HydrophobicContact CD1-CG1 3.71Å; F15-I95 HydrophobicContact CE1-CD1 4.23Å; F15-I95 HydrophobicContact CE1-CG1 3.4Å; F15-I95 VanDerWaalsContact CE1-CG1 3.4Å; F15-I95 HydrophobicContact CZ-CG1 4.26Å
16	C	88.8	Confident	69.7	Low	56 Å²	56	74.7 Å²	74.7	38%	0.378	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	140.3	165	-174.3	0	0	0	0	109.2	F93 S94 N96	C16-F93 CarbonylContact O-C 3.52Å; C16-F93 WeakPolarHBondContact O-CA 3.28Å; C16-S94 PolarHBondContact N-O 3.3Å; C16-S94 PolarHBondContact O-N 3.36Å; C16-S94 PolarHBondContact O-OG 3.32Å; C16-N96 WeakPolarHBondContact CB-ND2 3.2Å; C16-N96 WeakPolarHBondContact CB-OD1 3.41Å; C16-N96 PolarHBondContact N-OD1 3Å
17	R	84.4	Confident	71.1	Confident	58 Å²	58	70.5 Å²	70.5	22%	0.219	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	118.7	179	-174.6	172.3	172.8	163.6	-2.2	109.3	S22 L24 Y64 G92 F93	R17-S22 PolarHBondContact NH2-O 3.21Å; R17-S22 PolarHBondContact NH2-OG 3.43Å; R17-L24 PolarHBondContact NH1-O 3.32Å; R17-Y64 HydrophobicContact CB-CE2 3.98Å; R17-Y64 WeakPolarHBondContact CD-OH 3.46Å; R17-Y64 PolarHBondContact NH1-OH 3.34Å; R17-G92 CarbonylContact C-O 3.54Å; R17-G92 WeakPolarHBondContact CA-O 3.42Å; R17-F93 HydrophobicContact CB-CD1 4.11Å; R17-F93 HydrophobicContact CB-CE1 3.89Å; R17-F93 HydrophobicContact CG-CE1 4.25Å
18	Q	75.3	Confident	72.4	Confident	132 Å²	132	65 Å²	65	62%	0.617	33%	0.332	S	S	*	.			trans	-88.9	-31.4	-173.4	-68.4	-175.5	-51.8	0	0	113.5	G92	Q18-G92 PolarHBondContact N-O 2.97Å
19	L	65.3	Low	73.6	Confident	123 Å²	123	63.5 Å²	63.5	64%	0.644	32%	0.322	S	S	*	.	S	Bend	trans	-84.8	150.6	175.9	-90.8	74.3	0	0	0	111.2
20	Q	52.4	Low	73.9	Confident	173 Å²	173	60.9 Å²	60.9	81%	0.808	31%	0.311	S	S	*	.			trans	-49.2	155.2	176.8	-76.9	-173.8	-4	0	0	112.9	S22	Q20-S22 VanDerWaalsContact C-N 3.27Å; Q20-S22 PolarHBondContact O-N 2.92Å
21	P	50.2	Low	73.9	Confident	115 Å²	115	61 Å²	61	75%	0.747	31%	0.312	S	S	*	.			trans	-73.8	74.7	-175.7	31.9	-37.3	0	0	0	112.7	R23	P21-R23 PolarHBondContact O-N 3.34Å
22	S	46.4	Very low	73.8	Confident	64 Å²	64	61 Å²	61	45%	0.448	31%	0.312	S	S	.	.			trans	-52.1	135.5	148.3	54.9	0	0	0	0	108	R17 Q20 L24	R17-S22 PolarHBondContact NH2-O 3.21Å; R17-S22 PolarHBondContact NH2-OG 3.43Å; Q20-S22 VanDerWaalsContact C-N 3.27Å; Q20-S22 PolarHBondContact O-N 2.92Å; S22-L24 PolarHBondContact O-N 3.11Å
23	R	46.5	Very low	73.5	Confident	233 Å²	233	61.1 Å²	61.1	88%	0.879	31%	0.312	S	S	*	.	S	Bend	trans	-69	21.1	-165	-65.5	179.3	174.3	168.8	-3.1	115.5	P21 T25	P21-R23 PolarHBondContact O-N 3.34Å; R23-T25 PolarHBondContact O-N 3.2Å
24	L	47.1	Very low	73.1	Confident	45 Å²	45	62.7 Å²	62.7	24%	0.236	32%	0.323	C	S	.	.			trans	-85.9	109.6	-175	-49.5	179.6	0	0	0	109.8	R17 S22 L26 S282	R17-L24 PolarHBondContact NH1-O 3.32Å; S22-L24 PolarHBondContact O-N 3.11Å; L24-L26 VanDerWaalsContact C-N 3.32Å; L24-L26 PolarHBondContact O-N 2.92Å; L24-L26 VanDerWaalsContact O-N 3.14Å; L24-S282 VanDerWaalsContact CD1-OG 3.31Å; L24-S282 WeakPolarHBondContact CD1-OG 3.4Å; L24-S282 WeakPolarHBondContact CD2-O 3.02Å
25	T	54.6	Low	73.1	Confident	97 Å²	97	61.1 Å²	61.1	60%	0.595	31%	0.313	S	S	*	.			trans	-73.6	86.3	161.9	48.4	0	0	0	0	108.2	R23 H27	R23-T25 PolarHBondContact O-N 3.2Å; T25-H27 PolarHBondContact O-N 3.26Å
26	L	64.3	Low	73	Confident	61 Å²	61	60.9 Å²	60.9	32%	0.319	31%	0.312	S	S	.	.			trans	-69.9	117.3	179	-170.2	144.8	0	0	0	108.9	L24 L31 F93	L24-L26 VanDerWaalsContact C-N 3.32Å; L24-L26 PolarHBondContact O-N 2.92Å; L24-L26 VanDerWaalsContact O-N 3.14Å; L26-L31 HydrophobicContact CD2-CB 3.62Å; L26-L31 HydrophobicContact CD2-CD1 4.3Å; L26-F93 HydrophobicContact CD1-CE2 4.25Å
27	H	75.7	Confident	72.9	Confident	49 Å²	49	61 Å²	61	23%	0.227	31%	0.305	C	S	.	.			trans	-65	138.2	-172.9	-170.5	-90.6	0	0	0	111	T25 F29 D30 L31 R406	T25-H27 PolarHBondContact O-N 3.26Å; H27-F29 VanDerWaalsContact C-N 3.3Å; H27-F29 PolarHBondContact ND1-N 3.2Å; H27-F29 PolarHBondContact O-N 2.97Å; H27-D30 HydrophobicContact CB-CB 4.4Å; H27-D30 IonicContact ND1-OD1 3.59Å; H27-D30 WeakPolarHBondContact O-CA 3.44Å; H27-D30 VanDerWaalsContact O-CB 3.31Å; H27-D30 WeakPolarHBondContact O-CB 3.34Å; H27-D30 PolarHBondContact O-N 3.2Å; H27-L31 PolarHBondContact O-N 3.49Å; H27-R406 PolarHBondContact CE1-NE 2.89Å; H27-R406 VanDerWaalsContact ND1-CZ 3.32Å; H27-R406 PolarHBondContact ND1-NH1 3.03Å
28	V	82.5	Confident	73.2	Confident	7 Å²	7	58.9 Å²	58.9	4%	0.042	30%	0.298	C	S	.	.	H	α-helix	trans	-51.1	-44.4	-174.6	169.7	0	0	0	0	113.4	D30 L31 F32 L57 H60 E62 L66 M114	V28-D30 VanDerWaalsContact C-N 3.26Å; V28-D30 PolarHBondContact O-N 2.97Å; V28-L31 WeakPolarHBondContact O-CB 3.44Å; V28-L31 PolarHBondContact O-N 3.02Å; V28-F32 PolarHBondContact O-N 2.95Å; V28-L57 HydrophobicContact CG1-CD2 4.18Å; V28-H60 HydrophobicContact CB-CB 4.44Å; V28-H60 HydrophobicContact CG1-CB 3.4Å; V28-H60 HydrophobicContact CG2-CB 4.25Å; V28-E62 WeakPolarHBondContact CG2-OE1 3.29Å; V28-L66 HydrophobicContact CG1-CD2 3.42Å; V28-L66 VanDerWaalsContact CG1-CD2 3.42Å; V28-M114 HydrophobicContact CG1-CE 4.49Å
29	F	81.4	Confident	74	Confident	3 Å²	3	52.6 Å²	52.6	1%	0.013	27%	0.268	C	S	.	.	H	α-helix	trans	-63.8	-32.1	175.9	-179.2	-89.5	0	0	0	112.7	H27 F32 I33 L57 Q122 I398 F402	H27-F29 VanDerWaalsContact C-N 3.3Å; H27-F29 PolarHBondContact ND1-N 3.2Å; H27-F29 PolarHBondContact O-N 2.97Å; F29-F32 WeakPolarHBondContact O-CB 3.41Å; F29-F32 PolarHBondContact O-N 3.45Å; F29-I33 HydrophobicContact CD1-CG1 3.8Å; F29-I33 HydrophobicContact CE1-CD1 4.13Å; F29-I33 HydrophobicContact CE1-CG1 3.52Å; F29-I33 HydrophobicContact CG-CG1 4.5Å; F29-I33 HydrophobicContact CZ-CD1 4.09Å; F29-I33 HydrophobicContact CZ-CG1 3.97Å; F29-I33 WeakPolarHBondContact O-CG1 3.32Å; F29-I33 PolarHBondContact O-N 3.29Å; F29-L57 HydrophobicContact CB-CD2 4.32Å; F29-L57 HydrophobicContact CD2-CD2 4.28Å; F29-Q122 HydrophobicContact CE2-CG 4.13Å; F29-I398 HydrophobicContact CE1-CG2 3.68Å; F29-I398 HydrophobicContact CZ-CG2 4.02Å; F29-F402 HydrophobicContact CE1-CB 4.08Å; F29-F402 HydrophobicContact CE1-CD1 4.32Å; F29-F402 HydrophobicContact CE1-CD2 4.17Å; F29-F402 AromaticContact CE1-CG 3.88Å; F29-F402 HydrophobicContact CE1-CG 3.88Å; F29-F402 HydrophobicContact CZ-CD1 4.3Å; F29-F402 HydrophobicContact CZ-CD2 4.25Å; F29-F402 HydrophobicContact CZ-CG 4.15Å
30	D	82.2	Confident	75.2	Confident	13 Å²	13	47.6 Å²	47.6	7%	0.07	24%	0.243	C	C	.	.	H	α-helix	trans	-77.4	-31.1	-177.8	-54.6	9	0	0	0	109.4	H27 V28 S34 L399 Q403 R406	H27-D30 HydrophobicContact CB-CB 4.4Å; H27-D30 IonicContact ND1-OD1 3.59Å; H27-D30 WeakPolarHBondContact O-CA 3.44Å; H27-D30 VanDerWaalsContact O-CB 3.31Å; H27-D30 WeakPolarHBondContact O-CB 3.34Å; H27-D30 PolarHBondContact O-N 3.2Å; V28-D30 VanDerWaalsContact C-N 3.26Å; V28-D30 PolarHBondContact O-N 2.97Å; D30-S34 VanDerWaalsContact O-CB 3.28Å; D30-S34 WeakPolarHBondContact O-CB 3.41Å; D30-S34 PolarHBondContact O-N 2.88Å; D30-S34 PolarHBondContact O-OG 3.11Å; D30-L399 HydrophobicContact CB-CD2 3.74Å; D30-Q403 PolarHBondContact OD2-NE2 2.72Å; D30-R406 IonicContact OD1-CZ 3.15Å; D30-R406 IonicContact OD1-NH1 2.82Å; D30-R406 PolarHBondContact OD1-NH1 2.95Å
31	L	88.1	Confident	76.6	Confident	3 Å²	3	41.3 Å²	41.3	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-62.2	-45.5	164.9	-175.4	65.3	0	0	0	111.2	F15 L26 H27 V28 S34 F35 Y64 L66 P90 F93	F15-L31 HydrophobicContact CB-CD2 4.49Å; F15-L31 HydrophobicContact CD2-CD2 3.86Å; F15-L31 HydrophobicContact CE2-CD2 4.34Å; F15-L31 HydrophobicContact CG-CD2 4.21Å; L26-L31 HydrophobicContact CD2-CB 3.62Å; L26-L31 HydrophobicContact CD2-CD1 4.3Å; H27-L31 PolarHBondContact O-N 3.49Å; V28-L31 WeakPolarHBondContact O-CB 3.44Å; V28-L31 PolarHBondContact O-N 3.02Å; L31-S34 PolarHBondContact O-N 3.3Å; L31-F35 WeakPolarHBondContact O-CB 3.24Å; L31-F35 PolarHBondContact O-N 2.77Å; L31-Y64 HydrophobicContact CD2-CD1 4.42Å; L31-L66 HydrophobicContact CD2-CD1 4.38Å; L31-L66 HydrophobicContact CD2-CD2 4.31Å; L31-L66 HydrophobicContact CD2-CG 4.35Å; L31-L66 HydrophobicContact CG-CD1 4.3Å; L31-P90 HydrophobicContact CD1-CB 3.98Å; L31-P90 HydrophobicContact CD1-CG 3.78Å; L31-F93 HydrophobicContact CD1-CD1 4.21Å; L31-F93 HydrophobicContact CD1-CD2 3.66Å; L31-F93 HydrophobicContact CD1-CE1 4.18Å; L31-F93 HydrophobicContact CD1-CE2 3.63Å; L31-F93 HydrophobicContact CD1-CG 3.96Å; L31-F93 HydrophobicContact CD1-CZ 3.9Å
32	F	90	Very high	77.6	Confident	1 Å²	1	39.7 Å²	39.7	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-62.4	-46.7	177.3	176.2	-109.1	0	0	0	112.7	V28 F29 S34 F35 K36 Y56 L57 L66 I68 Q122	V28-F32 PolarHBondContact O-N 2.95Å; F29-F32 WeakPolarHBondContact O-CB 3.41Å; F29-F32 PolarHBondContact O-N 3.45Å; F32-S34 VanDerWaalsContact C-N 3.34Å; F32-S34 PolarHBondContact O-N 3.39Å; F32-F35 WeakPolarHBondContact O-CB 3.26Å; F32-F35 PolarHBondContact O-N 2.88Å; F32-K36 HydrophobicContact CD1-CD 4.12Å; F32-K36 HydrophobicContact CE1-CD 3.47Å; F32-K36 VanDerWaalsContact CE1-CD 3.47Å; F32-K36 HydrophobicContact CE1-CG 4.37Å; F32-K36 HydrophobicContact CE2-CD 4.02Å; F32-K36 HydrophobicContact CE2-CG 4.28Å; F32-K36 HydrophobicContact CZ-CD 3.42Å; F32-K36 VanDerWaalsContact CZ-CD 3.42Å; F32-K36 HydrophobicContact CZ-CG 4.17Å; F32-K36 WeakPolarHBondContact O-CG 3.34Å; F32-K36 PolarHBondContact O-N 2.82Å; F32-Y56 VanDerWaalsContact CZ-C 3.5Å; F32-L57 HydrophobicContact CB-CD1 4.34Å; F32-L57 HydrophobicContact CB-CD2 3.93Å; F32-L57 HydrophobicContact CD1-CB 3.7Å; F32-L57 HydrophobicContact CD1-CD2 4.31Å; F32-L57 HydrophobicContact CD2-CB 4.05Å; F32-L57 HydrophobicContact CD2-CD1 4.09Å; F32-L57 HydrophobicContact CE1-CB 3.73Å; F32-L57 HydrophobicContact CE2-CB 4.07Å; F32-L57 HydrophobicContact CG-CB 3.85Å; F32-L57 HydrophobicContact CG-CD1 4.21Å; F32-L57 HydrophobicContact CG-CD2 4.12Å; F32-L57 HydrophobicContact CG-CG 4.3Å; F32-L57 HydrophobicContact CZ-CB 3.9Å; F32-L57 VanDerWaalsContact CZ-N 3.26Å; F32-L66 HydrophobicContact CB-CD1 3.85Å; F32-L66 HydrophobicContact CD2-CD1 4.17Å; F32-I68 HydrophobicContact CD2-CD1 4.03Å; F32-I68 HydrophobicContact CD2-CG1 4.2Å; F32-I68 HydrophobicContact CE2-CD1 3.89Å; F32-I68 HydrophobicContact CE2-CG1 3.91Å; F32-I68 HydrophobicContact CE2-CG2 4.31Å; F32-Q122 VanDerWaalsContact CE1-OE1 3.28Å
33	I	86.4	Confident	79.1	Confident	8 Å²	8	38.2 Å²	38.2	4%	0.041	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-38	176.7	-66.7	-62.6	0	0	0	111	F29 K36 Y37 L395 I398 L399	F29-I33 HydrophobicContact CD1-CG1 3.8Å; F29-I33 HydrophobicContact CE1-CD1 4.13Å; F29-I33 HydrophobicContact CE1-CG1 3.52Å; F29-I33 HydrophobicContact CG-CG1 4.5Å; F29-I33 HydrophobicContact CZ-CD1 4.09Å; F29-I33 HydrophobicContact CZ-CG1 3.97Å; F29-I33 WeakPolarHBondContact O-CG1 3.32Å; F29-I33 PolarHBondContact O-N 3.29Å; I33-K36 PolarHBondContact O-N 2.81Å; I33-Y37 WeakPolarHBondContact O-CB 3.36Å; I33-Y37 PolarHBondContact O-N 3.05Å; I33-L395 HydrophobicContact CG2-CB 4.42Å; I33-L395 HydrophobicContact CG2-CD2 4.37Å; I33-I398 HydrophobicContact CD1-CG2 3.93Å; I33-I398 HydrophobicContact CG1-CG2 3.94Å; I33-I398 HydrophobicContact CG2-CG2 4.42Å; I33-L399 HydrophobicContact CB-CD2 3.88Å; I33-L399 HydrophobicContact CB-CG 4.5Å; I33-L399 HydrophobicContact CG2-CD1 4.22Å; I33-L399 HydrophobicContact CG2-CD2 3.78Å; I33-L399 HydrophobicContact CG2-CG 3.84Å
34	S	88	Confident	80.6	Confident	33 Å²	33	36.5 Å²	36.5	23%	0.231	19%	0.186	C	C	.	.	H	α-helix	trans	-63.3	-43.2	173.3	-59.8	0	0	0	0	112.3	D30 L31 F32 Y37 I38	D30-S34 VanDerWaalsContact O-CB 3.28Å; D30-S34 WeakPolarHBondContact O-CB 3.41Å; D30-S34 PolarHBondContact O-N 2.88Å; D30-S34 PolarHBondContact O-OG 3.11Å; L31-S34 PolarHBondContact O-N 3.3Å; F32-S34 VanDerWaalsContact C-N 3.34Å; F32-S34 PolarHBondContact O-N 3.39Å; S34-Y37 PolarHBondContact O-N 3.34Å; S34-I38 WeakPolarHBondContact O-CD1 3.35Å; S34-I38 WeakPolarHBondContact O-CG1 3.23Å; S34-I38 PolarHBondContact O-N 3.15Å; S34-I38 VanDerWaalsContact O-N 3.1Å
35	F	91.8	Very high	82.5	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.4	-41.6	174.2	168.1	-104.2	0	0	0	112	I13 F15 L31 F32 N39 I52 I68 L87 P90 I95	I13-F35 HydrophobicContact CD1-CE1 3.92Å; I13-F35 HydrophobicContact CD1-CE2 4.13Å; I13-F35 HydrophobicContact CD1-CZ 3.45Å; I13-F35 VanDerWaalsContact CD1-CZ 3.45Å; F15-F35 HydrophobicContact CE1-CD2 4.04Å; F15-F35 HydrophobicContact CZ-CB 4.35Å; F15-F35 AromaticContact CZ-CD2 3.84Å; F15-F35 HydrophobicContact CZ-CD2 3.84Å; F15-F35 HydrophobicContact CZ-CE2 4.34Å; F15-F35 HydrophobicContact CZ-CG 4.1Å; L31-F35 WeakPolarHBondContact O-CB 3.24Å; L31-F35 PolarHBondContact O-N 2.77Å; F32-F35 WeakPolarHBondContact O-CB 3.26Å; F32-F35 PolarHBondContact O-N 2.88Å; F35-N39 WeakPolarHBondContact O-CB 3.38Å; F35-N39 PolarHBondContact O-N 3.44Å; F35-N39 PolarHBondContact O-ND2 2.8Å; F35-I52 HydrophobicContact CE1-CD1 3.59Å; F35-I52 HydrophobicContact CZ-CD1 3.6Å; F35-I68 HydrophobicContact CD1-CD1 4.27Å; F35-I68 HydrophobicContact CE1-CD1 3.85Å; F35-L87 HydrophobicContact CE2-CD1 3.85Å; F35-L87 HydrophobicContact CE2-CD2 4Å; F35-L87 HydrophobicContact CE2-CG 3.95Å; F35-L87 HydrophobicContact CZ-CD1 3.85Å; F35-L87 HydrophobicContact CZ-CD2 4.1Å; F35-L87 HydrophobicContact CZ-CG 4.29Å; F35-P90 HydrophobicContact CB-CG 3.86Å; F35-I95 HydrophobicContact CE2-CD1 4.13Å
36	K	91.6	Very high	84.2	Confident	5 Å²	5	35.4 Å²	35.4	2%	0.022	18%	0.183	C	C	.	.	H	α-helix	trans	-65.4	-46.8	174.4	-73.4	-172	63.8	144.8	0	112.4	F32 I33 I38 N39 V40 I52 Q53 C55	F32-K36 HydrophobicContact CD1-CD 4.12Å; F32-K36 HydrophobicContact CE1-CD 3.47Å; F32-K36 VanDerWaalsContact CE1-CD 3.47Å; F32-K36 HydrophobicContact CE1-CG 4.37Å; F32-K36 HydrophobicContact CE2-CD 4.02Å; F32-K36 HydrophobicContact CE2-CG 4.28Å; F32-K36 HydrophobicContact CZ-CD 3.42Å; F32-K36 VanDerWaalsContact CZ-CD 3.42Å; F32-K36 HydrophobicContact CZ-CG 4.17Å; F32-K36 WeakPolarHBondContact O-CG 3.34Å; F32-K36 PolarHBondContact O-N 2.82Å; I33-K36 PolarHBondContact O-N 2.81Å; K36-I38 PolarHBondContact O-N 2.91Å; K36-N39 PolarHBondContact O-N 2.94Å; K36-V40 WeakPolarHBondContact O-CB 3.49Å; K36-V40 VanDerWaalsContact O-CG2 3.28Å; K36-V40 WeakPolarHBondContact O-CG2 3.3Å; K36-V40 PolarHBondContact O-N 2.85Å; K36-I52 HydrophobicContact CB-CG2 4.06Å; K36-I52 WeakPolarHBondContact CE-O 3.37Å; K36-I52 HydrophobicContact CG-CG2 3.91Å; K36-I52 PolarHBondContact NZ-O 3.2Å; K36-Q53 PolarHBondContact NZ-O 3.11Å; K36-C55 PolarHBondContact NZ-O 3.3Å
37	Y	87.8	Confident	85.5	Confident	59 Å²	59	40.9 Å²	40.9	23%	0.231	20%	0.2	C	C	.	.	H	α-helix	trans	-52.5	-59	177.9	-177.7	-83.7	0	0	0	110.6	I33 S34 N39 V40 T41 P392 L395	I33-Y37 WeakPolarHBondContact O-CB 3.36Å; I33-Y37 PolarHBondContact O-N 3.05Å; S34-Y37 PolarHBondContact O-N 3.34Å; Y37-N39 VanDerWaalsContact C-N 3.26Å; Y37-N39 PolarHBondContact O-N 2.68Å; Y37-V40 PolarHBondContact O-N 3.15Å; Y37-T41 HydrophobicContact CD1-CG2 4.14Å; Y37-T41 HydrophobicContact CD2-CG2 4.21Å; Y37-T41 HydrophobicContact CE1-CG2 3.93Å; Y37-T41 HydrophobicContact CE2-CG2 4Å; Y37-T41 HydrophobicContact CG-CG2 4.28Å; Y37-T41 PolarHBondContact O-N 3.37Å; Y37-T41 PolarHBondContact O-OG1 3.08Å; Y37-P392 HydrophobicContact CE2-CB 3.53Å; Y37-P392 WeakPolarHBondContact OH-CB 3.42Å; Y37-L395 HydrophobicContact CD2-CB 4.05Å; Y37-L395 HydrophobicContact CD2-CD1 3.9Å; Y37-L395 HydrophobicContact CG-CD1 4.42Å
38	I	89.3	Confident	86.4	Confident	12 Å²	12	38.5 Å²	38.5	6%	0.062	19%	0.189	C	C	.	.	H	α-helix	trans	-64.9	-30.4	-172.2	-66.7	161.8	0	0	0	112.1	S34 K36 H42 K88 P90 F91	S34-I38 WeakPolarHBondContact O-CD1 3.35Å; S34-I38 WeakPolarHBondContact O-CG1 3.23Å; S34-I38 PolarHBondContact O-N 3.15Å; S34-I38 VanDerWaalsContact O-N 3.1Å; K36-I38 PolarHBondContact O-N 2.91Å; I38-H42 PolarHBondContact O-N 2.99Å; I38-K88 HydrophobicContact CG2-CB 3.73Å; I38-K88 HydrophobicContact CG2-CD 4.24Å; I38-P90 HydrophobicContact CD1-CB 4.46Å; I38-F91 HydrophobicContact CD1-CD2 3.65Å; I38-F91 HydrophobicContact CD1-CE2 3.79Å; I38-F91 HydrophobicContact CG1-CD2 4.49Å; I38-F91 HydrophobicContact CG1-CE2 4.17Å
39	N	92.4	Very high	86.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-91.7	5.7	176.4	-68.1	-73.1	0	0	0	114.8	F35 K36 Y37 Q43 I52 K88	F35-N39 WeakPolarHBondContact O-CB 3.38Å; F35-N39 PolarHBondContact O-N 3.44Å; F35-N39 PolarHBondContact O-ND2 2.8Å; K36-N39 PolarHBondContact O-N 2.94Å; Y37-N39 VanDerWaalsContact C-N 3.26Å; Y37-N39 PolarHBondContact O-N 2.68Å; N39-Q43 HydrophobicContact CB-CG 4.38Å; N39-Q43 WeakPolarHBondContact O-CG 3.28Å; N39-Q43 PolarHBondContact OD1-NE2 2.89Å; N39-I52 HydrophobicContact CB-CB 4.46Å; N39-I52 HydrophobicContact CB-CD1 4.15Å; N39-I52 HydrophobicContact CB-CG1 3.95Å; N39-I52 HydrophobicContact CB-CG2 4.04Å; N39-K88 PolarHBondContact ND2-O 2.98Å; N39-K88 PolarHBondContact OD1-N 2.94Å
40	V	89.6	Confident	87.2	Confident	18 Å²	18	43.2 Å²	43.2	11%	0.109	21%	0.212	C	C	.	.	H	α-helix	trans	-113.1	-43.4	169.8	168.5	0	0	0	0	111	K36 Y37 I52 Q53 H390	K36-V40 WeakPolarHBondContact O-CB 3.49Å; K36-V40 VanDerWaalsContact O-CG2 3.28Å; K36-V40 WeakPolarHBondContact O-CG2 3.3Å; K36-V40 PolarHBondContact O-N 2.85Å; Y37-V40 PolarHBondContact O-N 3.15Å; V40-I52 HydrophobicContact CG2-CB 4.32Å; V40-I52 HydrophobicContact CG2-CG2 3.86Å; V40-Q53 HydrophobicContact CG2-CB 4.47Å; V40-H390 PolarHBondContact O-CE1 2.85Å; V40-H390 VanDerWaalsContact O-CE1 3.29Å
41	T	82.4	Confident	87.8	Confident	41 Å²	41	42.6 Å²	42.6	25%	0.252	21%	0.209	S	C	.	.	H	α-helix	trans	-75.8	-30.3	-177.8	55.9	0	0	0	0	113.8	Y37	Y37-T41 HydrophobicContact CD1-CG2 4.14Å; Y37-T41 HydrophobicContact CD2-CG2 4.21Å; Y37-T41 HydrophobicContact CE1-CG2 3.93Å; Y37-T41 HydrophobicContact CE2-CG2 4Å; Y37-T41 HydrophobicContact CG-CG2 4.28Å; Y37-T41 PolarHBondContact O-N 3.37Å; Y37-T41 PolarHBondContact O-OG1 3.08Å
42	H	70.6	Confident	88	Confident	81 Å²	81	42.4 Å²	42.4	38%	0.375	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118	29	-170.9	-51.3	-58.5	0	0	0	113.4	I38 K88	I38-H42 PolarHBondContact O-N 2.99Å; H42-K88 HydrophobicContact CB-CD 4.49Å; H42-K88 PolarHBondContact O-NZ 2.84Å
43	Q	78.5	Confident	88	Confident	34 Å²	34	44.6 Å²	44.6	16%	0.159	22%	0.218	C	C	.	.			trans	-119.6	125.2	-179.3	-68.2	-65.4	-1.3	0	0	112.7	N39 N45 L48 Q86	N39-Q43 HydrophobicContact CB-CG 4.38Å; N39-Q43 WeakPolarHBondContact O-CG 3.28Å; N39-Q43 PolarHBondContact OD1-NE2 2.89Å; Q43-N45 VanDerWaalsContact C-N 3.31Å; Q43-L48 HydrophobicContact CG-CD2 4.02Å; Q43-L48 HydrophobicContact CG-CG 4.48Å; Q43-Q86 PolarHBondContact NE2-O 3.25Å
44	H	79.2	Confident	88	Confident	197 Å²	197	47 Å²	47	91%	0.912	23%	0.231	S	C	*	.	S	Bend	trans	-79.2	-17.1	170.3	-56.3	-68	0	0	0	112.6	S46	H44-S46 PolarHBondContact O-N 3.02Å
45	N	86.9	Confident	88.2	Confident	38 Å²	38	45.4 Å²	45.4	20%	0.203	22%	0.22	C	C	.	.			trans	-82.6	98.3	177.4	-178.4	-5.9	0	0	0	109.8	Q43 W47 L48 S49 Q86	Q43-N45 VanDerWaalsContact C-N 3.31Å; N45-W47 PolarHBondContact O-N 3.38Å; N45-W47 WeakPolarHBondContact OD1-CB 3.02Å; N45-W47 PolarHBondContact OD1-N 3.18Å; N45-W47 VanDerWaalsContact OD1-N 3.17Å; N45-L48 HydrophobicContact CB-CB 3.99Å; N45-L48 PolarHBondContact O-N 3.27Å; N45-L48 VanDerWaalsContact O-N 3.13Å; N45-L48 PolarHBondContact OD1-N 3.18Å; N45-S49 PolarHBondContact O-N 3.47Å; N45-Q86 PolarHBondContact ND2-OE1 3.15Å
46	S	89.1	Confident	88	Confident	80 Å²	80	46.4 Å²	46.4	56%	0.559	22%	0.224	S	C	*	.	H	α-helix	trans	-57.2	-35.4	179.3	55.1	0	0	0	0	113.2	H44 S49 Q50	H44-S46 PolarHBondContact O-N 3.02Å; S46-S49 PolarHBondContact O-N 3.12Å; S46-Q50 VanDerWaalsContact O-CB 3.25Å; S46-Q50 WeakPolarHBondContact O-CB 3.38Å; S46-Q50 PolarHBondContact O-N 2.9Å
47	W	91.7	Very high	88	Confident	176 Å²	176	46.1 Å²	46.1	67%	0.667	22%	0.223	S	C	*	.	H	α-helix	trans	-67.1	-39	177.3	-58.7	97.4	0	0	0	112.1	N45 A51 T77	N45-W47 PolarHBondContact O-N 3.38Å; N45-W47 WeakPolarHBondContact OD1-CB 3.02Å; N45-W47 PolarHBondContact OD1-N 3.18Å; N45-W47 VanDerWaalsContact OD1-N 3.17Å; W47-A51 WeakPolarHBondContact O-CB 3.26Å; W47-A51 PolarHBondContact O-N 2.76Å; W47-T77 HydrophobicContact CB-CG2 4.18Å
48	L	94	Very high	87.9	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.9	-47.5	173.7	174.8	58.3	0	0	0	111	Q43 N45 Q50 A51 I52 I78 Q86 L87	Q43-L48 HydrophobicContact CG-CD2 4.02Å; Q43-L48 HydrophobicContact CG-CG 4.48Å; N45-L48 HydrophobicContact CB-CB 3.99Å; N45-L48 PolarHBondContact O-N 3.27Å; N45-L48 VanDerWaalsContact O-N 3.13Å; N45-L48 PolarHBondContact OD1-N 3.18Å; L48-Q50 VanDerWaalsContact C-N 3.32Å; L48-Q50 PolarHBondContact O-N 3.22Å; L48-A51 PolarHBondContact O-N 3.16Å; L48-I52 HydrophobicContact CD1-CD1 4.23Å; L48-I52 HydrophobicContact CD1-CG1 3.67Å; L48-I52 HydrophobicContact CG-CG1 4.3Å; L48-I52 WeakPolarHBondContact O-CB 3.3Å; L48-I52 WeakPolarHBondContact O-CG1 3.46Å; L48-I52 PolarHBondContact O-N 3.02Å; L48-I78 HydrophobicContact CD1-CG1 4.43Å; L48-Q86 HydrophobicContact CD2-CB 4.42Å; L48-L87 HydrophobicContact CD1-CD1 3.98Å
49	S	91.8	Very high	87.8	Confident	15 Å²	15	43.1 Å²	43.1	11%	0.105	21%	0.21	C	C	.	.	H	α-helix	trans	-57.2	-46.3	176.6	-175.5	0	0	0	0	111.2	N45 S46 I52 Q53	N45-S49 PolarHBondContact O-N 3.47Å; S46-S49 PolarHBondContact O-N 3.12Å; S49-I52 PolarHBondContact O-N 2.85Å; S49-Q53 VanDerWaalsContact O-CB 3.28Å; S49-Q53 WeakPolarHBondContact O-CB 3.38Å; S49-Q53 PolarHBondContact O-N 2.69Å
50	Q	91	Very high	87.7	Confident	93 Å²	93	43.7 Å²	43.7	44%	0.435	21%	0.213	S	C	.	.	H	α-helix	trans	-64	-42.7	176.4	-176	177	-3.4	0	0	112.2	S46 L48 Q53 N54	S46-Q50 VanDerWaalsContact O-CB 3.25Å; S46-Q50 WeakPolarHBondContact O-CB 3.38Å; S46-Q50 PolarHBondContact O-N 2.9Å; L48-Q50 VanDerWaalsContact C-N 3.32Å; L48-Q50 PolarHBondContact O-N 3.22Å; Q50-Q53 PolarHBondContact O-N 3.38Å; Q50-N54 WeakPolarHBondContact O-CB 3.47Å; Q50-N54 PolarHBondContact O-N 3.37Å; Q50-N54 PolarHBondContact O-ND2 3.18Å
51	A	93.3	Very high	87.5	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-41.4	178.2	0	0	0	0	0	112.3	W47 L48 N54 C55 H74 T77 I78	W47-A51 WeakPolarHBondContact O-CB 3.26Å; W47-A51 PolarHBondContact O-N 2.76Å; L48-A51 PolarHBondContact O-N 3.16Å; A51-N54 CarbonylContact O-C 3.42Å; A51-N54 PolarHBondContact O-N 3.13Å; A51-C55 WeakPolarHBondContact O-CB 3.29Å; A51-C55 PolarHBondContact O-N 3.35Å; A51-H74 HydrophobicContact CB-CB 3.8Å; A51-T77 HydrophobicContact CB-CG2 3.97Å; A51-I78 HydrophobicContact CB-CD1 4.49Å; A51-I78 HydrophobicContact CB-CG1 4.06Å
52	I	93.3	Very high	87.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-70.2	-41.5	176.8	-66.8	-78.3	0	0	0	111.1	F35 K36 N39 V40 L48 S49 N54 C55 I78 L87	F35-I52 HydrophobicContact CE1-CD1 3.59Å; F35-I52 HydrophobicContact CZ-CD1 3.6Å; K36-I52 HydrophobicContact CB-CG2 4.06Å; K36-I52 WeakPolarHBondContact CE-O 3.37Å; K36-I52 HydrophobicContact CG-CG2 3.91Å; K36-I52 PolarHBondContact NZ-O 3.2Å; N39-I52 HydrophobicContact CB-CB 4.46Å; N39-I52 HydrophobicContact CB-CD1 4.15Å; N39-I52 HydrophobicContact CB-CG1 3.95Å; N39-I52 HydrophobicContact CB-CG2 4.04Å; V40-I52 HydrophobicContact CG2-CB 4.32Å; V40-I52 HydrophobicContact CG2-CG2 3.86Å; L48-I52 HydrophobicContact CD1-CD1 4.23Å; L48-I52 HydrophobicContact CD1-CG1 3.67Å; L48-I52 HydrophobicContact CG-CG1 4.3Å; L48-I52 WeakPolarHBondContact O-CB 3.3Å; L48-I52 WeakPolarHBondContact O-CG1 3.46Å; L48-I52 PolarHBondContact O-N 3.02Å; S49-I52 PolarHBondContact O-N 2.85Å; I52-N54 VanDerWaalsContact C-N 3.3Å; I52-N54 PolarHBondContact O-N 3.4Å; I52-C55 PolarHBondContact O-N 3.18Å; I52-C55 PolarHBondContact O-SG 3.08Å; I52-I78 HydrophobicContact CD1-CD1 3.87Å; I52-I78 HydrophobicContact CD1-CG1 3.81Å; I52-I78 HydrophobicContact CD1-CG2 4.33Å; I52-I78 HydrophobicContact CG1-CD1 4.43Å; I52-I78 HydrophobicContact CG1-CG1 4.19Å; I52-L87 HydrophobicContact CD1-CD1 3.98Å
53	Q	88.4	Confident	87.6	Confident	47 Å²	47	47.2 Å²	47.2	22%	0.22	24%	0.236	C	C	.	.	H	α-helix	trans	-58.8	-44.3	174.8	-169.6	176.4	17.2	0	0	110.8	K36 V40 S49 Q50 C55 W125 Q126	K36-Q53 PolarHBondContact NZ-O 3.11Å; V40-Q53 HydrophobicContact CG2-CB 4.47Å; S49-Q53 VanDerWaalsContact O-CB 3.28Å; S49-Q53 WeakPolarHBondContact O-CB 3.38Å; S49-Q53 PolarHBondContact O-N 2.69Å; Q50-Q53 PolarHBondContact O-N 3.38Å; Q53-C55 PolarHBondContact O-N 2.86Å; Q53-W125 HydrophobicContact CG-CH2 3.77Å; Q53-W125 HydrophobicContact CG-CZ2 4.43Å; Q53-W125 HydrophobicContact CG-CZ3 4.41Å; Q53-W125 WeakPolarHBondContact O-CZ3 3.35Å; Q53-Q126 PolarHBondContact O-NE2 3.17Å; Q53-Q126 VanDerWaalsContact O-NE2 3.16Å
54	N	88.3	Confident	88.1	Confident	57 Å²	57	48.3 Å²	48.3	31%	0.305	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	5.6	-178.1	-69.1	-78.5	0	0	0	115.1	Q50 A51 I52 H74 Q126	Q50-N54 WeakPolarHBondContact O-CB 3.47Å; Q50-N54 PolarHBondContact O-N 3.37Å; Q50-N54 PolarHBondContact O-ND2 3.18Å; A51-N54 CarbonylContact O-C 3.42Å; A51-N54 PolarHBondContact O-N 3.13Å; I52-N54 VanDerWaalsContact C-N 3.3Å; I52-N54 PolarHBondContact O-N 3.4Å; N54-H74 WeakPolarHBondContact CB-CE1 3.39Å; N54-H74 VanDerWaalsContact CB-ND1 3.33Å; N54-H74 WeakPolarHBondContact CB-ND1 3.21Å; N54-Q126 PolarHBondContact O-NE2 3.28Å
55	C	90.5	Very high	88.6	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.205	C	C	.	.			trans	-90.2	150.4	170.2	83.4	0	0	0	0	111.7	K36 A51 I52 Q53 I68 G69 I78 Q126	K36-C55 PolarHBondContact NZ-O 3.3Å; A51-C55 WeakPolarHBondContact O-CB 3.29Å; A51-C55 PolarHBondContact O-N 3.35Å; I52-C55 PolarHBondContact O-N 3.18Å; I52-C55 PolarHBondContact O-SG 3.08Å; Q53-C55 PolarHBondContact O-N 2.86Å; C55-I68 HydrophobicContact CB-CG2 3.51Å; C55-I68 VanDerWaalsContact SG-CG2 3.59Å; C55-G69 CarbonylContact C-O 3.54Å; C55-G69 VanDerWaalsContact CA-O 3.25Å; C55-G69 WeakPolarHBondContact CA-O 3.29Å; C55-G69 WeakPolarHBondContact CB-O 3.34Å; C55-I78 HydrophobicContact CB-CD1 4.06Å; C55-Q126 PolarHBondContact O-NE2 3.27Å
56	Y	89	Confident	88.9	Confident	21 Å²	21	39 Å²	39	8%	0.082	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	151.3	-179.8	53.2	-98.4	0	0	0	110.8	F32 I58 I68 G69 V146 S149	F32-Y56 VanDerWaalsContact CZ-C 3.5Å; Y56-I58 HydrophobicContact CD2-CG1 4.06Å; Y56-I58 HydrophobicContact CE2-CD1 4.31Å; Y56-I58 HydrophobicContact CE2-CG1 3.76Å; Y56-I68 WeakPolarHBondContact O-CA 3.37Å; Y56-G69 PolarHBondContact N-O 3.33Å; Y56-G69 PolarHBondContact O-N 2.77Å; Y56-V146 HydrophobicContact CD1-CG2 4.44Å; Y56-V146 HydrophobicContact CD2-CG1 4.4Å; Y56-V146 HydrophobicContact CE1-CG2 3.89Å; Y56-V146 HydrophobicContact CE2-CB 4.45Å; Y56-V146 HydrophobicContact CE2-CG1 3.78Å; Y56-V146 HydrophobicContact CE2-CG2 4.04Å; Y56-S149 PolarHBondContact OH-OG 3.24Å
57	L	89.9	Confident	89	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	118.9	177.1	-174.6	65.7	0	0	0	109.3	V28 F29 F32 G59 L66 M114	V28-L57 HydrophobicContact CG1-CD2 4.18Å; F29-L57 HydrophobicContact CB-CD2 4.32Å; F29-L57 HydrophobicContact CD2-CD2 4.28Å; F32-L57 HydrophobicContact CB-CD1 4.34Å; F32-L57 HydrophobicContact CB-CD2 3.93Å; F32-L57 HydrophobicContact CD1-CB 3.7Å; F32-L57 HydrophobicContact CD1-CD2 4.31Å; F32-L57 HydrophobicContact CD2-CB 4.05Å; F32-L57 HydrophobicContact CD2-CD1 4.09Å; F32-L57 HydrophobicContact CE1-CB 3.73Å; F32-L57 HydrophobicContact CE2-CB 4.07Å; F32-L57 HydrophobicContact CG-CB 3.85Å; F32-L57 HydrophobicContact CG-CD1 4.21Å; F32-L57 HydrophobicContact CG-CD2 4.12Å; F32-L57 HydrophobicContact CG-CG 4.3Å; F32-L57 HydrophobicContact CZ-CB 3.9Å; F32-L57 VanDerWaalsContact CZ-N 3.26Å; L57-G59 WeakPolarHBondContact CD1-O 3.45Å; L57-L66 HydrophobicContact CD1-CB 4.04Å; L57-L66 HydrophobicContact CD1-CD2 4.05Å; L57-L66 HydrophobicContact CD1-CG 4.48Å; L57-M114 HydrophobicContact CB-CG 4.24Å; L57-M114 HydrophobicContact CD2-CE 4.07Å; L57-M114 HydrophobicContact CD2-CG 3.99Å; L57-M114 HydrophobicContact CD2-SD 3.46Å; L57-M114 WeakPolarHBondContact CD2-SD 3.23Å; L57-M114 HydrophobicContact CG-CE 4.48Å; L57-M114 HydrophobicContact CG-CG 3.8Å; L57-M114 HydrophobicContact CG-SD 3.96Å; L57-M114 WeakPolarHBondContact O-CG 3.31Å
58	I	87.3	Confident	89	Confident	7 Å²	7	26.8 Å²	26.8	4%	0.036	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	-42.1	175.5	-67.6	164.6	0	0	0	110.3	C10 Y56 L67 G69 F111 M114 I150	C10-I58 HydrophobicContact CB-CD1 3.78Å; C10-I58 VanDerWaalsContact SG-CD1 3.51Å; Y56-I58 HydrophobicContact CD2-CG1 4.06Å; Y56-I58 HydrophobicContact CE2-CD1 4.31Å; Y56-I58 HydrophobicContact CE2-CG1 3.76Å; I58-L67 HydrophobicContact CB-CB 4.17Å; I58-L67 WeakPolarHBondContact CB-O 3.43Å; I58-L67 PolarHBondContact N-O 2.85Å; I58-G69 VanDerWaalsContact CD1-CA 3.49Å; I58-F111 HydrophobicContact CG2-CE2 4.05Å; I58-M114 PolarHBondContact O-N 2.92Å; I58-I150 HydrophobicContact CB-CD1 4.37Å; I58-I150 HydrophobicContact CD1-CD1 4.15Å; I58-I150 HydrophobicContact CD1-CG1 3.85Å; I58-I150 HydrophobicContact CG1-CD1 3.75Å; I58-I150 HydrophobicContact CG1-CG1 4.04Å; I58-I150 HydrophobicContact CG2-CD1 3.87Å; I58-I150 HydrophobicContact CG2-CG1 4.16Å; I58-I150 HydrophobicContact CG2-CG2 3.79Å
59	G	87.3	Confident	88.8	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.1	-167	-169.8	0	0	0	0	0	111.4	L57 L67 N112	L57-G59 WeakPolarHBondContact CD1-O 3.45Å; G59-L67 WeakPolarHBondContact O-CB 3.38Å; G59-L67 PolarHBondContact O-N 3.26Å; G59-N112 CarbonylContact C-O 3.58Å; G59-N112 WeakPolarHBondContact CA-O 3.19Å
60	H	88.6	Confident	88.7	Confident	13 Å²	13	26.8 Å²	26.8	6%	0.06	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	165	-176.9	62.2	-80.8	0	0	0	113.7	V28 E62 L65 F111 N112 M114	V28-H60 HydrophobicContact CB-CB 4.44Å; V28-H60 HydrophobicContact CG1-CB 3.4Å; V28-H60 HydrophobicContact CG2-CB 4.25Å; H60-E62 IonicContact CD2-OE1 2.73Å; H60-E62 IonicContact NE2-OE1 2.77Å; H60-L65 CarbonylContact C-O 3.58Å; H60-L65 WeakPolarHBondContact CA-O 3.11Å; H60-L65 VanDerWaalsContact CB-O 3.22Å; H60-L65 WeakPolarHBondContact CB-O 3.49Å; H60-F111 CarbonylContact O-C 3.58Å; H60-F111 WeakPolarHBondContact O-CA 3.44Å; H60-F111 WeakPolarHBondContact O-CB 3.5Å; H60-N112 WeakPolarHBondContact CE1-CB 3.02Å; H60-N112 PolarHBondContact N-O 2.81Å; H60-N112 PolarHBondContact ND1-O 2.83Å; H60-N112 WeakPolarHBondContact NE2-CB 3.42Å; H60-N112 PolarHBondContact NE2-ND2 2.76Å; H60-N112 PolarHBondContact O-N 3.43Å; H60-M114 VanDerWaalsContact ND1-CE 3.27Å; H60-M114 WeakPolarHBondContact ND1-CE 3.22Å
61	V	86.6	Confident	88.5	Confident	44 Å²	44	24.9 Å²	24.9	27%	0.267	14%	0.136	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.3	158.7	-172.3	0	0	0	0	108	Y64 L65 F105 F111	V61-Y64 PolarHBondContact O-N 3.48Å; V61-L65 HydrophobicContact CB-CB 4.11Å; V61-L65 HydrophobicContact CB-CD1 4.39Å; V61-L65 HydrophobicContact CG2-CD2 4.36Å; V61-L65 PolarHBondContact N-O 3.14Å; V61-L65 WeakPolarHBondContact O-CB 3.02Å; V61-L65 PolarHBondContact O-N 2.95Å; V61-F105 HydrophobicContact CG2-CZ 3.94Å; V61-F111 HydrophobicContact CG2-CB 3.97Å
62	E	81	Confident	88.2	Confident	89 Å²	89	26.5 Å²	26.5	42%	0.416	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	144.8	176.1	-75	-71.3	142.7	0	0	110.9	V28 H60	V28-E62 WeakPolarHBondContact CG2-OE1 3.29Å; H60-E62 IonicContact CD2-OE1 2.73Å; H60-E62 IonicContact NE2-OE1 2.77Å
63	P	74.9	Confident	88.1	Confident	81 Å²	81	29.7 Å²	29.7	53%	0.526	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	cis	-85.5	-29.3	4.8	32.6	-35.2	0	0	0	114.5
64	Y	87.1	Confident	88.3	Confident	57 Å²	57	29.5 Å²	29.5	22%	0.224	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-148.3	37.2	-164.9	-53	-61.2	0	0	0	114.7	F15 R17 L31 V61 F93	F15-Y64 PolarHBondContact N-O 3.01Å; F15-Y64 WeakPolarHBondContact O-CB 3.28Å; R17-Y64 HydrophobicContact CB-CE2 3.98Å; R17-Y64 WeakPolarHBondContact CD-OH 3.46Å; R17-Y64 PolarHBondContact NH1-OH 3.34Å; L31-Y64 HydrophobicContact CD2-CD1 4.42Å; V61-Y64 PolarHBondContact O-N 3.48Å; Y64-F93 AromaticContact CD1-CE1 3.59Å; Y64-F93 HydrophobicContact CD1-CE1 3.59Å; Y64-F93 HydrophobicContact CD1-CZ 4.21Å; Y64-F93 HydrophobicContact CD2-CE1 4.38Å; Y64-F93 AromaticContact CE1-CE1 3.61Å; Y64-F93 HydrophobicContact CE1-CE1 3.61Å; Y64-F93 AromaticContact CE1-CZ 3.95Å; Y64-F93 HydrophobicContact CE1-CZ 3.95Å; Y64-F93 HydrophobicContact CE2-CE1 4.41Å; Y64-F93 HydrophobicContact CG-CE1 4.01Å
65	L	91	Very high	88.5	Confident	37 Å²	37	26.8 Å²	26.8	19%	0.194	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	116.2	172	-173.3	165.8	0	0	0	109.8	A12 T14 H60 V61 L67	A12-L65 HydrophobicContact CB-CD2 4.04Å; A12-L65 HydrophobicContact CB-CG 4.48Å; T14-L65 HydrophobicContact CG2-CB 4.27Å; T14-L65 HydrophobicContact CG2-CD1 3.89Å; T14-L65 HydrophobicContact CG2-CG 3.87Å; H60-L65 CarbonylContact C-O 3.58Å; H60-L65 WeakPolarHBondContact CA-O 3.11Å; H60-L65 VanDerWaalsContact CB-O 3.22Å; H60-L65 WeakPolarHBondContact CB-O 3.49Å; V61-L65 HydrophobicContact CB-CB 4.11Å; V61-L65 HydrophobicContact CB-CD1 4.39Å; V61-L65 HydrophobicContact CG2-CD2 4.36Å; V61-L65 PolarHBondContact N-O 3.14Å; V61-L65 WeakPolarHBondContact O-CB 3.02Å; V61-L65 PolarHBondContact O-N 2.95Å; L65-L67 HydrophobicContact CD2-CD2 3.58Å; L65-L67 HydrophobicContact CD2-CG 3.9Å
66	L	93.1	Very high	88.6	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	133.5	174.6	-57.6	-173.2	0	0	0	110.8	A12 I13 F15 V28 L31 F32 L57 I68	A12-L66 WeakPolarHBondContact CA-O 3.22Å; I13-L66 PolarHBondContact N-O 3.37Å; I13-L66 PolarHBondContact O-N 3Å; F15-L66 HydrophobicContact CD2-CD1 4.45Å; F15-L66 HydrophobicContact CD2-CG 4.27Å; F15-L66 HydrophobicContact CE2-CB 4.32Å; F15-L66 HydrophobicContact CE2-CD1 3.59Å; F15-L66 HydrophobicContact CE2-CG 3.74Å; F15-L66 HydrophobicContact CZ-CD1 4.18Å; V28-L66 HydrophobicContact CG1-CD2 3.42Å; V28-L66 VanDerWaalsContact CG1-CD2 3.42Å; L31-L66 HydrophobicContact CD2-CD1 4.38Å; L31-L66 HydrophobicContact CD2-CD2 4.31Å; L31-L66 HydrophobicContact CD2-CG 4.35Å; L31-L66 HydrophobicContact CG-CD1 4.3Å; F32-L66 HydrophobicContact CB-CD1 3.85Å; F32-L66 HydrophobicContact CD2-CD1 4.17Å; L57-L66 HydrophobicContact CD1-CB 4.04Å; L57-L66 HydrophobicContact CD1-CD2 4.05Å; L57-L66 HydrophobicContact CD1-CG 4.48Å; L66-I68 HydrophobicContact CB-CD1 4.38Å; L66-I68 HydrophobicContact CB-CG1 4.21Å
67	L	91.4	Very high	88.9	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	114.1	171.3	-60.8	171.6	0	0	0	108.9	A12 I58 G59 L65 V101 F105 F111	A12-L67 HydrophobicContact CB-CD2 4.11Å; I58-L67 HydrophobicContact CB-CB 4.17Å; I58-L67 WeakPolarHBondContact CB-O 3.43Å; I58-L67 PolarHBondContact N-O 2.85Å; G59-L67 WeakPolarHBondContact O-CB 3.38Å; G59-L67 PolarHBondContact O-N 3.26Å; L65-L67 HydrophobicContact CD2-CD2 3.58Å; L65-L67 HydrophobicContact CD2-CG 3.9Å; L67-V101 HydrophobicContact CD2-CG2 3.91Å; L67-F105 HydrophobicContact CD1-CE1 4.12Å; L67-F105 HydrophobicContact CD2-CE1 3.98Å; L67-F111 HydrophobicContact CD1-CB 3.48Å; L67-F111 VanDerWaalsContact CD1-CB 3.48Å; L67-F111 HydrophobicContact CD1-CD1 4.16Å; L67-F111 HydrophobicContact CD1-CD2 3.48Å; L67-F111 VanDerWaalsContact CD1-CD2 3.48Å; L67-F111 HydrophobicContact CD1-CE2 4.23Å; L67-F111 HydrophobicContact CD1-CG 3.44Å; L67-F111 VanDerWaalsContact CD1-CG 3.44Å
68	I	92.1	Very high	89.1	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126.2	-170.5	-60.9	180	0	0	0	110.2	C10 L11 I13 F32 F35 C55 Y56 L66 L75	C10-I68 WeakPolarHBondContact CA-O 3.25Å; L11-I68 PolarHBondContact N-O 3.16Å; L11-I68 PolarHBondContact O-N 3.38Å; I13-I68 HydrophobicContact CD1-CD1 3.72Å; I13-I68 HydrophobicContact CG1-CD1 4.09Å; F32-I68 HydrophobicContact CD2-CD1 4.03Å; F32-I68 HydrophobicContact CD2-CG1 4.2Å; F32-I68 HydrophobicContact CE2-CD1 3.89Å; F32-I68 HydrophobicContact CE2-CG1 3.91Å; F32-I68 HydrophobicContact CE2-CG2 4.31Å; F35-I68 HydrophobicContact CD1-CD1 4.27Å; F35-I68 HydrophobicContact CE1-CD1 3.85Å; C55-I68 HydrophobicContact CB-CG2 3.51Å; C55-I68 VanDerWaalsContact SG-CG2 3.59Å; Y56-I68 WeakPolarHBondContact O-CA 3.37Å; L66-I68 HydrophobicContact CB-CD1 4.38Å; L66-I68 HydrophobicContact CB-CG1 4.21Å; I68-L75 HydrophobicContact CG2-CD2 4.31Å
69	G	89.4	Confident	89.5	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	165.8	174.9	0	0	0	0	0	112.7	C55 Y56 I58	C55-G69 CarbonylContact C-O 3.54Å; C55-G69 VanDerWaalsContact CA-O 3.25Å; C55-G69 WeakPolarHBondContact CA-O 3.29Å; C55-G69 WeakPolarHBondContact CB-O 3.34Å; Y56-G69 PolarHBondContact N-O 3.33Å; Y56-G69 PolarHBondContact O-N 2.77Å; I58-G69 VanDerWaalsContact CD1-CA 3.49Å
70	G	88.6	Confident	89.8	Confident	15 Å²	15	35.8 Å²	35.8	16%	0.155	21%	0.205	C	C	.	.			trans	166.5	-173.7	-178	0	0	0	0	0	111.1
71	S	87.5	Confident	90.1	Very high	54 Å²	54	35.3 Å²	35.3	38%	0.378	20%	0.202	S	C	.	.			trans	-67.3	146.7	167.2	78	0	0	0	0	109.4	A73 H74 L75	S71-A73 PolarHBondContact O-N 3.18Å; S71-A73 VanDerWaalsContact O-N 3.15Å; S71-H74 WeakPolarHBondContact O-CA 3.32Å; S71-H74 WeakPolarHBondContact O-CB 3.49Å; S71-H74 PolarHBondContact O-N 3.08Å; S71-H74 PolarHBondContact OG-CD2 3.49Å; S71-H74 PolarHBondContact OG-N 3.28Å; S71-H74 VanDerWaalsContact OG-N 3.16Å; S71-H74 PolarHBondContact OG-ND1 3.21Å; S71-L75 PolarHBondContact O-N 3.09Å
72	S	87.8	Confident	90.4	Very high	34 Å²	34	36.9 Å²	36.9	24%	0.238	20%	0.204	C	C	.	.	H	α-helix	trans	-58.3	-30.9	178.2	179.2	0	0	0	0	112.1	L75 Q76	S72-L75 PolarHBondContact O-N 2.82Å; S72-Q76 WeakPolarHBondContact O-CB 3.28Å; S72-Q76 PolarHBondContact O-N 3.46Å
73	A	90.7	Very high	91	Very high	67 Å²	67	37.4 Å²	37.4	55%	0.554	21%	0.21	S	C	*	.	H	α-helix	trans	-63.1	-40.1	172	0	0	0	0	0	112.9	S71 T77	S71-A73 PolarHBondContact O-N 3.18Å; S71-A73 VanDerWaalsContact O-N 3.15Å; A73-T77 WeakPolarHBondContact O-CB 3.37Å; A73-T77 PolarHBondContact O-N 2.93Å; A73-T77 PolarHBondContact O-OG1 2.86Å
74	H	92.4	Very high	91.8	Very high	42 Å²	42	41.2 Å²	41.2	19%	0.194	21%	0.213	C	C	.	.	H	α-helix	trans	-69.8	-46.4	175.1	-63.3	163.6	0	0	0	111.3	A51 N54 S71 Q76 T77 I78	A51-H74 HydrophobicContact CB-CB 3.8Å; N54-H74 WeakPolarHBondContact CB-CE1 3.39Å; N54-H74 VanDerWaalsContact CB-ND1 3.33Å; N54-H74 WeakPolarHBondContact CB-ND1 3.21Å; S71-H74 WeakPolarHBondContact O-CA 3.32Å; S71-H74 WeakPolarHBondContact O-CB 3.49Å; S71-H74 PolarHBondContact O-N 3.08Å; S71-H74 PolarHBondContact OG-CD2 3.49Å; S71-H74 PolarHBondContact OG-N 3.28Å; S71-H74 VanDerWaalsContact OG-N 3.16Å; S71-H74 PolarHBondContact OG-ND1 3.21Å; H74-Q76 PolarHBondContact O-N 3.05Å; H74-T77 WeakPolarHBondContact O-CB 3.49Å; H74-T77 PolarHBondContact O-N 3.29Å; H74-T77 VanDerWaalsContact O-N 3.08Å; H74-I78 WeakPolarHBondContact O-CG1 3.4Å; H74-I78 PolarHBondContact O-N 3.4Å
75	L	93.1	Very high	92	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.8	-44.1	178.9	-62.3	-178.2	0	0	0	111.7	K9 L11 I68 S71 S72 T77 I78 K79	K9-L75 WeakPolarHBondContact O-CD1 3.38Å; L11-L75 HydrophobicContact CB-CD2 3.99Å; I68-L75 HydrophobicContact CG2-CD2 4.31Å; S71-L75 PolarHBondContact O-N 3.09Å; S72-L75 PolarHBondContact O-N 2.82Å; L75-T77 VanDerWaalsContact C-N 3.3Å; L75-T77 PolarHBondContact O-N 3.25Å; L75-I78 PolarHBondContact O-N 3.23Å; L75-K79 WeakPolarHBondContact O-CB 3.28Å; L75-K79 PolarHBondContact O-N 3.34Å
76	Q	92.9	Very high	92.1	Very high	73 Å²	73	43.4 Å²	43.4	34%	0.341	24%	0.243	S	C	.	.	H	α-helix	trans	-63.7	-33.7	173.3	-175.6	62.5	12.5	0	0	112.3	S72 H74 L80	S72-Q76 WeakPolarHBondContact O-CB 3.28Å; S72-Q76 PolarHBondContact O-N 3.46Å; H74-Q76 PolarHBondContact O-N 3.05Å; Q76-L80 HydrophobicContact CG-CD1 4.02Å; Q76-L80 HydrophobicContact CG-CG 4.37Å; Q76-L80 VanDerWaalsContact O-CB 3.31Å; Q76-L80 WeakPolarHBondContact O-CB 3.4Å; Q76-L80 VanDerWaalsContact O-CG 3.25Å; Q76-L80 WeakPolarHBondContact O-CG 3.43Å; Q76-L80 PolarHBondContact O-N 2.96Å
77	T	94.1	Very high	92.1	Very high	36 Å²	36	43.9 Å²	43.9	22%	0.221	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-40.4	174.4	-62	0	0	0	0	111.8	W47 A51 A73 H74 L75 S81	W47-T77 HydrophobicContact CB-CG2 4.18Å; A51-T77 HydrophobicContact CB-CG2 3.97Å; A73-T77 WeakPolarHBondContact O-CB 3.37Å; A73-T77 PolarHBondContact O-N 2.93Å; A73-T77 PolarHBondContact O-OG1 2.86Å; H74-T77 WeakPolarHBondContact O-CB 3.49Å; H74-T77 PolarHBondContact O-N 3.29Å; H74-T77 VanDerWaalsContact O-N 3.08Å; L75-T77 VanDerWaalsContact C-N 3.3Å; L75-T77 PolarHBondContact O-N 3.25Å; T77-S81 VanDerWaalsContact O-CB 3.28Å; T77-S81 WeakPolarHBondContact O-CB 3.31Å; T77-S81 PolarHBondContact O-N 2.72Å; T77-S81 PolarHBondContact O-OG 2.94Å
78	I	94.9	Very high	92.2	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-48.1	175.1	-65.3	166.9	0	0	0	110	L11 I13 L48 A51 I52 C55 H74 L75 S81 W82 L87	L11-I78 HydrophobicContact CD2-CB 4.02Å; L11-I78 HydrophobicContact CD2-CG2 3.73Å; I13-I78 HydrophobicContact CD1-CG2 4.21Å; L48-I78 HydrophobicContact CD1-CG1 4.43Å; A51-I78 HydrophobicContact CB-CD1 4.49Å; A51-I78 HydrophobicContact CB-CG1 4.06Å; I52-I78 HydrophobicContact CD1-CD1 3.87Å; I52-I78 HydrophobicContact CD1-CG1 3.81Å; I52-I78 HydrophobicContact CD1-CG2 4.33Å; I52-I78 HydrophobicContact CG1-CD1 4.43Å; I52-I78 HydrophobicContact CG1-CG1 4.19Å; C55-I78 HydrophobicContact CB-CD1 4.06Å; H74-I78 WeakPolarHBondContact O-CG1 3.4Å; H74-I78 PolarHBondContact O-N 3.4Å; L75-I78 PolarHBondContact O-N 3.23Å; I78-S81 WeakPolarHBondContact O-CB 3.24Å; I78-S81 PolarHBondContact O-N 3.07Å; I78-S81 VanDerWaalsContact O-N 3.12Å; I78-W82 PolarHBondContact O-N 3.17Å; I78-L87 HydrophobicContact CG2-CD1 4.28Å; I78-L87 HydrophobicContact CG2-CD2 4.04Å
79	K	94.2	Very high	92.1	Very high	49 Å²	49	50.1 Å²	50.1	21%	0.213	28%	0.278	C	S	.	.	H	α-helix	trans	-58.5	-52.6	177.1	-175	-180	174.5	-174.3	0	112.4	L11 L75 S81 W82 D83 V98 D100	L11-K79 HydrophobicContact CD1-CB 4.33Å; L75-K79 WeakPolarHBondContact O-CB 3.28Å; L75-K79 PolarHBondContact O-N 3.34Å; K79-S81 PolarHBondContact O-N 3.03Å; K79-S81 VanDerWaalsContact O-N 3.16Å; K79-W82 WeakPolarHBondContact O-CA 3.3Å; K79-W82 WeakPolarHBondContact O-CB 3.45Å; K79-W82 PolarHBondContact O-N 2.72Å; K79-D83 VanDerWaalsContact O-CG 3.28Å; K79-D83 PolarHBondContact O-N 3.43Å; K79-V98 HydrophobicContact CB-CG1 4.43Å; K79-D100 IonicContact NZ-OD1 2.85Å; K79-D100 IonicContact NZ-OD2 3.9Å; K79-D100 PolarHBondContact NZ-OD2 2.97Å
80	L	93.8	Very high	92.1	Very high	60 Å²	60	50.4 Å²	50.4	31%	0.314	28%	0.279	S	S	.	.	H	α-helix	trans	-62.3	-23.2	175.8	-71.6	173.5	0	0	0	113.3	Q76 R84	Q76-L80 HydrophobicContact CG-CD1 4.02Å; Q76-L80 HydrophobicContact CG-CG 4.37Å; Q76-L80 VanDerWaalsContact O-CB 3.31Å; Q76-L80 WeakPolarHBondContact O-CB 3.4Å; Q76-L80 VanDerWaalsContact O-CG 3.25Å; Q76-L80 WeakPolarHBondContact O-CG 3.43Å; Q76-L80 PolarHBondContact O-N 2.96Å; L80-R84 WeakPolarHBondContact O-CB 3.39Å; L80-R84 WeakPolarHBondContact O-CD 3.22Å; L80-R84 WeakPolarHBondContact O-CG 3.29Å; L80-R84 PolarHBondContact O-N 2.71Å
81	S	94.5	Very high	91.8	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.014	29%	0.294	C	S	.	.	H	α-helix	trans	-80.5	-30.6	174.5	-60	0	0	0	0	112.3	T77 I78 K79 G85 Q86 L87	T77-S81 VanDerWaalsContact O-CB 3.28Å; T77-S81 WeakPolarHBondContact O-CB 3.31Å; T77-S81 PolarHBondContact O-N 2.72Å; T77-S81 PolarHBondContact O-OG 2.94Å; I78-S81 WeakPolarHBondContact O-CB 3.24Å; I78-S81 PolarHBondContact O-N 3.07Å; I78-S81 VanDerWaalsContact O-N 3.12Å; K79-S81 PolarHBondContact O-N 3.03Å; K79-S81 VanDerWaalsContact O-N 3.16Å; S81-G85 PolarHBondContact O-N 3.32Å; S81-Q86 WeakPolarHBondContact O-CA 3.45Å; S81-Q86 WeakPolarHBondContact O-CB 3.11Å; S81-Q86 PolarHBondContact O-N 3.16Å; S81-L87 PolarHBondContact O-N 3.29Å; S81-L87 VanDerWaalsContact O-N 3.12Å
82	W	94.5	Very high	91.6	Very high	78 Å²	78	53.3 Å²	53.3	30%	0.295	29%	0.288	S	S	.	.	H	α-helix	trans	-66.3	-50.1	167.2	171	-107.7	0	0	0	111.3	I78 K79 R84 G85 L87 I95 V98	I78-W82 PolarHBondContact O-N 3.17Å; K79-W82 WeakPolarHBondContact O-CA 3.3Å; K79-W82 WeakPolarHBondContact O-CB 3.45Å; K79-W82 PolarHBondContact O-N 2.72Å; W82-R84 PolarHBondContact O-N 3.39Å; W82-G85 PolarHBondContact O-N 3.28Å; W82-L87 HydrophobicContact CB-CB 4.28Å; W82-L87 HydrophobicContact CB-CD2 3.97Å; W82-L87 HydrophobicContact CE3-CB 4.45Å; W82-I95 HydrophobicContact CD2-CG2 4.06Å; W82-I95 HydrophobicContact CE3-CB 4.12Å; W82-I95 HydrophobicContact CE3-CD1 4.32Å; W82-I95 HydrophobicContact CE3-CG2 3.7Å; W82-I95 HydrophobicContact CH2-CB 3.83Å; W82-I95 HydrophobicContact CH2-CG2 3.64Å; W82-I95 WeakPolarHBondContact CH2-O 3.4Å; W82-I95 HydrophobicContact CZ2-CG2 3.99Å; W82-I95 HydrophobicContact CZ3-CB 3.54Å; W82-I95 HydrophobicContact CZ3-CD1 4.29Å; W82-I95 HydrophobicContact CZ3-CG2 3.5Å; W82-V98 HydrophobicContact CB-CB 4.05Å; W82-V98 HydrophobicContact CB-CG1 4.42Å; W82-V98 HydrophobicContact CB-CG2 3.78Å; W82-V98 HydrophobicContact CD2-CB 4.44Å; W82-V98 HydrophobicContact CD2-CG2 3.79Å; W82-V98 HydrophobicContact CE3-CG2 4.44Å; W82-V98 HydrophobicContact CG-CB 3.73Å; W82-V98 HydrophobicContact CG-CG2 3.46Å; W82-V98 VanDerWaalsContact CG-CG2 3.46Å
83	D	92.9	Very high	91.7	Very high	100 Å²	100	52 Å²	52	54%	0.535	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-20	179.2	-59.8	-26.2	0	0	0	113.2	K79	K79-D83 VanDerWaalsContact O-CG 3.28Å; K79-D83 PolarHBondContact O-N 3.43Å
84	R	92.6	Very high	91.7	Very high	161 Å²	161	50 Å²	50	61%	0.608	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	4	177.7	-68.4	171.3	-175.8	166.5	-0.1	114.3	L80 W82 Q86	L80-R84 WeakPolarHBondContact O-CB 3.39Å; L80-R84 WeakPolarHBondContact O-CD 3.22Å; L80-R84 WeakPolarHBondContact O-CG 3.29Å; L80-R84 PolarHBondContact O-N 2.71Å; W82-R84 PolarHBondContact O-N 3.39Å; R84-Q86 HydrophobicContact CB-CG 4.07Å; R84-Q86 PolarHBondContact O-N 3.31Å
85	G	91.5	Very high	91.9	Very high	67 Å²	67	48.6 Å²	48.6	69%	0.691	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	18.5	-176.3	0	0	0	0	0	114.8	S81 W82	S81-G85 PolarHBondContact O-N 3.32Å; W82-G85 PolarHBondContact O-N 3.28Å
86	Q	92.4	Very high	91.8	Very high	73 Å²	73	53.1 Å²	53.1	34%	0.341	28%	0.278	S	S	.	.			trans	-85.6	-26.6	178.2	-63.4	-172.7	-11.4	0	0	112.3	Q43 N45 L48 S81 R84 K88	Q43-Q86 PolarHBondContact NE2-O 3.25Å; N45-Q86 PolarHBondContact ND2-OE1 3.15Å; L48-Q86 HydrophobicContact CD2-CB 4.42Å; S81-Q86 WeakPolarHBondContact O-CA 3.45Å; S81-Q86 WeakPolarHBondContact O-CB 3.11Å; S81-Q86 PolarHBondContact O-N 3.16Å; R84-Q86 HydrophobicContact CB-CG 4.07Å; R84-Q86 PolarHBondContact O-N 3.31Å; Q86-K88 PolarHBondContact O-N 3.01Å
87	L	93.6	Very high	91.8	Very high	10 Å²	10	51.7 Å²	51.7	5%	0.052	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-75.8	122	-179.2	-168	70.4	0	0	0	111.1	I13 F35 L48 I52 I78 S81 W82 I95 V98	I13-L87 HydrophobicContact CD1-CD2 4.46Å; F35-L87 HydrophobicContact CE2-CD1 3.85Å; F35-L87 HydrophobicContact CE2-CD2 4Å; F35-L87 HydrophobicContact CE2-CG 3.95Å; F35-L87 HydrophobicContact CZ-CD1 3.85Å; F35-L87 HydrophobicContact CZ-CD2 4.1Å; F35-L87 HydrophobicContact CZ-CG 4.29Å; L48-L87 HydrophobicContact CD1-CD1 3.98Å; I52-L87 HydrophobicContact CD1-CD1 3.98Å; I78-L87 HydrophobicContact CG2-CD1 4.28Å; I78-L87 HydrophobicContact CG2-CD2 4.04Å; S81-L87 PolarHBondContact O-N 3.29Å; S81-L87 VanDerWaalsContact O-N 3.12Å; W82-L87 HydrophobicContact CB-CB 4.28Å; W82-L87 HydrophobicContact CB-CD2 3.97Å; W82-L87 HydrophobicContact CE3-CB 4.45Å; L87-I95 HydrophobicContact CD2-CD1 3.92Å; L87-I95 HydrophobicContact CG-CD1 3.94Å; L87-V98 HydrophobicContact CD2-CG2 4.16Å
88	K	92.3	Very high	91.9	Very high	88 Å²	88	50.6 Å²	50.6	38%	0.383	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-93.7	144.6	-176.7	-66.7	174.9	178.4	-179.8	0	111.2	I38 N39 H42 Q86	I38-K88 HydrophobicContact CG2-CB 3.73Å; I38-K88 HydrophobicContact CG2-CD 4.24Å; N39-K88 PolarHBondContact ND2-O 2.98Å; N39-K88 PolarHBondContact OD1-N 2.94Å; H42-K88 HydrophobicContact CB-CD 4.49Å; H42-K88 PolarHBondContact O-NZ 2.84Å; Q86-K88 PolarHBondContact O-N 3.01Å
89	S	90.9	Very high	91.7	Very high	44 Å²	44	53.1 Å²	53.1	31%	0.308	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-89	157.4	175.3	58.8	0	0	0	0	112.6	F93	S89-F93 WeakPolarHBondContact CB-O 3.36Å; S89-F93 PolarHBondContact OG-O 3.29Å
90	P	89.4	Confident	91.5	Very high	5 Å²	5	53.5 Å²	53.5	3%	0.032	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-61.7	150.6	169.8	-26	36.8	0	0	0	113.7	F15 L31 F35 I38 G92 F93	F15-P90 HydrophobicContact CD1-CG 4.43Å; F15-P90 VanDerWaalsContact CE1-CD 3.42Å; F15-P90 HydrophobicContact CE1-CG 4.02Å; L31-P90 HydrophobicContact CD1-CB 3.98Å; L31-P90 HydrophobicContact CD1-CG 3.78Å; F35-P90 HydrophobicContact CB-CG 3.86Å; I38-P90 HydrophobicContact CD1-CB 4.46Å; P90-G92 PolarHBondContact O-N 2.89Å; P90-F93 HydrophobicContact CB-CB 4.41Å; P90-F93 HydrophobicContact CB-CD2 4.09Å; P90-F93 PolarHBondContact O-N 3.26Å; P90-F93 VanDerWaalsContact O-O 3.05Å
91	F	81.3	Confident	91	Very high	107 Å²	107	51.5 Å²	51.5	47%	0.469	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	130.7	172.8	-68.1	-80.4	0	0	0	110.9	I38 F93 L274 L278	I38-F91 HydrophobicContact CD1-CD2 3.65Å; I38-F91 HydrophobicContact CD1-CE2 3.79Å; I38-F91 HydrophobicContact CG1-CD2 4.49Å; I38-F91 HydrophobicContact CG1-CE2 4.17Å; F91-F93 VanDerWaalsContact C-N 3.34Å; F91-F93 WeakPolarHBondContact O-CD2 3.45Å; F91-L274 HydrophobicContact CD2-CD2 4.08Å; F91-L274 HydrophobicContact CE2-CD1 3.69Å; F91-L274 HydrophobicContact CE2-CD2 3.99Å; F91-L274 HydrophobicContact CE2-CG 4.3Å; F91-L274 HydrophobicContact CZ-CD1 3.94Å; F91-L278 HydrophobicContact CB-CD1 4.09Å
92	G	84.2	Confident	89.9	Confident	24 Å²	24	52.9 Å²	52.9	25%	0.247	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.1	-2.8	-173.9	0	0	0	0	0	115.4	R17 Q18 P90	R17-G92 CarbonylContact C-O 3.54Å; R17-G92 WeakPolarHBondContact CA-O 3.42Å; Q18-G92 PolarHBondContact N-O 2.97Å; P90-G92 PolarHBondContact O-N 2.89Å
93	F	89.6	Confident	88.7	Confident	7 Å²	7	50.9 Å²	50.9	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	147.6	-178.1	-64.5	-92.4	0	0	0	113.1	F15 C16 R17 L26 L31 Y64 S89 P90 F91	F15-F93 HydrophobicContact CB-CB 4.38Å; F15-F93 HydrophobicContact CB-CD1 3.96Å; F15-F93 HydrophobicContact CD1-CB 4.34Å; C16-F93 CarbonylContact O-C 3.52Å; C16-F93 WeakPolarHBondContact O-CA 3.28Å; R17-F93 HydrophobicContact CB-CD1 4.11Å; R17-F93 HydrophobicContact CB-CE1 3.89Å; R17-F93 HydrophobicContact CG-CE1 4.25Å; L26-F93 HydrophobicContact CD1-CE2 4.25Å; L31-F93 HydrophobicContact CD1-CD1 4.21Å; L31-F93 HydrophobicContact CD1-CD2 3.66Å; L31-F93 HydrophobicContact CD1-CE1 4.18Å; L31-F93 HydrophobicContact CD1-CE2 3.63Å; L31-F93 HydrophobicContact CD1-CG 3.96Å; L31-F93 HydrophobicContact CD1-CZ 3.9Å; Y64-F93 AromaticContact CD1-CE1 3.59Å; Y64-F93 HydrophobicContact CD1-CE1 3.59Å; Y64-F93 HydrophobicContact CD1-CZ 4.21Å; Y64-F93 HydrophobicContact CD2-CE1 4.38Å; Y64-F93 AromaticContact CE1-CE1 3.61Å; Y64-F93 HydrophobicContact CE1-CE1 3.61Å; Y64-F93 AromaticContact CE1-CZ 3.95Å; Y64-F93 HydrophobicContact CE1-CZ 3.95Å; Y64-F93 HydrophobicContact CE2-CE1 4.41Å; Y64-F93 HydrophobicContact CG-CE1 4.01Å; S89-F93 WeakPolarHBondContact CB-O 3.36Å; S89-F93 PolarHBondContact OG-O 3.29Å; P90-F93 HydrophobicContact CB-CB 4.41Å; P90-F93 HydrophobicContact CB-CD2 4.09Å; P90-F93 PolarHBondContact O-N 3.26Å; P90-F93 VanDerWaalsContact O-O 3.05Å; F91-F93 VanDerWaalsContact C-N 3.34Å; F91-F93 WeakPolarHBondContact O-CD2 3.45Å
94	S	91.6	Very high	87.3	Confident	25 Å²	25	54 Å²	54	18%	0.175	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	151.5	155.1	53.9	0	0	0	0	109.9	F15 C16 N96	F15-S94 CarbonylContact C-O 3.54Å; F15-S94 WeakPolarHBondContact CA-O 3.38Å; F15-S94 WeakPolarHBondContact CB-O 3.34Å; C16-S94 PolarHBondContact N-O 3.3Å; C16-S94 PolarHBondContact O-N 3.36Å; C16-S94 PolarHBondContact O-OG 3.32Å; S94-N96 PolarHBondContact OG-OD1 3.36Å
95	I	94.6	Very high	86.2	Confident	12 Å²	12	48 Å²	48	6%	0.062	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	133.5	157.4	-66.4	156.7	0	0	0	106.7	I13 F15 F35 W82 L87 V98	I13-I95 HydrophobicContact CG2-CG1 4.26Å; I13-I95 HydrophobicContact CG2-CG2 3.95Å; F15-I95 HydrophobicContact CD1-CG1 3.71Å; F15-I95 HydrophobicContact CE1-CD1 4.23Å; F15-I95 HydrophobicContact CE1-CG1 3.4Å; F15-I95 VanDerWaalsContact CE1-CG1 3.4Å; F15-I95 HydrophobicContact CZ-CG1 4.26Å; F35-I95 HydrophobicContact CE2-CD1 4.13Å; W82-I95 HydrophobicContact CD2-CG2 4.06Å; W82-I95 HydrophobicContact CE3-CB 4.12Å; W82-I95 HydrophobicContact CE3-CD1 4.32Å; W82-I95 HydrophobicContact CE3-CG2 3.7Å; W82-I95 HydrophobicContact CH2-CB 3.83Å; W82-I95 HydrophobicContact CH2-CG2 3.64Å; W82-I95 WeakPolarHBondContact CH2-O 3.4Å; W82-I95 HydrophobicContact CZ2-CG2 3.99Å; W82-I95 HydrophobicContact CZ3-CB 3.54Å; W82-I95 HydrophobicContact CZ3-CD1 4.29Å; W82-I95 HydrophobicContact CZ3-CG2 3.5Å; L87-I95 HydrophobicContact CD2-CD1 3.92Å; L87-I95 HydrophobicContact CG-CD1 3.94Å; I95-V98 HydrophobicContact CG2-CG2 3.81Å
96	N	92.4	Very high	85	Confident	94 Å²	94	45.4 Å²	45.4	50%	0.503	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	-40.6	-178.7	-84.7	36.8	0	0	0	111.9	T14 C16 S94	T14-N96 PolarHBondContact O-N 3.27Å; T14-N96 WeakPolarHBondContact OG1-CB 3.28Å; C16-N96 WeakPolarHBondContact CB-ND2 3.2Å; C16-N96 WeakPolarHBondContact CB-OD1 3.41Å; C16-N96 PolarHBondContact N-OD1 3Å; S94-N96 PolarHBondContact OG-OD1 3.36Å
97	S	93.2	Very high	83.5	Confident	43 Å²	43	47.5 Å²	47.5	30%	0.301	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	152.5	173.6	69.3	0	0	0	0	111.5	I13 T14	I13-S97 WeakPolarHBondContact CA-O 3.45Å; T14-S97 WeakPolarHBondContact CG2-OG 3.36Å; T14-S97 PolarHBondContact N-O 2.79Å; T14-S97 PolarHBondContact OG1-N 2.95Å; T14-S97 PolarHBondContact OG1-OG 3.06Å
98	V	95	Very high	82	Confident	14 Å²	14	50.2 Å²	50.2	9%	0.085	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	118.2	167.8	177.9	0	0	0	0	106.5	L11 A12 I13 K79 W82 L87 I95	L11-V98 HydrophobicContact CD1-CG1 3.85Å; L11-V98 HydrophobicContact CD2-CG1 3.66Å; L11-V98 HydrophobicContact CG-CG1 3.82Å; A12-V98 WeakPolarHBondContact O-CA 3.33Å; I13-V98 HydrophobicContact CD1-CG2 4.35Å; I13-V98 HydrophobicContact CG1-CG1 4.34Å; I13-V98 HydrophobicContact CG1-CG2 4.14Å; I13-V98 HydrophobicContact CG2-CG2 4.1Å; K79-V98 HydrophobicContact CB-CG1 4.43Å; W82-V98 HydrophobicContact CB-CB 4.05Å; W82-V98 HydrophobicContact CB-CG1 4.42Å; W82-V98 HydrophobicContact CB-CG2 3.78Å; W82-V98 HydrophobicContact CD2-CB 4.44Å; W82-V98 HydrophobicContact CD2-CG2 3.79Å; W82-V98 HydrophobicContact CE3-CG2 4.44Å; W82-V98 HydrophobicContact CG-CB 3.73Å; W82-V98 HydrophobicContact CG-CG2 3.46Å; W82-V98 VanDerWaalsContact CG-CG2 3.46Å; L87-V98 HydrophobicContact CD2-CG2 4.16Å; I95-V98 HydrophobicContact CG2-CG2 3.81Å
99	S	91.2	Very high	80.5	Confident	53 Å²	53	50.7 Å²	50.7	37%	0.371	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	141.4	-171.1	53.4	0	0	0	0	111.9	A12	A12-S99 PolarHBondContact N-O 3.33Å; A12-S99 PolarHBondContact O-N 3.14Å
100	D	90.1	Very high	79.6	Confident	56 Å²	56	54.4 Å²	54.4	30%	0.299	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	140.7	176.4	-46.7	-71.6	0	0	0	110.8	T8 K79	T8-D100 HydrophobicContact CG2-CB 3.67Å; T8-D100 VanDerWaalsContact CG2-CG 3.48Å; T8-D100 WeakPolarHBondContact CG2-OD1 3.41Å; K79-D100 IonicContact NZ-OD1 2.85Å; K79-D100 IonicContact NZ-OD2 3.9Å; K79-D100 PolarHBondContact NZ-OD2 2.97Å
101	V	83.3	Confident	79	Confident	18 Å²	18	55.1 Å²	55.1	11%	0.109	30%	0.304	C	S	.	.			trans	-95	114	179.2	-177.9	0	0	0	0	108.9	C10 A12 L67 F105 L106	C10-V101 HydrophobicContact CB-CB 3.96Å; C10-V101 HydrophobicContact CB-CG2 4.33Å; C10-V101 PolarHBondContact O-N 2.96Å; A12-V101 HydrophobicContact CB-CG2 3.63Å; L67-V101 HydrophobicContact CD2-CG2 3.91Å; V101-F105 HydrophobicContact CG1-CB 3.82Å; V101-F105 HydrophobicContact CG1-CD1 3.56Å; V101-F105 HydrophobicContact CG1-CG 4.02Å; V101-L106 HydrophobicContact CG1-CD1 4.45Å; V101-L106 HydrophobicContact CG1-CD2 4Å; V101-L106 HydrophobicContact CG1-CG 3.93Å
102	G	72.4	Confident	79	Confident	31 Å²	31	53.9 Å²	53.9	32%	0.32	30%	0.302	S	S	.	.			trans	-69.7	147.4	173	0	0	0	0	0	111.7	W104 F105	G102-W104 PolarHBondContact O-N 3.15Å; G102-W104 VanDerWaalsContact O-N 3.11Å; G102-F105 WeakPolarHBondContact O-CB 3.12Å; G102-F105 PolarHBondContact O-N 3.39Å
103	S	67.9	Low	78.9	Confident	37 Å²	37	55.5 Å²	55.5	26%	0.259	31%	0.313	S	S	.	.	H	α-helix	trans	-47.4	-42.8	-176.9	-51.6	0	0	0	0	113.7	F105 L106 E107	S103-F105 PolarHBondContact O-N 2.84Å; S103-F105 VanDerWaalsContact O-N 3.12Å; S103-L106 PolarHBondContact O-N 3.13Å; S103-E107 WeakPolarHBondContact CB-OE1 3.38Å; S103-E107 WeakPolarHBondContact O-CG 3.27Å; S103-E107 PolarHBondContact O-N 2.88Å; S103-E107 VanDerWaalsContact O-N 3.13Å
104	W	64.3	Low	78.6	Confident	166 Å²	166	55.9 Å²	55.9	63%	0.629	32%	0.315	S	S	*	.	H	α-helix	trans	-53.1	-32.7	177.7	67.7	-95.7	0	0	0	114.2	G102 T108	G102-W104 PolarHBondContact O-N 3.15Å; G102-W104 VanDerWaalsContact O-N 3.11Å; W104-T108 VanDerWaalsContact O-CG2 3.31Å; W104-T108 WeakPolarHBondContact O-CG2 3.44Å; W104-T108 PolarHBondContact O-N 3.14Å; W104-T108 VanDerWaalsContact O-N 3.15Å; W104-T108 PolarHBondContact O-OG1 3.42Å
105	F	68.7	Low	78.2	Confident	34 Å²	34	60.7 Å²	60.7	15%	0.149	33%	0.329	C	S	.	.	H	α-helix	trans	-72.6	-37.4	-179	-178.9	-92	0	0	0	111.2	V61 L67 V101 G102 S103 T108 F111	V61-F105 HydrophobicContact CG2-CZ 3.94Å; L67-F105 HydrophobicContact CD1-CE1 4.12Å; L67-F105 HydrophobicContact CD2-CE1 3.98Å; V101-F105 HydrophobicContact CG1-CB 3.82Å; V101-F105 HydrophobicContact CG1-CD1 3.56Å; V101-F105 HydrophobicContact CG1-CG 4.02Å; G102-F105 WeakPolarHBondContact O-CB 3.12Å; G102-F105 PolarHBondContact O-N 3.39Å; S103-F105 PolarHBondContact O-N 2.84Å; S103-F105 VanDerWaalsContact O-N 3.12Å; F105-T108 PolarHBondContact O-OG1 3.25Å; F105-F111 HydrophobicContact CE1-CB 4.44Å
106	L	66.8	Low	77.9	Confident	13 Å²	13	61.2 Å²	61.2	7%	0.068	33%	0.332	C	S	.	.	H	α-helix	trans	-71.2	-35.8	177	-58.9	171.5	0	0	0	110.9	C10 V101 S103 F111 I150	C10-L106 HydrophobicContact CB-CD1 4.32Å; V101-L106 HydrophobicContact CG1-CD1 4.45Å; V101-L106 HydrophobicContact CG1-CD2 4Å; V101-L106 HydrophobicContact CG1-CG 3.93Å; S103-L106 PolarHBondContact O-N 3.13Å; L106-F111 HydrophobicContact CB-CE1 4.43Å; L106-F111 HydrophobicContact CD2-CD1 4.48Å; L106-F111 HydrophobicContact CD2-CE1 3.96Å; L106-F111 HydrophobicContact CD2-CZ 4.22Å; L106-I150 HydrophobicContact CD1-CG2 3.99Å; L106-I150 HydrophobicContact CD2-CG2 4.04Å; L106-I150 HydrophobicContact CG-CG2 4.43Å
107	E	62	Low	77.7	Confident	116 Å²	116	57.9 Å²	57.9	54%	0.542	31%	0.313	S	S	.	.	H	α-helix	trans	-65.9	-35.7	176.3	-69.1	156.7	-149.6	0	0	112.9	S103 S109 Q151	S103-E107 WeakPolarHBondContact CB-OE1 3.38Å; S103-E107 WeakPolarHBondContact O-CG 3.27Å; S103-E107 PolarHBondContact O-N 2.88Å; S103-E107 VanDerWaalsContact O-N 3.13Å; E107-S109 PolarHBondContact O-N 3.28Å; E107-S109 VanDerWaalsContact O-N 3.13Å; E107-Q151 PolarHBondContact OE1-NE2 2.88Å
108	T	61.4	Low	77.3	Confident	67 Å²	67	56.6 Å²	56.6	41%	0.411	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	0.5	-176	51.8	0	0	0	0	115.2	W104 F105 Q110	W104-T108 VanDerWaalsContact O-CG2 3.31Å; W104-T108 WeakPolarHBondContact O-CG2 3.44Å; W104-T108 PolarHBondContact O-N 3.14Å; W104-T108 VanDerWaalsContact O-N 3.15Å; W104-T108 PolarHBondContact O-OG1 3.42Å; F105-T108 PolarHBondContact O-OG1 3.25Å; T108-Q110 PolarHBondContact O-N 3.34Å
109	S	61.1	Low	77	Confident	98 Å²	98	56.3 Å²	56.3	69%	0.685	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	22.3	175.9	-55.6	0	0	0	0	115.3	E107 F111	E107-S109 PolarHBondContact O-N 3.28Å; E107-S109 VanDerWaalsContact O-N 3.13Å; S109-F111 PolarHBondContact O-N 3.14Å; S109-F111 VanDerWaalsContact O-N 3.16Å
110	Q	72.1	Confident	77	Confident	123 Å²	123	53.8 Å²	53.8	58%	0.575	28%	0.283	S	S	*	.			trans	-78.8	10.6	-177.3	-63.2	-175.9	8	0	0	113.9	T108	T108-Q110 PolarHBondContact O-N 3.34Å
111	F	77.2	Confident	76.9	Confident	20 Å²	20	51.3 Å²	51.3	9%	0.088	27%	0.27	C	S	.	.	S	Bend	trans	-130.6	146.3	-174.7	77	-86.3	0	0	0	112.3	I58 H60 V61 L67 F105 L106 S109 A113 L152	I58-F111 HydrophobicContact CG2-CE2 4.05Å; H60-F111 CarbonylContact O-C 3.58Å; H60-F111 WeakPolarHBondContact O-CA 3.44Å; H60-F111 WeakPolarHBondContact O-CB 3.5Å; V61-F111 HydrophobicContact CG2-CB 3.97Å; L67-F111 HydrophobicContact CD1-CB 3.48Å; L67-F111 VanDerWaalsContact CD1-CB 3.48Å; L67-F111 HydrophobicContact CD1-CD1 4.16Å; L67-F111 HydrophobicContact CD1-CD2 3.48Å; L67-F111 VanDerWaalsContact CD1-CD2 3.48Å; L67-F111 HydrophobicContact CD1-CE2 4.23Å; L67-F111 HydrophobicContact CD1-CG 3.44Å; L67-F111 VanDerWaalsContact CD1-CG 3.44Å; F105-F111 HydrophobicContact CE1-CB 4.44Å; L106-F111 HydrophobicContact CB-CE1 4.43Å; L106-F111 HydrophobicContact CD2-CD1 4.48Å; L106-F111 HydrophobicContact CD2-CE1 3.96Å; L106-F111 HydrophobicContact CD2-CZ 4.22Å; S109-F111 PolarHBondContact O-N 3.14Å; S109-F111 VanDerWaalsContact O-N 3.16Å; F111-A113 HydrophobicContact CD2-CB 4.43Å; F111-A113 HydrophobicContact CE2-CB 3.84Å; F111-A113 PolarHBondContact O-N 3.15Å; F111-L152 HydrophobicContact CZ-CD1 4.4Å; F111-L152 HydrophobicContact CZ-CD2 4.32Å
112	N	81	Confident	77.1	Confident	81 Å²	81	51 Å²	51	43%	0.433	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	103.3	172.5	-68.5	-22.9	0	0	0	108.8	G59 H60	G59-N112 CarbonylContact C-O 3.58Å; G59-N112 WeakPolarHBondContact CA-O 3.19Å; H60-N112 WeakPolarHBondContact CE1-CB 3.02Å; H60-N112 PolarHBondContact N-O 2.81Å; H60-N112 PolarHBondContact ND1-O 2.83Å; H60-N112 WeakPolarHBondContact NE2-CB 3.42Å; H60-N112 PolarHBondContact NE2-ND2 2.76Å; H60-N112 PolarHBondContact O-N 3.43Å
113	A	82	Confident	77.9	Confident	57 Å²	57	49.9 Å²	49.9	47%	0.471	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	150.2	173.6	0	0	0	0	0	111.8	F111	F111-A113 HydrophobicContact CD2-CB 4.43Å; F111-A113 HydrophobicContact CE2-CB 3.84Å; F111-A113 PolarHBondContact O-N 3.15Å
114	M	83.3	Confident	79	Confident	16 Å²	16	48.1 Å²	48.1	8%	0.079	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-68.4	149.8	170.1	-71.2	-61.6	99	0	0	111.2	V28 L57 I58 H60 V119	V28-M114 HydrophobicContact CG1-CE 4.49Å; L57-M114 HydrophobicContact CB-CG 4.24Å; L57-M114 HydrophobicContact CD2-CE 4.07Å; L57-M114 HydrophobicContact CD2-CG 3.99Å; L57-M114 HydrophobicContact CD2-SD 3.46Å; L57-M114 WeakPolarHBondContact CD2-SD 3.23Å; L57-M114 HydrophobicContact CG-CE 4.48Å; L57-M114 HydrophobicContact CG-CG 3.8Å; L57-M114 HydrophobicContact CG-SD 3.96Å; L57-M114 WeakPolarHBondContact O-CG 3.31Å; I58-M114 PolarHBondContact O-N 2.92Å; H60-M114 VanDerWaalsContact ND1-CE 3.27Å; H60-M114 WeakPolarHBondContact ND1-CE 3.22Å; M114-V119 HydrophobicContact CB-CG2 3.89Å
115	R	83.5	Confident	80	Confident	125 Å²	125	41 Å²	41	47%	0.472	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-68	149.5	175.8	-63.3	-178.8	59.2	131.4	4.1	110.7	E117 E118 V119	R115-E117 IonicContact CZ-OE2 3.86Å; R115-E117 VanDerWaalsContact CZ-OE2 3.29Å; R115-E117 IonicContact NE-OE2 2.64Å; R115-E117 PolarHBondContact NE-OE2 3.12Å; R115-E117 IonicContact NH2-OE2 3.55Å; R115-E117 PolarHBondContact NH2-OE2 3.44Å; R115-E117 PolarHBondContact O-N 2.9Å; R115-E118 HydrophobicContact CB-CG 4.23Å; R115-E118 PolarHBondContact N-OE2 3.26Å; R115-E118 WeakPolarHBondContact O-CA 3.4Å; R115-E118 WeakPolarHBondContact O-CB 3.25Å; R115-E118 PolarHBondContact O-N 3.03Å; R115-V119 PolarHBondContact O-N 2.95Å
116	L	88.1	Confident	80.8	Confident	24 Å²	24	40.9 Å²	40.9	13%	0.126	22%	0.215	C	C	.	.	H	α-helix	trans	-55.9	-37.1	177.2	-177.8	57.3	0	0	0	111.6	E118 V119 I120 L143 P155 D159 V160	L116-E118 VanDerWaalsContact C-N 3.33Å; L116-E118 PolarHBondContact O-N 2.86Å; L116-V119 PolarHBondContact O-N 3.07Å; L116-I120 HydrophobicContact CD1-CD1 4.04Å; L116-I120 HydrophobicContact CD1-CG1 4.1Å; L116-I120 HydrophobicContact CG-CD1 3.81Å; L116-I120 HydrophobicContact CG-CG1 4.34Å; L116-I120 WeakPolarHBondContact O-CB 3.35Å; L116-I120 VanDerWaalsContact O-CG1 3.27Å; L116-I120 WeakPolarHBondContact O-CG1 3.46Å; L116-I120 PolarHBondContact O-N 3.46Å; L116-L143 HydrophobicContact CD1-CD1 4.28Å; L116-L143 HydrophobicContact CD1-CD2 3.87Å; L116-P155 HydrophobicContact CD1-CB 4.06Å; L116-P155 HydrophobicContact CD1-CG 3.91Å; L116-P155 HydrophobicContact CD2-CB 3.78Å; L116-P155 HydrophobicContact CD2-CG 4.49Å; L116-D159 HydrophobicContact CD2-CB 3.85Å; L116-V160 HydrophobicContact CD2-CG2 4.35Å
117	E	88	Confident	81.8	Confident	23 Å²	23	40.5 Å²	40.5	11%	0.107	21%	0.213	C	C	.	.	H	α-helix	trans	-54.9	-43	171.1	-66.8	80.5	-123.7	0	0	113.5	R115 C121 S163 V166 L167	R115-E117 IonicContact CZ-OE2 3.86Å; R115-E117 VanDerWaalsContact CZ-OE2 3.29Å; R115-E117 IonicContact NE-OE2 2.64Å; R115-E117 PolarHBondContact NE-OE2 3.12Å; R115-E117 IonicContact NH2-OE2 3.55Å; R115-E117 PolarHBondContact NH2-OE2 3.44Å; R115-E117 PolarHBondContact O-N 2.9Å; E117-C121 PolarHBondContact O-N 3.25Å; E117-C121 VanDerWaalsContact O-N 3.16Å; E117-S163 WeakPolarHBondContact OE1-CB 3.25Å; E117-S163 PolarHBondContact OE1-OG 3.06Å; E117-V166 HydrophobicContact CG-CG1 3.93Å; E117-L167 HydrophobicContact CB-CD1 4.41Å; E117-L167 HydrophobicContact CB-CD2 3.98Å; E117-L167 HydrophobicContact CB-CG 4.2Å; E117-L167 HydrophobicContact CG-CD2 4.36Å; E117-L167 HydrophobicContact CG-CG 4.22Å
118	E	84.5	Confident	83	Confident	17 Å²	17	36.1 Å²	36.1	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-78.4	-30.4	-176.9	-63.3	177	122.8	0	0	111.9	R115 L116 Q122 F402 R406	R115-E118 HydrophobicContact CB-CG 4.23Å; R115-E118 PolarHBondContact N-OE2 3.26Å; R115-E118 WeakPolarHBondContact O-CA 3.4Å; R115-E118 WeakPolarHBondContact O-CB 3.25Å; R115-E118 PolarHBondContact O-N 3.03Å; L116-E118 VanDerWaalsContact C-N 3.33Å; L116-E118 PolarHBondContact O-N 2.86Å; E118-Q122 VanDerWaalsContact O-CG 3.29Å; E118-Q122 WeakPolarHBondContact O-CG 3.43Å; E118-Q122 PolarHBondContact O-N 3.29Å; E118-Q122 PolarHBondContact O-NE2 2.97Å; E118-F402 HydrophobicContact CG-CD1 4.43Å; E118-F402 HydrophobicContact CG-CE1 4.14Å; E118-R406 IonicContact OE1-CZ 3.13Å; E118-R406 VanDerWaalsContact OE1-CZ 3.28Å; E118-R406 IonicContact OE1-NE 3.69Å; E118-R406 PolarHBondContact OE1-NE 3.21Å; E118-R406 IonicContact OE1-NH2 3.52Å; E118-R406 PolarHBondContact OE1-NH2 2.86Å
119	V	87.5	Confident	84	Confident	8 Å²	8	36.5 Å²	36.5	5%	0.048	19%	0.191	C	C	.	.	H	α-helix	trans	-72.4	-46.2	171.9	-177.8	0	0	0	0	110.5	M114 R115 L116 C121 Q122 L123 L143 V146 Y147	M114-V119 HydrophobicContact CB-CG2 3.89Å; R115-V119 PolarHBondContact O-N 2.95Å; L116-V119 PolarHBondContact O-N 3.07Å; V119-C121 PolarHBondContact O-N 2.84Å; V119-Q122 PolarHBondContact O-N 3.16Å; V119-L123 HydrophobicContact CG1-CD1 4.12Å; V119-L123 HydrophobicContact CG1-CG 4.45Å; V119-L123 WeakPolarHBondContact O-CG 3.47Å; V119-L123 PolarHBondContact O-N 3.06Å; V119-L143 HydrophobicContact CG1-CD2 3.79Å; V119-V146 HydrophobicContact CG1-CG1 4.36Å; V119-Y147 HydrophobicContact CG1-CE2 4.26Å
120	I	91.1	Very high	85	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-55.2	-49.1	176.9	-76.9	170.5	0	0	0	110.8	L116 Q122 L123 V124 L139 L143 V160 L164 L167	L116-I120 HydrophobicContact CD1-CD1 4.04Å; L116-I120 HydrophobicContact CD1-CG1 4.1Å; L116-I120 HydrophobicContact CG-CD1 3.81Å; L116-I120 HydrophobicContact CG-CG1 4.34Å; L116-I120 WeakPolarHBondContact O-CB 3.35Å; L116-I120 VanDerWaalsContact O-CG1 3.27Å; L116-I120 WeakPolarHBondContact O-CG1 3.46Å; L116-I120 PolarHBondContact O-N 3.46Å; I120-Q122 PolarHBondContact O-N 3.09Å; I120-L123 PolarHBondContact O-N 2.82Å; I120-V124 HydrophobicContact CG2-CG2 4.16Å; I120-V124 WeakPolarHBondContact O-CB 3.21Å; I120-V124 VanDerWaalsContact O-CG2 3.32Å; I120-V124 WeakPolarHBondContact O-CG2 3.31Å; I120-V124 PolarHBondContact O-N 3.34Å; I120-L139 HydrophobicContact CG1-CD1 4.42Å; I120-L139 HydrophobicContact CG1-CD2 4.32Å; I120-L139 HydrophobicContact CG2-CD1 4.38Å; I120-L139 HydrophobicContact CG2-CD2 3.95Å; I120-L143 HydrophobicContact CG1-CD1 4.07Å; I120-L143 HydrophobicContact CG1-CD2 4.36Å; I120-V160 HydrophobicContact CD1-CG1 4.26Å; I120-L164 HydrophobicContact CG2-CD2 3.9Å; I120-L167 HydrophobicContact CB-CD1 4.08Å; I120-L167 HydrophobicContact CG2-CD1 3.61Å
121	C	88.3	Confident	85.8	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.02	18%	0.175	C	C	.	.	H	α-helix	trans	-67.7	-32.2	-179.6	-77.3	0	0	0	0	113.9	E117 V119 W125 L167 L182 F402	E117-C121 PolarHBondContact O-N 3.25Å; E117-C121 VanDerWaalsContact O-N 3.16Å; V119-C121 PolarHBondContact O-N 2.84Å; C121-W125 WeakPolarHBondContact O-CB 3.36Å; C121-W125 PolarHBondContact O-N 3.34Å; C121-L167 VanDerWaalsContact SG-CD2 3.59Å; C121-L182 HydrophobicContact CB-CD2 4.15Å; C121-F402 HydrophobicContact CB-CE1 4.42Å; C121-F402 HydrophobicContact CB-CE2 4.19Å; C121-F402 HydrophobicContact CB-CZ 3.47Å; C121-F402 VanDerWaalsContact CB-CZ 3.47Å
122	Q	87.9	Confident	86.2	Confident	13 Å²	13	36.6 Å²	36.6	6%	0.061	20%	0.199	C	C	.	.	H	α-helix	trans	-64.4	-42.8	171.8	-76	174.7	87.5	0	0	111.6	F29 F32 E118 V119 I120 W125 Q126	F29-Q122 HydrophobicContact CE2-CG 4.13Å; F32-Q122 VanDerWaalsContact CE1-OE1 3.28Å; E118-Q122 VanDerWaalsContact O-CG 3.29Å; E118-Q122 WeakPolarHBondContact O-CG 3.43Å; E118-Q122 PolarHBondContact O-N 3.29Å; E118-Q122 PolarHBondContact O-NE2 2.97Å; V119-Q122 PolarHBondContact O-N 3.16Å; I120-Q122 PolarHBondContact O-N 3.09Å; Q122-W125 PolarHBondContact O-N 3.37Å; Q122-Q126 WeakPolarHBondContact O-CG 3.48Å; Q122-Q126 PolarHBondContact O-N 2.9Å
123	L	90	Very high	86.6	Confident	6 Å²	6	33.2 Å²	33.2	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-68.4	-45.8	177.5	-69.4	176.8	0	0	0	112.2	V119 I120 W125 Q126 V127 L139 L143 V146	V119-L123 HydrophobicContact CG1-CD1 4.12Å; V119-L123 HydrophobicContact CG1-CG 4.45Å; V119-L123 WeakPolarHBondContact O-CG 3.47Å; V119-L123 PolarHBondContact O-N 3.06Å; I120-L123 PolarHBondContact O-N 2.82Å; L123-W125 VanDerWaalsContact C-N 3.28Å; L123-W125 PolarHBondContact O-N 3.22Å; L123-Q126 PolarHBondContact O-N 2.79Å; L123-V127 WeakPolarHBondContact O-CG2 3.46Å; L123-V127 PolarHBondContact O-N 3.27Å; L123-L139 HydrophobicContact CB-CD1 3.89Å; L123-L139 HydrophobicContact CD1-CD1 4.2Å; L123-L143 HydrophobicContact CD1-CD2 3.63Å; L123-L143 HydrophobicContact CD1-CG 3.8Å; L123-V146 HydrophobicContact CD1-CG2 4.34Å; L123-V146 HydrophobicContact CD2-CG2 4.09Å
124	V	91	Very high	87.2	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-57.3	-44	174.5	171.7	0	0	0	0	110	I120 T128 C134 L139 L182	I120-V124 HydrophobicContact CG2-CG2 4.16Å; I120-V124 WeakPolarHBondContact O-CB 3.21Å; I120-V124 VanDerWaalsContact O-CG2 3.32Å; I120-V124 WeakPolarHBondContact O-CG2 3.31Å; I120-V124 PolarHBondContact O-N 3.34Å; V124-T128 HydrophobicContact CG1-CG2 4.34Å; V124-T128 WeakPolarHBondContact O-CB 3.05Å; V124-T128 VanDerWaalsContact O-CG2 3.29Å; V124-T128 WeakPolarHBondContact O-CG2 3.29Å; V124-T128 PolarHBondContact O-N 2.85Å; V124-T128 PolarHBondContact O-OG1 3.45Å; V124-C134 HydrophobicContact CG1-CB 4.43Å; V124-C134 HydrophobicContact CG2-CB 4.21Å; V124-L139 HydrophobicContact CG2-CD1 4.24Å; V124-L139 HydrophobicContact CG2-CD2 4.49Å; V124-L182 HydrophobicContact CG1-CD1 4.45Å; V124-L182 HydrophobicContact CG1-CG 4.1Å
125	W	85.1	Confident	87.6	Confident	18 Å²	18	31.3 Å²	31.3	7%	0.068	17%	0.167	C	C	.	.	H	α-helix	trans	-59.2	-50.6	174.8	175.1	57.7	0	0	0	112.8	Q53 C121 Q122 L123 V127 T128 Q129 L182 F394 L395	Q53-W125 HydrophobicContact CG-CH2 3.77Å; Q53-W125 HydrophobicContact CG-CZ2 4.43Å; Q53-W125 HydrophobicContact CG-CZ3 4.41Å; Q53-W125 WeakPolarHBondContact O-CZ3 3.35Å; C121-W125 WeakPolarHBondContact O-CB 3.36Å; C121-W125 PolarHBondContact O-N 3.34Å; Q122-W125 PolarHBondContact O-N 3.37Å; L123-W125 VanDerWaalsContact C-N 3.28Å; L123-W125 PolarHBondContact O-N 3.22Å; W125-V127 VanDerWaalsContact C-N 3.32Å; W125-V127 PolarHBondContact O-N 3.13Å; W125-T128 CarbonylContact O-C 3.54Å; W125-T128 PolarHBondContact O-N 3.4Å; W125-T128 VanDerWaalsContact O-N 3.15Å; W125-T128 PolarHBondContact O-OG1 2.86Å; W125-Q129 VanDerWaalsContact CD1-NE2 3.25Å; W125-Q129 HydrophobicContact CZ2-CG 4.27Å; W125-Q129 WeakPolarHBondContact O-CG 3.34Å; W125-Q129 PolarHBondContact O-N 3.43Å; W125-Q129 VanDerWaalsContact O-N 3.16Å; W125-Q129 PolarHBondContact O-NE2 2.58Å; W125-Q129 VanDerWaalsContact O-NE2 3.17Å; W125-L182 HydrophobicContact CB-CD1 3.53Å; W125-L182 HydrophobicContact CG-CD1 4.35Å; W125-F394 AromaticContact CD1-CD1 3.87Å; W125-F394 AromaticContact CD1-CE1 3.02Å; W125-F394 AromaticContact CD1-CZ 3.35Å; W125-F394 HydrophobicContact CD2-CE1 4.41Å; W125-F394 AromaticContact CG-CE1 3.84Å; W125-F394 HydrophobicContact CG-CE1 3.84Å; W125-F394 HydrophobicContact CG-CZ 4.24Å; W125-F394 AromaticContact NE1-CD1 3.46Å; W125-F394 AromaticContact NE1-CE1 3.1Å; W125-F394 AromaticContact NE1-CZ 3.84Å; W125-L395 HydrophobicContact CZ2-CD2 4.35Å
126	Q	84.4	Confident	88.1	Confident	30 Å²	30	26.9 Å²	26.9	14%	0.14	15%	0.153	C	C	.	.	H	α-helix	trans	-58.8	-44.7	-178.3	-77	179.1	-27.4	0	0	111.5	Q53 N54 C55 Q122 L123 Q129	Q53-Q126 PolarHBondContact O-NE2 3.17Å; Q53-Q126 VanDerWaalsContact O-NE2 3.16Å; N54-Q126 PolarHBondContact O-NE2 3.28Å; C55-Q126 PolarHBondContact O-NE2 3.27Å; Q122-Q126 WeakPolarHBondContact O-CG 3.48Å; Q122-Q126 PolarHBondContact O-N 2.9Å; L123-Q126 PolarHBondContact O-N 2.79Å; Q126-Q129 PolarHBondContact O-N 2.8Å
127	V	88.2	Confident	88.2	Confident	6 Å²	6	32.2 Å²	32.2	4%	0.036	18%	0.178	C	C	.	.	H	α-helix	trans	-65.1	-40.9	176.3	176.7	0	0	0	0	111.2	L123 W125 Q129 S130 E131 C134 Y142	L123-V127 WeakPolarHBondContact O-CG2 3.46Å; L123-V127 PolarHBondContact O-N 3.27Å; W125-V127 VanDerWaalsContact C-N 3.32Å; W125-V127 PolarHBondContact O-N 3.13Å; V127-Q129 PolarHBondContact O-N 3.01Å; V127-Q129 VanDerWaalsContact O-N 3.17Å; V127-S130 PolarHBondContact O-N 3.41Å; V127-S130 PolarHBondContact O-OG 2.96Å; V127-S130 VanDerWaalsContact O-OG 3.07Å; V127-E131 HydrophobicContact CG1-CB 4.19Å; V127-E131 PolarHBondContact O-N 3.21Å; V127-C134 HydrophobicContact CB-CB 4Å; V127-C134 HydrophobicContact CG1-CB 3.8Å; V127-Y142 HydrophobicContact CG2-CD2 3.72Å; V127-Y142 HydrophobicContact CG2-CE2 3.32Å
128	T	87.9	Confident	88.4	Confident	24 Å²	24	35.2 Å²	35.2	15%	0.147	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	3.7	179.7	63.8	0	0	0	0	115	V124 W125 E131 N181	V124-T128 HydrophobicContact CG1-CG2 4.34Å; V124-T128 WeakPolarHBondContact O-CB 3.05Å; V124-T128 VanDerWaalsContact O-CG2 3.29Å; V124-T128 WeakPolarHBondContact O-CG2 3.29Å; V124-T128 PolarHBondContact O-N 2.85Å; V124-T128 PolarHBondContact O-OG1 3.45Å; W125-T128 CarbonylContact O-C 3.54Å; W125-T128 PolarHBondContact O-N 3.4Å; W125-T128 VanDerWaalsContact O-N 3.15Å; W125-T128 PolarHBondContact O-OG1 2.86Å; T128-E131 VanDerWaalsContact CA-O 3.29Å; T128-E131 WeakPolarHBondContact CA-O 3.24Å; T128-N181 HydrophobicContact CG2-CB 4.15Å
129	Q	81.1	Confident	88.9	Confident	74 Å²	74	34.5 Å²	34.5	35%	0.346	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-18.3	163.6	-55.3	-46.6	-94.2	0	0	112.7	W125 Q126 V127	W125-Q129 VanDerWaalsContact CD1-NE2 3.25Å; W125-Q129 HydrophobicContact CZ2-CG 4.27Å; W125-Q129 WeakPolarHBondContact O-CG 3.34Å; W125-Q129 PolarHBondContact O-N 3.43Å; W125-Q129 VanDerWaalsContact O-N 3.16Å; W125-Q129 PolarHBondContact O-NE2 2.58Å; W125-Q129 VanDerWaalsContact O-NE2 3.17Å; Q126-Q129 PolarHBondContact O-N 2.8Å; V127-Q129 PolarHBondContact O-N 3.01Å; V127-Q129 VanDerWaalsContact O-N 3.17Å
130	S	83.6	Confident	89.2	Confident	92 Å²	92	36 Å²	36	64%	0.643	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.2	-24.2	-178.2	50.9	0	0	0	0	114.4	V127	V127-S130 PolarHBondContact O-N 3.41Å; V127-S130 PolarHBondContact O-OG 2.96Å; V127-S130 VanDerWaalsContact O-OG 3.07Å
131	E	87.5	Confident	89.2	Confident	59 Å²	59	42.2 Å²	42.2	28%	0.276	22%	0.221	S	C	.	.	S	Bend	trans	-132.3	152.2	-171.6	-73.1	166.1	-159.4	0	0	110.8	V127 T128 S133 R138	V127-E131 HydrophobicContact CG1-CB 4.19Å; V127-E131 PolarHBondContact O-N 3.21Å; T128-E131 VanDerWaalsContact CA-O 3.29Å; T128-E131 WeakPolarHBondContact CA-O 3.24Å; E131-S133 VanDerWaalsContact C-N 3.27Å; E131-S133 PolarHBondContact O-N 3.02Å; E131-R138 VanDerWaalsContact CD-CZ 3.48Å; E131-R138 IonicContact OE1-CZ 3.27Å; E131-R138 IonicContact OE1-NH1 2.77Å; E131-R138 PolarHBondContact OE1-NH1 3.17Å; E131-R138 IonicContact OE1-NH2 2.81Å; E131-R138 PolarHBondContact OE1-NH2 3.38Å; E131-R138 IonicContact OE2-CZ 2.76Å; E131-R138 IonicContact OE2-NE 2.71Å; E131-R138 IonicContact OE2-NH1 3.02Å; E131-R138 PolarHBondContact OE2-NH1 3.5Å; E131-R138 IonicContact OE2-NH2 3.98Å
132	P	86.3	Confident	89.2	Confident	92 Å²	92	45.8 Å²	45.8	60%	0.597	23%	0.234	S	C	*	.	S	Bend	trans	-67.5	-26.2	-174.2	26.5	-34.9	0	0	0	113.5	N181	P132-N181 PolarHBondContact O-ND2 3.06Å
133	S	89.9	Confident	89.4	Confident	11 Å²	11	45.2 Å²	45.2	8%	0.077	23%	0.232	C	C	.	.	S	Bend	trans	-158.9	154.9	176.9	54.3	0	0	0	0	111	E131 S176 G179	E131-S133 VanDerWaalsContact C-N 3.27Å; E131-S133 PolarHBondContact O-N 3.02Å; S133-S176 WeakPolarHBondContact CB-OG 3.5Å; S133-S176 PolarHBondContact OG-OG 2.82Å; S133-G179 PolarHBondContact OG-N 2.98Å
134	C	92.9	Very high	89.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-93.6	114.3	175.1	-170.3	0	0	0	0	110.4	V124 V127 G179 Y180	V124-C134 HydrophobicContact CG1-CB 4.43Å; V124-C134 HydrophobicContact CG2-CB 4.21Å; V127-C134 HydrophobicContact CB-CB 4Å; V127-C134 HydrophobicContact CG1-CB 3.8Å; C134-G179 CarbonylContact O-C 3.54Å; C134-G179 WeakPolarHBondContact O-CA 3.42Å; C134-Y180 PolarHBondContact N-O 3.5Å; C134-Y180 PolarHBondContact O-N 3.05Å
135	S	93	Very high	89	Confident	33 Å²	33	52 Å²	52	23%	0.231	27%	0.266	C	S	.	.			trans	-70.8	160.1	176.2	90	0	0	0	0	111.7	E137 R138 L139	S135-E137 WeakPolarHBondContact CB-OE2 3.27Å; S135-E137 PolarHBondContact OG-OE2 2.71Å; S135-R138 PolarHBondContact O-N 3.42Å; S135-R138 WeakPolarHBondContact OG-CB 3.44Å; S135-R138 PolarHBondContact OG-N 3.45Å; S135-L139 WeakPolarHBondContact O-CB 3.34Å; S135-L139 PolarHBondContact O-N 2.97Å
136	V	92.9	Very high	88.9	Confident	31 Å²	31	51.5 Å²	51.5	19%	0.188	27%	0.265	C	S	.	.	H	α-helix	trans	-66.5	-42.1	-176.5	177.4	0	0	0	0	111.2	R138 L139 V140 L157 Y180	V136-R138 PolarHBondContact O-N 2.86Å; V136-L139 PolarHBondContact O-N 3.22Å; V136-V140 HydrophobicContact CG1-CG2 4.24Å; V136-V140 WeakPolarHBondContact O-CB 3.23Å; V136-V140 VanDerWaalsContact O-CG2 3.27Å; V136-V140 WeakPolarHBondContact O-CG2 3.3Å; V136-V140 PolarHBondContact O-N 3.39Å; V136-L157 HydrophobicContact CG1-CD1 4.32Å; V136-Y180 HydrophobicContact CG2-CD2 4.2Å; V136-Y180 HydrophobicContact CG2-CE2 3.71Å
137	E	91.9	Very high	88.8	Confident	137 Å²	137	51.4 Å²	51.4	64%	0.64	26%	0.264	S	S	*	.	H	α-helix	trans	-60.9	-39.4	179.5	-46.6	67.6	-141	0	0	110.2	S135 K141	S135-E137 WeakPolarHBondContact CB-OE2 3.27Å; S135-E137 PolarHBondContact OG-OE2 2.71Å; E137-K141 WeakPolarHBondContact O-CB 3.48Å; E137-K141 PolarHBondContact O-N 3.47Å
138	R	92.1	Very high	88.4	Confident	86 Å²	86	57.5 Å²	57.5	33%	0.325	29%	0.286	S	S	.	.	H	α-helix	trans	-75.4	-38.6	178.5	-171.6	157.6	-170.1	176.9	-16.7	112.6	E131 S135 V136 K141 Y142	E131-R138 VanDerWaalsContact CD-CZ 3.48Å; E131-R138 IonicContact OE1-CZ 3.27Å; E131-R138 IonicContact OE1-NH1 2.77Å; E131-R138 PolarHBondContact OE1-NH1 3.17Å; E131-R138 IonicContact OE1-NH2 2.81Å; E131-R138 PolarHBondContact OE1-NH2 3.38Å; E131-R138 IonicContact OE2-CZ 2.76Å; E131-R138 IonicContact OE2-NE 2.71Å; E131-R138 IonicContact OE2-NH1 3.02Å; E131-R138 PolarHBondContact OE2-NH1 3.5Å; E131-R138 IonicContact OE2-NH2 3.98Å; S135-R138 PolarHBondContact O-N 3.42Å; S135-R138 WeakPolarHBondContact OG-CB 3.44Å; S135-R138 PolarHBondContact OG-N 3.45Å; V136-R138 PolarHBondContact O-N 2.86Å; R138-K141 PolarHBondContact O-N 3.1Å; R138-Y142 HydrophobicContact CG-CD2 3.84Å; R138-Y142 HydrophobicContact CG-CE2 3.43Å; R138-Y142 VanDerWaalsContact CG-CE2 3.43Å; R138-Y142 PolarHBondContact NE-OH 2.75Å; R138-Y142 PolarHBondContact NH2-OH 2.86Å; R138-Y142 WeakPolarHBondContact O-CD2 3.34Å; R138-Y142 PolarHBondContact O-N 2.83Å
139	L	93.5	Very high	87.6	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-47.2	172.4	178.2	62.4	0	0	0	111.4	I120 L123 V124 S135 V136 K141 Y142 L143 V160 L164	I120-L139 HydrophobicContact CG1-CD1 4.42Å; I120-L139 HydrophobicContact CG1-CD2 4.32Å; I120-L139 HydrophobicContact CG2-CD1 4.38Å; I120-L139 HydrophobicContact CG2-CD2 3.95Å; L123-L139 HydrophobicContact CB-CD1 3.89Å; L123-L139 HydrophobicContact CD1-CD1 4.2Å; V124-L139 HydrophobicContact CG2-CD1 4.24Å; V124-L139 HydrophobicContact CG2-CD2 4.49Å; S135-L139 WeakPolarHBondContact O-CB 3.34Å; S135-L139 PolarHBondContact O-N 2.97Å; V136-L139 PolarHBondContact O-N 3.22Å; L139-K141 VanDerWaalsContact C-N 3.35Å; L139-K141 PolarHBondContact O-N 3.49Å; L139-Y142 PolarHBondContact O-N 3.39Å; L139-L143 HydrophobicContact CD1-CD1 4.4Å; L139-L143 HydrophobicContact CD1-CG 4.46Å; L139-L143 HydrophobicContact CG-CD1 4.12Å; L139-L143 WeakPolarHBondContact O-CG 3.37Å; L139-L143 PolarHBondContact O-N 3.29Å; L139-V160 HydrophobicContact CD2-CG1 4.33Å; L139-L164 HydrophobicContact CD2-CD1 4.13Å; L139-L164 HydrophobicContact CD2-CD2 3.84Å; L139-L164 HydrophobicContact CD2-CG 4.32Å
140	V	93.5	Very high	87.1	Confident	39 Å²	39	54.3 Å²	54.3	24%	0.236	27%	0.273	C	S	.	.	H	α-helix	trans	-60.4	-44.2	176.8	170.5	0	0	0	0	110.7	V136 Y142 L143 E144 L157 V160	V136-V140 HydrophobicContact CG1-CG2 4.24Å; V136-V140 WeakPolarHBondContact O-CB 3.23Å; V136-V140 VanDerWaalsContact O-CG2 3.27Å; V136-V140 WeakPolarHBondContact O-CG2 3.3Å; V136-V140 PolarHBondContact O-N 3.39Å; V140-Y142 PolarHBondContact O-N 2.89Å; V140-L143 PolarHBondContact O-N 3.39Å; V140-E144 PolarHBondContact O-N 3.11Å; V140-L157 HydrophobicContact CG2-CD1 3.95Å; V140-V160 HydrophobicContact CG2-CG1 4.23Å
141	K	91.7	Very high	86.4	Confident	132 Å²	132	54.6 Å²	54.6	57%	0.574	26%	0.263	S	S	*	.	H	α-helix	trans	-59.7	-44	174.5	-177.8	176.3	177.6	178.2	0	112.7	E137 R138 L139 E144 D145	E137-K141 WeakPolarHBondContact O-CB 3.48Å; E137-K141 PolarHBondContact O-N 3.47Å; R138-K141 PolarHBondContact O-N 3.1Å; L139-K141 VanDerWaalsContact C-N 3.35Å; L139-K141 PolarHBondContact O-N 3.49Å; K141-E144 WeakPolarHBondContact O-CB 3.28Å; K141-E144 PolarHBondContact O-N 3.39Å; K141-D145 PolarHBondContact O-N 3.09Å
142	Y	89.5	Confident	85.7	Confident	77 Å²	77	54 Å²	54	30%	0.302	26%	0.262	S	S	.	.	H	α-helix	trans	-67.5	-35.8	176.5	-73.6	-54.7	0	0	0	112.4	V127 R138 L139 V140 D145 V146	V127-Y142 HydrophobicContact CG2-CD2 3.72Å; V127-Y142 HydrophobicContact CG2-CE2 3.32Å; R138-Y142 HydrophobicContact CG-CD2 3.84Å; R138-Y142 HydrophobicContact CG-CE2 3.43Å; R138-Y142 VanDerWaalsContact CG-CE2 3.43Å; R138-Y142 PolarHBondContact NE-OH 2.75Å; R138-Y142 PolarHBondContact NH2-OH 2.86Å; R138-Y142 WeakPolarHBondContact O-CD2 3.34Å; R138-Y142 PolarHBondContact O-N 2.83Å; L139-Y142 PolarHBondContact O-N 3.39Å; V140-Y142 PolarHBondContact O-N 2.89Å; Y142-D145 PolarHBondContact O-N 3.43Å; Y142-V146 WeakPolarHBondContact O-CB 3.42Å; Y142-V146 WeakPolarHBondContact O-CG2 3.48Å; Y142-V146 PolarHBondContact O-N 2.88Å
143	L	91.1	Very high	85.4	Confident	2 Å²	2	54.9 Å²	54.9	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-63.7	-42	171.8	-72.6	167.4	0	0	0	111.5	L116 V119 I120 L123 L139 V140 V146 Y147 P155 V160	L116-L143 HydrophobicContact CD1-CD1 4.28Å; L116-L143 HydrophobicContact CD1-CD2 3.87Å; V119-L143 HydrophobicContact CG1-CD2 3.79Å; I120-L143 HydrophobicContact CG1-CD1 4.07Å; I120-L143 HydrophobicContact CG1-CD2 4.36Å; L123-L143 HydrophobicContact CD1-CD2 3.63Å; L123-L143 HydrophobicContact CD1-CG 3.8Å; L139-L143 HydrophobicContact CD1-CD1 4.4Å; L139-L143 HydrophobicContact CD1-CG 4.46Å; L139-L143 HydrophobicContact CG-CD1 4.12Å; L139-L143 WeakPolarHBondContact O-CG 3.37Å; L139-L143 PolarHBondContact O-N 3.29Å; V140-L143 PolarHBondContact O-N 3.39Å; L143-V146 PolarHBondContact O-N 3.27Å; L143-Y147 HydrophobicContact CD2-CD2 4.41Å; L143-Y147 HydrophobicContact CD2-CE2 3.91Å; L143-Y147 WeakPolarHBondContact O-CB 3.35Å; L143-Y147 VanDerWaalsContact O-CD2 3.25Å; L143-Y147 WeakPolarHBondContact O-CD2 3.5Å; L143-Y147 PolarHBondContact O-N 3.24Å; L143-P155 HydrophobicContact CB-CG 4.35Å; L143-P155 HydrophobicContact CD1-CG 4.44Å; L143-V160 HydrophobicContact CD1-CG1 4.08Å; L143-V160 HydrophobicContact CD1-CG2 3.54Å
144	E	88.5	Confident	85.1	Confident	67 Å²	67	57.9 Å²	57.9	31%	0.313	28%	0.282	S	S	.	.	H	α-helix	trans	-56.7	-51.3	171.6	-88.6	-157.1	-121.5	0	0	112.1	V140 K141 V146 R148 I154	V140-E144 PolarHBondContact O-N 3.11Å; K141-E144 WeakPolarHBondContact O-CB 3.28Å; K141-E144 PolarHBondContact O-N 3.39Å; E144-V146 VanDerWaalsContact C-N 3.35Å; E144-V146 PolarHBondContact O-N 3.35Å; E144-R148 WeakPolarHBondContact O-CB 3.32Å; E144-R148 PolarHBondContact O-N 3Å; E144-R148 IonicContact OE2-CZ 2.63Å; E144-R148 VanDerWaalsContact OE2-CZ 3.27Å; E144-R148 IonicContact OE2-NH1 3.28Å; E144-R148 PolarHBondContact OE2-NH1 2.9Å; E144-R148 IonicContact OE2-NH2 3.88Å; E144-R148 PolarHBondContact OE2-NH2 2.89Å; E144-I154 HydrophobicContact CG-CD1 4.32Å; E144-I154 HydrophobicContact CG-CG2 3.91Å
145	D	84.9	Confident	84.9	Confident	81 Å²	81	59 Å²	59	43%	0.433	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-42.4	179.6	-74.1	-27.8	0	0	0	111.6	K141 Y142 S149	K141-D145 PolarHBondContact O-N 3.09Å; Y142-D145 PolarHBondContact O-N 3.43Å; D145-S149 WeakPolarHBondContact O-CB 3.43Å; D145-S149 PolarHBondContact O-N 3.39Å; D145-S149 VanDerWaalsContact O-N 3.07Å
146	V	83.4	Confident	84.7	Confident	8 Å²	8	59.9 Å²	59.9	5%	0.048	30%	0.296	C	S	.	.	H	α-helix	trans	-60.3	-61.1	174.8	168.1	0	0	0	0	110.8	Y56 V119 L123 Y142 L143 E144 R148 S149 I150	Y56-V146 HydrophobicContact CD1-CG2 4.44Å; Y56-V146 HydrophobicContact CD2-CG1 4.4Å; Y56-V146 HydrophobicContact CE1-CG2 3.89Å; Y56-V146 HydrophobicContact CE2-CB 4.45Å; Y56-V146 HydrophobicContact CE2-CG1 3.78Å; Y56-V146 HydrophobicContact CE2-CG2 4.04Å; V119-V146 HydrophobicContact CG1-CG1 4.36Å; L123-V146 HydrophobicContact CD1-CG2 4.34Å; L123-V146 HydrophobicContact CD2-CG2 4.09Å; Y142-V146 WeakPolarHBondContact O-CB 3.42Å; Y142-V146 WeakPolarHBondContact O-CG2 3.48Å; Y142-V146 PolarHBondContact O-N 2.88Å; L143-V146 PolarHBondContact O-N 3.27Å; E144-V146 VanDerWaalsContact C-N 3.35Å; E144-V146 PolarHBondContact O-N 3.35Å; V146-R148 PolarHBondContact O-N 3.47Å; V146-S149 WeakPolarHBondContact O-CB 3.46Å; V146-S149 PolarHBondContact O-N 3.36Å; V146-S149 PolarHBondContact O-OG 3.19Å; V146-I150 HydrophobicContact CG1-CD1 3.64Å; V146-I150 VanDerWaalsContact O-CD1 3.28Å; V146-I150 WeakPolarHBondContact O-CD1 3.37Å; V146-I150 VanDerWaalsContact O-CG1 3.29Å; V146-I150 WeakPolarHBondContact O-CG1 3.31Å; V146-I150 PolarHBondContact O-N 3.44Å
147	Y	82.4	Confident	84.7	Confident	27 Å²	27	63.2 Å²	63.2	11%	0.106	31%	0.312	C	S	.	.	H	α-helix	trans	-67.7	-36.2	-172.4	-79.3	-110.6	0	0	0	111.9	V119 L143 S149 I150 Q151 L152 P153 P155	V119-Y147 HydrophobicContact CG1-CE2 4.26Å; L143-Y147 HydrophobicContact CD2-CD2 4.41Å; L143-Y147 HydrophobicContact CD2-CE2 3.91Å; L143-Y147 WeakPolarHBondContact O-CB 3.35Å; L143-Y147 VanDerWaalsContact O-CD2 3.25Å; L143-Y147 WeakPolarHBondContact O-CD2 3.5Å; L143-Y147 PolarHBondContact O-N 3.24Å; Y147-S149 VanDerWaalsContact C-N 3.3Å; Y147-S149 PolarHBondContact O-N 3.5Å; Y147-I150 PolarHBondContact O-N 2.92Å; Y147-I150 VanDerWaalsContact O-N 3.11Å; Y147-Q151 PolarHBondContact O-N 3.4Å; Y147-L152 HydrophobicContact CD1-CB 3.59Å; Y147-L152 HydrophobicContact CD1-CD1 4.32Å; Y147-L152 HydrophobicContact CE1-CB 4.27Å; Y147-L152 HydrophobicContact CE1-CD1 4.37Å; Y147-L152 HydrophobicContact CG-CB 4.4Å; Y147-L152 PolarHBondContact O-N 3.5Å; Y147-L152 VanDerWaalsContact O-N 3.12Å; Y147-P153 WeakPolarHBondContact CD1-O 3.31Å; Y147-P155 HydrophobicContact CE2-CG 4.32Å
148	R	79.3	Confident	84.7	Confident	134 Å²	134	63.4 Å²	63.4	51%	0.506	31%	0.313	S	S	.	.	H	α-helix	trans	-63.7	-31.9	171.7	-175.3	176.9	-76.9	116.2	-2.3	112.6	E144 V146 I150	E144-R148 WeakPolarHBondContact O-CB 3.32Å; E144-R148 PolarHBondContact O-N 3Å; E144-R148 IonicContact OE2-CZ 2.63Å; E144-R148 VanDerWaalsContact OE2-CZ 3.27Å; E144-R148 IonicContact OE2-NH1 3.28Å; E144-R148 PolarHBondContact OE2-NH1 2.9Å; E144-R148 IonicContact OE2-NH2 3.88Å; E144-R148 PolarHBondContact OE2-NH2 2.89Å; V146-R148 PolarHBondContact O-N 3.47Å; R148-I150 VanDerWaalsContact C-N 3.34Å
149	S	70.2	Confident	84.7	Confident	26 Å²	26	62.9 Å²	62.9	18%	0.182	32%	0.317	C	S	.	.	H	α-helix	trans	-71.5	-27.9	172.9	79.6	0	0	0	0	113	K9 Y56 D145 V146 Y147	K9-S149 VanDerWaalsContact CB-O 3.27Å; K9-S149 WeakPolarHBondContact CB-O 3.47Å; K9-S149 WeakPolarHBondContact CD-O 3.33Å; Y56-S149 PolarHBondContact OH-OG 3.24Å; D145-S149 WeakPolarHBondContact O-CB 3.43Å; D145-S149 PolarHBondContact O-N 3.39Å; D145-S149 VanDerWaalsContact O-N 3.07Å; V146-S149 WeakPolarHBondContact O-CB 3.46Å; V146-S149 PolarHBondContact O-N 3.36Å; V146-S149 PolarHBondContact O-OG 3.19Å; Y147-S149 VanDerWaalsContact C-N 3.3Å; Y147-S149 PolarHBondContact O-N 3.5Å
150	I	70.9	Confident	84.8	Confident	6 Å²	6	63 Å²	63	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-94.1	-12.6	-177.6	-49.9	151.4	0	0	0	111.6	I58 L106 V146 Y147 R148 L152	I58-I150 HydrophobicContact CB-CD1 4.37Å; I58-I150 HydrophobicContact CD1-CD1 4.15Å; I58-I150 HydrophobicContact CD1-CG1 3.85Å; I58-I150 HydrophobicContact CG1-CD1 3.75Å; I58-I150 HydrophobicContact CG1-CG1 4.04Å; I58-I150 HydrophobicContact CG2-CD1 3.87Å; I58-I150 HydrophobicContact CG2-CG1 4.16Å; I58-I150 HydrophobicContact CG2-CG2 3.79Å; L106-I150 HydrophobicContact CD1-CG2 3.99Å; L106-I150 HydrophobicContact CD2-CG2 4.04Å; L106-I150 HydrophobicContact CG-CG2 4.43Å; V146-I150 HydrophobicContact CG1-CD1 3.64Å; V146-I150 VanDerWaalsContact O-CD1 3.28Å; V146-I150 WeakPolarHBondContact O-CD1 3.37Å; V146-I150 VanDerWaalsContact O-CG1 3.29Å; V146-I150 WeakPolarHBondContact O-CG1 3.31Å; V146-I150 PolarHBondContact O-N 3.44Å; Y147-I150 PolarHBondContact O-N 2.92Å; Y147-I150 VanDerWaalsContact O-N 3.11Å; R148-I150 VanDerWaalsContact C-N 3.34Å; I150-L152 VanDerWaalsContact C-N 3.25Å; I150-L152 HydrophobicContact CB-CD1 4.12Å; I150-L152 HydrophobicContact CB-CG 4.14Å; I150-L152 HydrophobicContact CD1-CD1 4.31Å; I150-L152 HydrophobicContact CG2-CD1 3.64Å; I150-L152 HydrophobicContact CG2-CG 3.74Å
151	Q	70	Confident	84.8	Confident	97 Å²	97	64.5 Å²	64.5	45%	0.453	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	25.3	-169.4	-46.6	-172.2	119.8	0	0	113.9	E107 Y147	E107-Q151 PolarHBondContact OE1-NE2 2.88Å; Y147-Q151 PolarHBondContact O-N 3.4Å
152	L	72.5	Confident	84.9	Confident	46 Å²	46	62.1 Å²	62.1	24%	0.241	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-83.5	155	173.5	-73.3	171.6	0	0	0	111.1	F111 Y147 I150 I154	F111-L152 HydrophobicContact CZ-CD1 4.4Å; F111-L152 HydrophobicContact CZ-CD2 4.32Å; Y147-L152 HydrophobicContact CD1-CB 3.59Å; Y147-L152 HydrophobicContact CD1-CD1 4.32Å; Y147-L152 HydrophobicContact CE1-CB 4.27Å; Y147-L152 HydrophobicContact CE1-CD1 4.37Å; Y147-L152 HydrophobicContact CG-CB 4.4Å; Y147-L152 PolarHBondContact O-N 3.5Å; Y147-L152 VanDerWaalsContact O-N 3.12Å; I150-L152 VanDerWaalsContact C-N 3.25Å; I150-L152 HydrophobicContact CB-CD1 4.12Å; I150-L152 HydrophobicContact CB-CG 4.14Å; I150-L152 HydrophobicContact CD1-CD1 4.31Å; I150-L152 HydrophobicContact CG2-CD1 3.64Å; I150-L152 HydrophobicContact CG2-CG 3.74Å; L152-I154 PolarHBondContact O-N 2.79Å
153	P	78.6	Confident	85	Confident	111 Å²	111	58.8 Å²	58.8	72%	0.721	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-55.6	122.2	169.6	-23.2	33.9	0	0	0	110.7	Y147	Y147-P153 WeakPolarHBondContact CD1-O 3.31Å
154	I	85.2	Confident	85.1	Confident	74 Å²	74	58.8 Å²	58.8	38%	0.379	31%	0.305	S	S	.	.	P	Polyproline II helix	trans	-64.6	128.8	178	-62.5	172.7	0	0	0	108.1	E144 L152	E144-I154 HydrophobicContact CG-CD1 4.32Å; E144-I154 HydrophobicContact CG-CG2 3.91Å; L152-I154 PolarHBondContact O-N 2.79Å
155	P	87	Confident	85.2	Confident	25 Å²	25	57.5 Å²	57.5	16%	0.162	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-64	142.4	180	27.6	-35.5	0	0	0	110.7	L116 L143 Y147 D159 V160	L116-P155 HydrophobicContact CD1-CB 4.06Å; L116-P155 HydrophobicContact CD1-CG 3.91Å; L116-P155 HydrophobicContact CD2-CB 3.78Å; L116-P155 HydrophobicContact CD2-CG 4.49Å; L143-P155 HydrophobicContact CB-CG 4.35Å; L143-P155 HydrophobicContact CD1-CG 4.44Å; Y147-P155 HydrophobicContact CE2-CG 4.32Å; P155-D159 HydrophobicContact CB-CB 4.35Å; P155-V160 HydrophobicContact CB-CG2 4.16Å; P155-V160 HydrophobicContact CG-CG2 4.12Å
156	S	90.3	Very high	85.3	Confident	51 Å²	51	55 Å²	55	36%	0.357	29%	0.294	S	S	.	.	P	Polyproline II helix	trans	-71.3	159.8	177.7	76.6	0	0	0	0	111.2	E158 D159 V160	S156-E158 PolarHBondContact O-N 3.26Å; S156-E158 PolarHBondContact OG-N 3.34Å; S156-D159 VanDerWaalsContact CB-OD2 3.23Å; S156-D159 WeakPolarHBondContact CB-OD2 3.34Å; S156-D159 PolarHBondContact N-OD2 3.49Å; S156-D159 WeakPolarHBondContact O-CB 3.47Å; S156-D159 PolarHBondContact O-N 2.69Å; S156-D159 VanDerWaalsContact O-N 3.1Å; S156-D159 PolarHBondContact OG-N 3.07Å; S156-D159 VanDerWaalsContact OG-N 3.08Å; S156-D159 PolarHBondContact OG-OD2 3.2Å; S156-V160 WeakPolarHBondContact O-CG2 3.47Å; S156-V160 PolarHBondContact O-N 2.63Å
157	L	92.3	Very high	85.6	Confident	100 Å²	100	54.7 Å²	54.7	52%	0.524	29%	0.292	S	S	.	.	H	α-helix	trans	-60.3	-28.2	173.2	-178.2	59.3	0	0	0	112	V136 V140 N161	V136-L157 HydrophobicContact CG1-CD1 4.32Å; V140-L157 HydrophobicContact CG2-CD1 3.95Å; L157-N161 VanDerWaalsContact O-CB 3.31Å; L157-N161 WeakPolarHBondContact O-CB 3.15Å; L157-N161 VanDerWaalsContact O-CG 3.23Å; L157-N161 PolarHBondContact O-N 3.47Å; L157-N161 PolarHBondContact O-ND2 3.45Å
158	E	92.8	Very high	85.9	Confident	141 Å²	141	55 Å²	55	66%	0.659	30%	0.297	S	S	*	.	H	α-helix	trans	-68.7	-45.2	173.1	-174.1	170.6	177	0	0	111.2	S156 V160 N161 N162	S156-E158 PolarHBondContact O-N 3.26Å; S156-E158 PolarHBondContact OG-N 3.34Å; E158-V160 PolarHBondContact O-N 3.06Å; E158-N161 PolarHBondContact O-N 3.22Å; E158-N162 VanDerWaalsContact O-CB 3.3Å; E158-N162 WeakPolarHBondContact O-CB 3.41Å; E158-N162 VanDerWaalsContact O-CG 3.25Å; E158-N162 PolarHBondContact O-N 3.49Å; E158-N162 PolarHBondContact O-ND2 2.99Å; E158-N162 VanDerWaalsContact O-ND2 3.11Å
159	D	92.1	Very high	86.1	Confident	76 Å²	76	57.6 Å²	57.6	41%	0.406	31%	0.307	S	S	.	.	H	α-helix	trans	-60	-46.1	174.7	-58.1	-56.9	0	0	0	111.5	L116 P155 S156 N161 N162 S163	L116-D159 HydrophobicContact CD2-CB 3.85Å; P155-D159 HydrophobicContact CB-CB 4.35Å; S156-D159 VanDerWaalsContact CB-OD2 3.23Å; S156-D159 WeakPolarHBondContact CB-OD2 3.34Å; S156-D159 PolarHBondContact N-OD2 3.49Å; S156-D159 WeakPolarHBondContact O-CB 3.47Å; S156-D159 PolarHBondContact O-N 2.69Å; S156-D159 VanDerWaalsContact O-N 3.1Å; S156-D159 PolarHBondContact OG-N 3.07Å; S156-D159 VanDerWaalsContact OG-N 3.08Å; S156-D159 PolarHBondContact OG-OD2 3.2Å; D159-N161 PolarHBondContact O-N 2.98Å; D159-N162 PolarHBondContact O-N 3.48Å; D159-S163 PolarHBondContact O-N 2.87Å; D159-S163 PolarHBondContact O-OG 2.67Å
160	V	94.2	Very high	86.6	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.012	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-45.8	178.5	175.3	0	0	0	0	110.9	L116 I120 L139 V140 L143 P155 S156 E158 N162 S163 L164	L116-V160 HydrophobicContact CD2-CG2 4.35Å; I120-V160 HydrophobicContact CD1-CG1 4.26Å; L139-V160 HydrophobicContact CD2-CG1 4.33Å; V140-V160 HydrophobicContact CG2-CG1 4.23Å; L143-V160 HydrophobicContact CD1-CG1 4.08Å; L143-V160 HydrophobicContact CD1-CG2 3.54Å; P155-V160 HydrophobicContact CB-CG2 4.16Å; P155-V160 HydrophobicContact CG-CG2 4.12Å; S156-V160 WeakPolarHBondContact O-CG2 3.47Å; S156-V160 PolarHBondContact O-N 2.63Å; E158-V160 PolarHBondContact O-N 3.06Å; V160-N162 PolarHBondContact O-N 3.19Å; V160-S163 PolarHBondContact O-N 3.02Å; V160-L164 HydrophobicContact CG1-CD1 3.94Å; V160-L164 HydrophobicContact CG1-CG 4.41Å; V160-L164 WeakPolarHBondContact O-CB 3.16Å; V160-L164 WeakPolarHBondContact O-CG 3.41Å; V160-L164 PolarHBondContact O-N 3.26Å
161	N	94	Very high	87.1	Confident	71 Å²	71	57.8 Å²	57.8	38%	0.38	31%	0.312	S	S	.	.	H	α-helix	trans	-65.4	-37.3	176.6	-75.9	-33.8	0	0	0	112.4	L157 E158 D159 L164 A165	L157-N161 VanDerWaalsContact O-CB 3.31Å; L157-N161 WeakPolarHBondContact O-CB 3.15Å; L157-N161 VanDerWaalsContact O-CG 3.23Å; L157-N161 PolarHBondContact O-N 3.47Å; L157-N161 PolarHBondContact O-ND2 3.45Å; E158-N161 PolarHBondContact O-N 3.22Å; D159-N161 PolarHBondContact O-N 2.98Å; N161-L164 PolarHBondContact O-N 2.9Å; N161-A165 WeakPolarHBondContact O-CB 3.31Å; N161-A165 PolarHBondContact O-N 3.49Å
162	N	93.2	Very high	87.6	Confident	82 Å²	82	53.2 Å²	53.2	44%	0.439	29%	0.291	S	S	.	.	H	α-helix	trans	-63.9	-50	174.5	-78.3	-36.8	0	0	0	111.3	E158 D159 V160 L164 A165 V166	E158-N162 VanDerWaalsContact O-CB 3.3Å; E158-N162 WeakPolarHBondContact O-CB 3.41Å; E158-N162 VanDerWaalsContact O-CG 3.25Å; E158-N162 PolarHBondContact O-N 3.49Å; E158-N162 PolarHBondContact O-ND2 2.99Å; E158-N162 VanDerWaalsContact O-ND2 3.11Å; D159-N162 PolarHBondContact O-N 3.48Å; V160-N162 PolarHBondContact O-N 3.19Å; N162-L164 VanDerWaalsContact C-N 3.34Å; N162-L164 PolarHBondContact O-N 3.2Å; N162-A165 PolarHBondContact O-N 3.5Å; N162-V166 VanDerWaalsContact O-CB 3.3Å; N162-V166 WeakPolarHBondContact O-CB 3.35Å; N162-V166 VanDerWaalsContact O-CG2 3.23Å; N162-V166 WeakPolarHBondContact O-CG2 3.39Å; N162-V166 PolarHBondContact O-N 3.43Å
163	S	92.6	Very high	88.4	Confident	8 Å²	8	51 Å²	51	6%	0.056	28%	0.279	C	S	.	.	H	α-helix	trans	-62.1	-36.9	175.3	-67.3	0	0	0	0	112.4	E117 D159 V160 V166 L167	E117-S163 WeakPolarHBondContact OE1-CB 3.25Å; E117-S163 PolarHBondContact OE1-OG 3.06Å; D159-S163 PolarHBondContact O-N 2.87Å; D159-S163 PolarHBondContact O-OG 2.67Å; V160-S163 PolarHBondContact O-N 3.02Å; S163-V166 WeakPolarHBondContact O-CB 3.44Å; S163-V166 PolarHBondContact O-N 3.25Å; S163-L167 WeakPolarHBondContact O-CB 3.2Å; S163-L167 VanDerWaalsContact O-CG 3.24Å; S163-L167 WeakPolarHBondContact O-CG 3.13Å; S163-L167 PolarHBondContact O-N 2.85Å
164	L	93.2	Very high	88.9	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-64.4	-44.3	172.7	-74.8	169.2	0	0	0	112	I120 L139 V160 N161 N162 V166 L167 T168 I173 Y180	I120-L164 HydrophobicContact CG2-CD2 3.9Å; L139-L164 HydrophobicContact CD2-CD1 4.13Å; L139-L164 HydrophobicContact CD2-CD2 3.84Å; L139-L164 HydrophobicContact CD2-CG 4.32Å; V160-L164 HydrophobicContact CG1-CD1 3.94Å; V160-L164 HydrophobicContact CG1-CG 4.41Å; V160-L164 WeakPolarHBondContact O-CB 3.16Å; V160-L164 WeakPolarHBondContact O-CG 3.41Å; V160-L164 PolarHBondContact O-N 3.26Å; N161-L164 PolarHBondContact O-N 2.9Å; N162-L164 VanDerWaalsContact C-N 3.34Å; N162-L164 PolarHBondContact O-N 3.2Å; L164-V166 VanDerWaalsContact C-N 3.3Å; L164-V166 PolarHBondContact O-N 2.88Å; L164-L167 PolarHBondContact O-N 3.06Å; L164-T168 VanDerWaalsContact O-CB 3.31Å; L164-T168 WeakPolarHBondContact O-CB 3.4Å; L164-T168 PolarHBondContact O-N 3.33Å; L164-T168 PolarHBondContact O-OG1 3.16Å; L164-I173 HydrophobicContact CD2-CD1 3.48Å; L164-I173 VanDerWaalsContact CD2-CD1 3.48Å; L164-Y180 HydrophobicContact CD1-CD2 4.34Å; L164-Y180 HydrophobicContact CD1-CE2 3.81Å; L164-Y180 HydrophobicContact CD2-CD1 4.2Å; L164-Y180 HydrophobicContact CD2-CD2 4.02Å; L164-Y180 HydrophobicContact CD2-CE1 4.25Å; L164-Y180 HydrophobicContact CD2-CE2 4.09Å; L164-Y180 HydrophobicContact CD2-CG 4.07Å; L164-Y180 HydrophobicContact CG-CE2 4.43Å
165	A	89.8	Confident	89.1	Confident	41 Å²	41	46 Å²	46	34%	0.339	24%	0.243	S	C	.	.	H	α-helix	trans	-66.6	-32.5	176.3	0	0	0	0	0	112.4	N161 N162 R169	N161-A165 WeakPolarHBondContact O-CB 3.31Å; N161-A165 PolarHBondContact O-N 3.49Å; N162-A165 PolarHBondContact O-N 3.5Å; A165-R169 WeakPolarHBondContact O-CB 3.4Å; A165-R169 WeakPolarHBondContact O-CG 3.28Å; A165-R169 PolarHBondContact O-N 3.23Å; A165-R169 VanDerWaalsContact O-N 3.09Å; A165-R169 PolarHBondContact O-NE 2.98Å
166	V	88.1	Confident	89.1	Confident	28 Å²	28	45.4 Å²	45.4	17%	0.17	24%	0.24	C	C	.	.	H	α-helix	trans	-66.1	-51.8	173	156	0	0	0	0	110.7	E117 N162 S163 L164 T168 R169 A170 W409	E117-V166 HydrophobicContact CG-CG1 3.93Å; N162-V166 VanDerWaalsContact O-CB 3.3Å; N162-V166 WeakPolarHBondContact O-CB 3.35Å; N162-V166 VanDerWaalsContact O-CG2 3.23Å; N162-V166 WeakPolarHBondContact O-CG2 3.39Å; N162-V166 PolarHBondContact O-N 3.43Å; S163-V166 WeakPolarHBondContact O-CB 3.44Å; S163-V166 PolarHBondContact O-N 3.25Å; L164-V166 VanDerWaalsContact C-N 3.3Å; L164-V166 PolarHBondContact O-N 2.88Å; V166-T168 VanDerWaalsContact C-N 3.34Å; V166-T168 PolarHBondContact O-N 3.4Å; V166-R169 PolarHBondContact O-N 2.83Å; V166-A170 PolarHBondContact O-N 3.23Å; V166-A170 VanDerWaalsContact O-N 3.11Å; V166-W409 HydrophobicContact CB-CH2 4.37Å; V166-W409 HydrophobicContact CG1-CH2 3.41Å; V166-W409 VanDerWaalsContact CG1-CH2 3.41Å; V166-W409 HydrophobicContact CG1-CZ2 3.52Å; V166-W409 HydrophobicContact CG1-CZ3 4.05Å
167	L	88.9	Confident	88.9	Confident	1 Å²	1	45 Å²	45	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-63.2	-36	176.6	-74.5	169.4	0	0	0	113	E117 I120 C121 S163 L164 G171 A172 I173	E117-L167 HydrophobicContact CB-CD1 4.41Å; E117-L167 HydrophobicContact CB-CD2 3.98Å; E117-L167 HydrophobicContact CB-CG 4.2Å; E117-L167 HydrophobicContact CG-CD2 4.36Å; E117-L167 HydrophobicContact CG-CG 4.22Å; I120-L167 HydrophobicContact CB-CD1 4.08Å; I120-L167 HydrophobicContact CG2-CD1 3.61Å; C121-L167 VanDerWaalsContact SG-CD2 3.59Å; S163-L167 WeakPolarHBondContact O-CB 3.2Å; S163-L167 VanDerWaalsContact O-CG 3.24Å; S163-L167 WeakPolarHBondContact O-CG 3.13Å; S163-L167 PolarHBondContact O-N 2.85Å; L164-L167 PolarHBondContact O-N 3.06Å; L167-G171 PolarHBondContact O-N 2.99Å; L167-A172 HydrophobicContact CB-CB 4.26Å; L167-A172 HydrophobicContact CD2-CB 3.74Å; L167-A172 WeakPolarHBondContact O-CB 3.48Å; L167-A172 PolarHBondContact O-N 3Å; L167-I173 HydrophobicContact CB-CD1 3.64Å; L167-I173 HydrophobicContact CB-CG1 3.8Å; L167-I173 HydrophobicContact CD1-CD1 4.17Å
168	T	87.7	Confident	88.6	Confident	35 Å²	35	46.1 Å²	46.1	22%	0.215	25%	0.246	C	C	.	.	H	α-helix	trans	-69.3	-46.7	177.2	-55.8	0	0	0	0	110.8	L164 V166 A170 G171	L164-T168 VanDerWaalsContact O-CB 3.31Å; L164-T168 WeakPolarHBondContact O-CB 3.4Å; L164-T168 PolarHBondContact O-N 3.33Å; L164-T168 PolarHBondContact O-OG1 3.16Å; V166-T168 VanDerWaalsContact C-N 3.34Å; V166-T168 PolarHBondContact O-N 3.4Å; T168-A170 VanDerWaalsContact C-N 3.27Å; T168-A170 PolarHBondContact O-N 3.42Å; T168-G171 PolarHBondContact O-N 3.27Å
169	R	84.9	Confident	88.6	Confident	188 Å²	188	39.4 Å²	39.4	71%	0.709	21%	0.214	S	C	*	.	H	α-helix	trans	-60.6	-34.5	176.5	-83.6	174.8	-75.4	161.2	-8.9	113.2	A165 V166 G171	A165-R169 WeakPolarHBondContact O-CB 3.4Å; A165-R169 WeakPolarHBondContact O-CG 3.28Å; A165-R169 PolarHBondContact O-N 3.23Å; A165-R169 VanDerWaalsContact O-N 3.09Å; A165-R169 PolarHBondContact O-NE 2.98Å; V166-R169 PolarHBondContact O-N 2.83Å; R169-G171 VanDerWaalsContact C-N 3.27Å
170	A	80.3	Confident	88.6	Confident	26 Å²	26	37.6 Å²	37.6	22%	0.215	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	0.6	175.2	0	0	0	0	0	113.9	V166 T168 A172 R401 L405 W409	V166-A170 PolarHBondContact O-N 3.23Å; V166-A170 VanDerWaalsContact O-N 3.11Å; T168-A170 VanDerWaalsContact C-N 3.27Å; T168-A170 PolarHBondContact O-N 3.42Å; A170-A172 VanDerWaalsContact C-N 3.32Å; A170-A172 PolarHBondContact O-N 3.49Å; A170-R401 PolarHBondContact O-NH2 3.46Å; A170-L405 HydrophobicContact CB-CD2 3.4Å; A170-W409 HydrophobicContact CB-CH2 4.15Å; A170-W409 HydrophobicContact CB-CZ2 3.64Å
171	G	81.1	Confident	88.5	Confident	10 Å²	10	38.3 Å²	38.3	10%	0.103	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	37.4	-179.8	0	0	0	0	0	113.4	L167 T168 R169 R401	L167-G171 PolarHBondContact O-N 2.99Å; T168-G171 PolarHBondContact O-N 3.27Å; R169-G171 VanDerWaalsContact C-N 3.27Å; G171-R401 PolarHBondContact O-NE 3.04Å; G171-R401 PolarHBondContact O-NH2 3.35Å
172	A	80.5	Confident	88.2	Confident	1 Å²	1	35 Å²	35	1%	0.008	19%	0.188	C	C	.	.	S	Bend	trans	-82.8	-42.4	169.5	0	0	0	0	0	110.7	L167 A170 L182 L183 L405	L167-A172 HydrophobicContact CB-CB 4.26Å; L167-A172 HydrophobicContact CD2-CB 3.74Å; L167-A172 WeakPolarHBondContact O-CB 3.48Å; L167-A172 PolarHBondContact O-N 3Å; A170-A172 VanDerWaalsContact C-N 3.32Å; A170-A172 PolarHBondContact O-N 3.49Å; A172-L182 WeakPolarHBondContact O-CD2 3.37Å; A172-L183 PolarHBondContact O-N 3.43Å; A172-L405 HydrophobicContact CB-CD1 3.72Å; A172-L405 HydrophobicContact CB-CD2 4.16Å
173	I	88.9	Confident	87.7	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	162.1	177.2	66.4	-174.8	0	0	0	110.3	L164 L167 Y180 N181 L182	L164-I173 HydrophobicContact CD2-CD1 3.48Å; L164-I173 VanDerWaalsContact CD2-CD1 3.48Å; L167-I173 HydrophobicContact CB-CD1 3.64Å; L167-I173 HydrophobicContact CB-CG1 3.8Å; L167-I173 HydrophobicContact CD1-CD1 4.17Å; I173-Y180 HydrophobicContact CB-CD1 4.45Å; I173-Y180 HydrophobicContact CD1-CD1 3.53Å; I173-Y180 HydrophobicContact CD1-CE1 3.97Å; I173-Y180 HydrophobicContact CD1-CG 4.22Å; I173-Y180 HydrophobicContact CG1-CD1 3.97Å; I173-Y180 HydrophobicContact CG1-CE1 4.48Å; I173-N181 CarbonylContact C-O 3.58Å; I173-N181 VanDerWaalsContact CA-O 3.23Å; I173-N181 WeakPolarHBondContact CA-O 3.39Å; I173-N181 WeakPolarHBondContact CB-O 3.46Å; I173-L182 HydrophobicContact CG2-CD2 3.84Å; I173-L182 HydrophobicContact CG2-CG 4.4Å
174	Y	89.5	Confident	87	Confident	11 Å²	11	31.5 Å²	31.5	4%	0.043	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	161.8	166	69.5	-79.5	0	0	0	109.4	Y180 N181 L182 L183 K187 F470	Y174-Y180 WeakPolarHBondContact O-CA 3.48Å; Y174-N181 VanDerWaalsContact CD1-O 3.28Å; Y174-N181 WeakPolarHBondContact CD1-O 3.43Å; Y174-N181 HydrophobicContact CE1-CB 3.82Å; Y174-N181 PolarHBondContact N-O 3.14Å; Y174-N181 PolarHBondContact O-N 3.01Å; Y174-L182 WeakPolarHBondContact CE1-O 3.42Å; Y174-L183 HydrophobicContact CD1-CB 4.02Å; Y174-L183 HydrophobicContact CD1-CD1 3.95Å; Y174-L183 HydrophobicContact CG-CD1 4.48Å; Y174-K187 HydrophobicContact CE1-CD 3.75Å; Y174-K187 PolarHBondContact OH-NZ 2.85Å; Y174-F470 HydrophobicContact CD1-CE2 4.44Å; Y174-F470 AromaticContact CD2-CD2 3.32Å; Y174-F470 HydrophobicContact CD2-CD2 3.32Å; Y174-F470 AromaticContact CD2-CE2 3.43Å; Y174-F470 HydrophobicContact CD2-CE2 3.43Å; Y174-F470 VanDerWaalsContact CD2-CE2 3.43Å; Y174-F470 AromaticContact CD2-CG 3.99Å; Y174-F470 HydrophobicContact CD2-CG 3.99Å; Y174-F470 HydrophobicContact CD2-CZ 4.17Å; Y174-F470 HydrophobicContact CE1-CE2 4.46Å; Y174-F470 HydrophobicContact CE1-CZ 4.33Å; Y174-F470 HydrophobicContact CE2-CB 4.23Å; Y174-F470 AromaticContact CE2-CD1 3.78Å; Y174-F470 HydrophobicContact CE2-CD1 3.78Å; Y174-F470 AromaticContact CE2-CD2 3.27Å; Y174-F470 HydrophobicContact CE2-CD2 3.27Å; Y174-F470 AromaticContact CE2-CE1 3.93Å; Y174-F470 HydrophobicContact CE2-CE1 3.93Å; Y174-F470 AromaticContact CE2-CE2 3.46Å; Y174-F470 HydrophobicContact CE2-CE2 3.46Å; Y174-F470 VanDerWaalsContact CE2-CE2 3.46Å; Y174-F470 AromaticContact CE2-CG 3.46Å; Y174-F470 HydrophobicContact CE2-CG 3.46Å; Y174-F470 VanDerWaalsContact CE2-CG 3.46Å; Y174-F470 AromaticContact CE2-CZ 3.79Å; Y174-F470 HydrophobicContact CE2-CZ 3.79Å; Y174-F470 HydrophobicContact CG-CD2 4.27Å; Y174-F470 AromaticContact CG-CE2 3.95Å; Y174-F470 HydrophobicContact CG-CE2 3.95Å; Y174-F470 AromaticContact CZ-CE1 3.93Å; Y174-F470 AromaticContact CZ-CE2 3.99Å; Y174-F470 AromaticContact CZ-CZ 3.86Å
175	F	90.2	Very high	86	Confident	67 Å²	67	34.6 Å²	34.6	29%	0.294	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	124.6	173.8	-173.4	-102	0	0	0	109.6	G177 G179 Y180	F175-G177 WeakPolarHBondContact CE1-O 3.3Å; F175-G177 VanDerWaalsContact CZ-O 3.23Å; F175-G177 WeakPolarHBondContact CZ-O 3.44Å; F175-G179 CarbonylContact C-O 3.57Å; F175-G179 WeakPolarHBondContact CA-O 3.37Å; F175-G179 VanDerWaalsContact CD2-O 3.31Å; F175-G179 WeakPolarHBondContact CD2-O 3.49Å; F175-Y180 HydrophobicContact CB-CD1 4.29Å; F175-Y180 HydrophobicContact CB-CE1 4.08Å; F175-Y180 HydrophobicContact CD2-CD1 4.31Å; F175-Y180 HydrophobicContact CD2-CD2 4.02Å; F175-Y180 HydrophobicContact CD2-CE1 4.15Å; F175-Y180 AromaticContact CD2-CE2 3.82Å; F175-Y180 HydrophobicContact CD2-CE2 3.82Å; F175-Y180 HydrophobicContact CD2-CG 4.27Å; F175-Y180 AromaticContact CD2-CZ 3.91Å; F175-Y180 HydrophobicContact CE2-CE2 4.29Å
176	S	86.6	Confident	85.1	Confident	14 Å²	14	37 Å²	37	10%	0.098	19%	0.194	C	C	.	.			trans	-84.9	-10	-176.2	60.8	0	0	0	0	114.6	S133 H178 G179	S133-S176 WeakPolarHBondContact CB-OG 3.5Å; S133-S176 PolarHBondContact OG-OG 2.82Å; S176-H178 PolarHBondContact OG-N 3.49Å; S176-G179 PolarHBondContact N-O 2.86Å; S176-G179 PolarHBondContact OG-N 2.78Å; S176-G179 PolarHBondContact OG-O 3.44Å; S176-G179 VanDerWaalsContact OG-O 3.09Å
177	G	86.6	Confident	84.5	Confident	42 Å²	42	38 Å²	38	43%	0.433	20%	0.196	S	C	.	.	S	Bend	trans	106.9	-45.1	-164.5	0	0	0	0	0	111.5	F175	F175-G177 WeakPolarHBondContact CE1-O 3.3Å; F175-G177 VanDerWaalsContact CZ-O 3.23Å; F175-G177 WeakPolarHBondContact CZ-O 3.44Å
178	H	85.9	Confident	83.9	Confident	124 Å²	124	39.5 Å²	39.5	57%	0.574	20%	0.203	S	C	*	.	S	Bend	trans	-96.4	-16.6	180	-60.8	121.8	0	0	0	114.1	S176 D474	S176-H178 PolarHBondContact OG-N 3.49Å; H178-D474 IonicContact CE1-OD2 2.83Å; H178-D474 PolarHBondContact CE1-OD2 3.11Å; H178-D474 IonicContact CG-OD2 2.92Å; H178-D474 IonicContact ND1-OD2 3.29Å; H178-D474 PolarHBondContact ND1-OD2 2.94Å
179	G	91.9	Very high	83.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	171.6	-166.7	178.1	0	0	0	0	0	112.5	S133 C134 F175 S176	S133-G179 PolarHBondContact OG-N 2.98Å; C134-G179 CarbonylContact O-C 3.54Å; C134-G179 WeakPolarHBondContact O-CA 3.42Å; F175-G179 CarbonylContact C-O 3.57Å; F175-G179 WeakPolarHBondContact CA-O 3.37Å; F175-G179 VanDerWaalsContact CD2-O 3.31Å; F175-G179 WeakPolarHBondContact CD2-O 3.49Å; S176-G179 PolarHBondContact N-O 2.86Å; S176-G179 PolarHBondContact OG-N 2.78Å; S176-G179 PolarHBondContact OG-O 3.44Å; S176-G179 VanDerWaalsContact OG-O 3.09Å
180	Y	93	Very high	82.8	Confident	38 Å²	38	32.8 Å²	32.8	15%	0.149	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	143.4	175.7	-69.8	-86.4	0	0	0	112.1	C134 V136 L164 I173 Y174 F175	C134-Y180 PolarHBondContact N-O 3.5Å; C134-Y180 PolarHBondContact O-N 3.05Å; V136-Y180 HydrophobicContact CG2-CD2 4.2Å; V136-Y180 HydrophobicContact CG2-CE2 3.71Å; L164-Y180 HydrophobicContact CD1-CD2 4.34Å; L164-Y180 HydrophobicContact CD1-CE2 3.81Å; L164-Y180 HydrophobicContact CD2-CD1 4.2Å; L164-Y180 HydrophobicContact CD2-CD2 4.02Å; L164-Y180 HydrophobicContact CD2-CE1 4.25Å; L164-Y180 HydrophobicContact CD2-CE2 4.09Å; L164-Y180 HydrophobicContact CD2-CG 4.07Å; L164-Y180 HydrophobicContact CG-CE2 4.43Å; I173-Y180 HydrophobicContact CB-CD1 4.45Å; I173-Y180 HydrophobicContact CD1-CD1 3.53Å; I173-Y180 HydrophobicContact CD1-CE1 3.97Å; I173-Y180 HydrophobicContact CD1-CG 4.22Å; I173-Y180 HydrophobicContact CG1-CD1 3.97Å; I173-Y180 HydrophobicContact CG1-CE1 4.48Å; Y174-Y180 WeakPolarHBondContact O-CA 3.48Å; F175-Y180 HydrophobicContact CB-CD1 4.29Å; F175-Y180 HydrophobicContact CB-CE1 4.08Å; F175-Y180 HydrophobicContact CD2-CD1 4.31Å; F175-Y180 HydrophobicContact CD2-CD2 4.02Å; F175-Y180 HydrophobicContact CD2-CE1 4.15Å; F175-Y180 AromaticContact CD2-CE2 3.82Å; F175-Y180 HydrophobicContact CD2-CE2 3.82Å; F175-Y180 HydrophobicContact CD2-CG 4.27Å; F175-Y180 AromaticContact CD2-CZ 3.91Å; F175-Y180 HydrophobicContact CE2-CE2 4.29Å
181	N	91	Very high	82.5	Confident	17 Å²	17	31.6 Å²	31.6	9%	0.091	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	160.3	170.7	-163.5	-32.8	0	0	0	109.2	T128 P132 I173 Y174 K187	T128-N181 HydrophobicContact CG2-CB 4.15Å; P132-N181 PolarHBondContact O-ND2 3.06Å; I173-N181 CarbonylContact C-O 3.58Å; I173-N181 VanDerWaalsContact CA-O 3.23Å; I173-N181 WeakPolarHBondContact CA-O 3.39Å; I173-N181 WeakPolarHBondContact CB-O 3.46Å; Y174-N181 VanDerWaalsContact CD1-O 3.28Å; Y174-N181 WeakPolarHBondContact CD1-O 3.43Å; Y174-N181 HydrophobicContact CE1-CB 3.82Å; Y174-N181 PolarHBondContact N-O 3.14Å; Y174-N181 PolarHBondContact O-N 3.01Å; N181-K187 VanDerWaalsContact CG-NZ 3.27Å; N181-K187 PolarHBondContact ND2-NZ 2.7Å; N181-K187 PolarHBondContact OD1-NZ 3.39Å; N181-K187 VanDerWaalsContact OD1-NZ 3.08Å
182	L	87.7	Confident	82.4	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	137.2	-176.9	-75.9	158.2	0	0	0	111.5	C121 V124 W125 A172 I173 Y174 T184 F394 W397	C121-L182 HydrophobicContact CB-CD2 4.15Å; V124-L182 HydrophobicContact CG1-CD1 4.45Å; V124-L182 HydrophobicContact CG1-CG 4.1Å; W125-L182 HydrophobicContact CB-CD1 3.53Å; W125-L182 HydrophobicContact CG-CD1 4.35Å; A172-L182 WeakPolarHBondContact O-CD2 3.37Å; I173-L182 HydrophobicContact CG2-CD2 3.84Å; I173-L182 HydrophobicContact CG2-CG 4.4Å; Y174-L182 WeakPolarHBondContact CE1-O 3.42Å; L182-T184 PolarHBondContact O-N 3.32Å; L182-F394 HydrophobicContact CB-CZ 4.48Å; L182-F394 HydrophobicContact CD1-CZ 3.94Å; L182-W397 HydrophobicContact CB-CH2 3.85Å; L182-W397 HydrophobicContact CB-CZ3 3.85Å; L182-W397 HydrophobicContact CD2-CH2 4.08Å; L182-W397 HydrophobicContact CD2-CZ3 4.32Å; L182-W397 HydrophobicContact CG-CZ3 4.48Å
183	L	84	Confident	82.4	Confident	5 Å²	5	39.5 Å²	39.5	3%	0.026	21%	0.207	C	C	.	.			trans	-92.3	76.8	-172.2	-173	57.4	0	0	0	111.5	A172 Y174 K187 L188 W397	A172-L183 PolarHBondContact O-N 3.43Å; Y174-L183 HydrophobicContact CD1-CB 4.02Å; Y174-L183 HydrophobicContact CD1-CD1 3.95Å; Y174-L183 HydrophobicContact CG-CD1 4.48Å; L183-K187 HydrophobicContact CD1-CB 4.1Å; L183-L188 HydrophobicContact CD1-CB 4.34Å; L183-L188 HydrophobicContact CD2-CD1 4.29Å; L183-L188 HydrophobicContact CG-CB 4.34Å; L183-W397 VanDerWaalsContact C-CZ2 3.47Å; L183-W397 WeakPolarHBondContact O-CZ2 3.37Å
184	T	77.3	Confident	81.8	Confident	12 Å²	12	42.1 Å²	42.1	7%	0.074	22%	0.221	C	C	.	.			trans	-57.9	161.2	176.6	62.4	0	0	0	0	112.4	L182 E186 K187 L188 F394 W397	L182-T184 PolarHBondContact O-N 3.32Å; T184-E186 PolarHBondContact O-N 3.19Å; T184-K187 PolarHBondContact O-N 2.86Å; T184-K187 WeakPolarHBondContact OG1-CB 3.09Å; T184-K187 VanDerWaalsContact OG1-CG 3.3Å; T184-K187 WeakPolarHBondContact OG1-CG 3.38Å; T184-K187 PolarHBondContact OG1-N 2.97Å; T184-L188 WeakPolarHBondContact O-CB 3.4Å; T184-L188 PolarHBondContact O-N 3.23Å; T184-F394 HydrophobicContact CG2-CD2 3.73Å; T184-F394 HydrophobicContact CG2-CE2 3.58Å; T184-W397 HydrophobicContact CG2-CD2 4.24Å; T184-W397 HydrophobicContact CG2-CE3 3.96Å; T184-W397 HydrophobicContact CG2-CZ3 4.2Å
185	P	71.3	Confident	81.2	Confident	65 Å²	65	45.4 Å²	45.4	42%	0.422	24%	0.237	S	C	.	.	H	α-helix	trans	-65.8	-34.1	-177.7	-15.7	32.3	0	0	0	111.1	L188 A189 W397	P185-L188 CarbonylContact O-C 3.5Å; P185-L188 PolarHBondContact O-N 2.9Å; P185-A189 VanDerWaalsContact O-CB 3.24Å; P185-A189 WeakPolarHBondContact O-CB 3.21Å; P185-A189 PolarHBondContact O-N 3.44Å; P185-W397 HydrophobicContact CG-CB 4.43Å; P185-W397 HydrophobicContact CG-CG 3.87Å
186	E	71.3	Confident	80.7	Confident	92 Å²	92	47.1 Å²	47.1	43%	0.43	25%	0.253	S	S	.	.	H	α-helix	trans	-58.8	-55.9	170.9	178.6	-177.4	-134.8	0	0	111.3	T184 L188 A189 V190 A219 E220	T184-E186 PolarHBondContact O-N 3.19Å; E186-L188 VanDerWaalsContact C-N 3.27Å; E186-L188 PolarHBondContact O-N 3.39Å; E186-A189 PolarHBondContact O-N 3.16Å; E186-A189 VanDerWaalsContact O-N 3.08Å; E186-V190 WeakPolarHBondContact O-CG2 3.45Å; E186-V190 PolarHBondContact O-N 3.45Å; E186-A219 HydrophobicContact CG-CB 3.94Å; E186-A219 VanDerWaalsContact OE1-CA 3.28Å; E186-A219 WeakPolarHBondContact OE1-CA 3.47Å; E186-A219 VanDerWaalsContact OE1-CB 3.28Å; E186-A219 WeakPolarHBondContact OE1-CB 3.46Å; E186-E220 PolarHBondContact OE1-N 3.01Å
187	K	76.6	Confident	80.3	Confident	50 Å²	50	48.9 Å²	48.9	22%	0.217	26%	0.263	C	S	.	.	H	α-helix	trans	-59.7	-36.3	174.5	-73.5	179.1	-178.6	-172.5	0	112.7	Y174 N181 L183 T184 A191 F470	Y174-K187 HydrophobicContact CE1-CD 3.75Å; Y174-K187 PolarHBondContact OH-NZ 2.85Å; N181-K187 VanDerWaalsContact CG-NZ 3.27Å; N181-K187 PolarHBondContact ND2-NZ 2.7Å; N181-K187 PolarHBondContact OD1-NZ 3.39Å; N181-K187 VanDerWaalsContact OD1-NZ 3.08Å; L183-K187 HydrophobicContact CD1-CB 4.1Å; T184-K187 PolarHBondContact O-N 2.86Å; T184-K187 WeakPolarHBondContact OG1-CB 3.09Å; T184-K187 VanDerWaalsContact OG1-CG 3.3Å; T184-K187 WeakPolarHBondContact OG1-CG 3.38Å; T184-K187 PolarHBondContact OG1-N 2.97Å; K187-A191 WeakPolarHBondContact O-CB 3.49Å; K187-A191 PolarHBondContact O-N 3.26Å; K187-F470 HydrophobicContact CB-CZ 4.28Å
188	L	75.3	Confident	79.7	Confident	31 Å²	31	51.3 Å²	51.3	16%	0.162	27%	0.271	C	S	.	.	H	α-helix	trans	-70.1	-34.9	175.3	-178.9	61.8	0	0	0	112.2	L183 T184 P185 E186 K192 F461	L183-L188 HydrophobicContact CD1-CB 4.34Å; L183-L188 HydrophobicContact CD2-CD1 4.29Å; L183-L188 HydrophobicContact CG-CB 4.34Å; T184-L188 WeakPolarHBondContact O-CB 3.4Å; T184-L188 PolarHBondContact O-N 3.23Å; P185-L188 CarbonylContact O-C 3.5Å; P185-L188 PolarHBondContact O-N 2.9Å; E186-L188 VanDerWaalsContact C-N 3.27Å; E186-L188 PolarHBondContact O-N 3.39Å; L188-K192 HydrophobicContact CD1-CG 4.49Å; L188-K192 HydrophobicContact CG-CD 4.41Å; L188-K192 WeakPolarHBondContact O-CB 3.25Å; L188-K192 VanDerWaalsContact O-CG 3.26Å; L188-K192 WeakPolarHBondContact O-CG 3.47Å; L188-K192 PolarHBondContact O-N 2.81Å; L188-F461 HydrophobicContact CD1-CZ 4.44Å
189	A	74.3	Confident	78.4	Confident	41 Å²	41	51.7 Å²	51.7	34%	0.339	27%	0.273	S	S	.	.	H	α-helix	trans	-71.4	-40.6	175.2	0	0	0	0	0	111.3	P185 E186 K192 W193 P217	P185-A189 VanDerWaalsContact O-CB 3.24Å; P185-A189 WeakPolarHBondContact O-CB 3.21Å; P185-A189 PolarHBondContact O-N 3.44Å; E186-A189 PolarHBondContact O-N 3.16Å; E186-A189 VanDerWaalsContact O-N 3.08Å; A189-K192 PolarHBondContact O-N 2.92Å; A189-W193 VanDerWaalsContact O-CB 3.29Å; A189-W193 WeakPolarHBondContact O-CB 3.34Å; A189-W193 PolarHBondContact O-N 3.32Å; A189-P217 HydrophobicContact CB-CG 4.5Å
190	V	75.5	Confident	76.6	Confident	42 Å²	42	58.8 Å²	58.8	26%	0.255	31%	0.309	S	S	.	.	H	α-helix	trans	-61.7	-47.9	171.2	172.9	0	0	0	0	110.6	E186 K192 W193 L194 P217	E186-V190 WeakPolarHBondContact O-CG2 3.45Å; E186-V190 PolarHBondContact O-N 3.45Å; V190-K192 PolarHBondContact O-N 2.84Å; V190-W193 PolarHBondContact O-N 2.87Å; V190-L194 HydrophobicContact CG1-CD1 4.19Å; V190-L194 WeakPolarHBondContact O-CG 2.99Å; V190-L194 PolarHBondContact O-N 2.88Å; V190-P217 HydrophobicContact CG2-CG 4.2Å
191	A	74.9	Confident	74	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.008	33%	0.334	C	S	.	.	H	α-helix	trans	-59.7	-46.2	176.9	0	0	0	0	0	112.3	K187 W193 L194 E195 L466 C469	K187-A191 WeakPolarHBondContact O-CB 3.49Å; K187-A191 PolarHBondContact O-N 3.26Å; A191-W193 VanDerWaalsContact C-N 3.32Å; A191-W193 PolarHBondContact O-N 2.87Å; A191-L194 PolarHBondContact O-N 3.3Å; A191-E195 PolarHBondContact O-N 2.87Å; A191-L466 HydrophobicContact CB-CD2 4.41Å; A191-C469 HydrophobicContact CB-CB 4.21Å
192	K	77.8	Confident	71.5	Confident	108 Å²	108	67.4 Å²	67.4	47%	0.47	37%	0.37	S	S	.	.	H	α-helix	trans	-64.9	-31.8	175	-76.3	178.1	174.8	-170.7	0	113.6	L188 A189 V190 F461	L188-K192 HydrophobicContact CD1-CG 4.49Å; L188-K192 HydrophobicContact CG-CD 4.41Å; L188-K192 WeakPolarHBondContact O-CB 3.25Å; L188-K192 VanDerWaalsContact O-CG 3.26Å; L188-K192 WeakPolarHBondContact O-CG 3.47Å; L188-K192 PolarHBondContact O-N 2.81Å; A189-K192 PolarHBondContact O-N 2.92Å; V190-K192 PolarHBondContact O-N 2.84Å; K192-F461 HydrophobicContact CG-CZ 4.25Å
193	W	81.7	Confident	69.1	Low	69 Å²	69	73.5 Å²	73.5	26%	0.261	40%	0.402	S	S	.	.	H	α-helix	trans	-70.3	-42	174	173.8	82.8	0	0	0	110.8	A189 V190 A191 E195 T196 V197 K214 A216 P217	A189-W193 VanDerWaalsContact O-CB 3.29Å; A189-W193 WeakPolarHBondContact O-CB 3.34Å; A189-W193 PolarHBondContact O-N 3.32Å; V190-W193 PolarHBondContact O-N 2.87Å; A191-W193 VanDerWaalsContact C-N 3.32Å; A191-W193 PolarHBondContact O-N 2.87Å; W193-E195 VanDerWaalsContact C-N 3.29Å; W193-E195 PolarHBondContact O-N 2.7Å; W193-T196 WeakPolarHBondContact O-CA 3.37Å; W193-T196 PolarHBondContact O-N 2.96Å; W193-T196 PolarHBondContact O-OG1 3.39Å; W193-V197 HydrophobicContact CD2-CG2 4.42Å; W193-V197 HydrophobicContact CE3-CG2 4.42Å; W193-V197 HydrophobicContact CH2-CG2 4Å; W193-V197 HydrophobicContact CZ2-CG2 4Å; W193-V197 HydrophobicContact CZ3-CG2 4.23Å; W193-V197 PolarHBondContact O-N 2.8Å; W193-K214 PolarHBondContact NE1-O 3.33Å; W193-A216 HydrophobicContact CD2-CB 4.02Å; W193-A216 VanDerWaalsContact CE2-CA 3.49Å; W193-A216 HydrophobicContact CE3-CB 3.97Å; W193-A216 HydrophobicContact CH2-CB 3.72Å; W193-A216 HydrophobicContact CZ2-CB 3.73Å; W193-A216 HydrophobicContact CZ3-CB 3.81Å; W193-P217 HydrophobicContact CB-CG 4.21Å; W193-P217 HydrophobicContact CG-CG 4.49Å
194	L	76.4	Confident	67.1	Low	54 Å²	54	79.5 Å²	79.5	28%	0.283	44%	0.439	S	S	.	.	H	α-helix	trans	-60.6	-36	173.4	-70.9	171.4	0	0	0	112.3	V190 A191 T196 V197 C469	V190-L194 HydrophobicContact CG1-CD1 4.19Å; V190-L194 WeakPolarHBondContact O-CG 2.99Å; V190-L194 PolarHBondContact O-N 2.88Å; A191-L194 PolarHBondContact O-N 3.3Å; L194-T196 PolarHBondContact O-N 3.5Å; L194-V197 PolarHBondContact O-N 2.84Å; L194-V197 VanDerWaalsContact O-N 3.12Å; L194-C469 HydrophobicContact CD1-CB 4.05Å
195	E	76.3	Confident	65.2	Low	81 Å²	81	88.8 Å²	88.8	38%	0.379	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-10.6	171.2	-70.8	-177.3	139.9	0	0	114.1	A191 W193 F461 N465	A191-E195 PolarHBondContact O-N 2.87Å; W193-E195 VanDerWaalsContact C-N 3.29Å; W193-E195 PolarHBondContact O-N 2.7Å; E195-F461 WeakPolarHBondContact OE2-CE1 3.29Å; E195-N465 WeakPolarHBondContact OE1-CB 3.28Å; E195-N465 PolarHBondContact OE1-ND2 3.37Å
196	T	80.2	Confident	63.8	Low	103 Å²	103	89.8 Å²	89.8	63%	0.632	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	-3.6	172.4	65.5	0	0	0	0	114.2	W193 L194	W193-T196 WeakPolarHBondContact O-CA 3.37Å; W193-T196 PolarHBondContact O-N 2.96Å; W193-T196 PolarHBondContact O-OG1 3.39Å; L194-T196 PolarHBondContact O-N 3.5Å
197	V	76.5	Confident	62.1	Low	51 Å²	51	92.8 Å²	92.8	31%	0.309	52%	0.515	S	S	.	.	S	Bend	trans	-83.7	124.2	173.8	-178.4	0	0	0	0	108.4	W193 L194	W193-V197 HydrophobicContact CD2-CG2 4.42Å; W193-V197 HydrophobicContact CE3-CG2 4.42Å; W193-V197 HydrophobicContact CH2-CG2 4Å; W193-V197 HydrophobicContact CZ2-CG2 4Å; W193-V197 HydrophobicContact CZ3-CG2 4.23Å; W193-V197 PolarHBondContact O-N 2.8Å; L194-V197 PolarHBondContact O-N 2.84Å; L194-V197 VanDerWaalsContact O-N 3.12Å
198	P	73.8	Confident	60.9	Low	93 Å²	93	97.2 Å²	97.2	60%	0.604	54%	0.54	S	S	*	.			trans	-58.5	145.5	177	-24.7	34.7	0	0	0	112.4	I200	P198-I200 PolarHBondContact O-N 3.24Å
199	E	60.3	Low	59.1	Low	131 Å²	131	103.5 Å²	103.5	61%	0.612	57%	0.574	S	S	*	*			trans	-69.1	101.2	168.4	-58.1	-160.8	-154.9	0	0	109.2	C201 R468	E199-C201 VanDerWaalsContact C-N 3.32Å; E199-C201 PolarHBondContact O-N 2.73Å; E199-R468 VanDerWaalsContact CD-CZ 3.45Å; E199-R468 VanDerWaalsContact CD-NH2 3.27Å; E199-R468 IonicContact OE1-CZ 3.69Å; E199-R468 IonicContact OE1-NH1 2.8Å; E199-R468 PolarHBondContact OE1-NH1 2.97Å; E199-R468 IonicContact OE1-NH2 3.92Å; E199-R468 IonicContact OE2-CZ 3.18Å; E199-R468 IonicContact OE2-NH1 2.85Å; E199-R468 PolarHBondContact OE2-NH1 2.75Å; E199-R468 IonicContact OE2-NH2 2.68Å; E199-R468 PolarHBondContact OE2-NH2 2.83Å
200	I	53.8	Low	57.4	Low	150 Å²	150	106.9 Å²	106.9	77%	0.769	59%	0.594	S	S	*	*			trans	-71.8	93.2	169.5	-54.3	176.4	0	0	0	107.1	P198 T202	P198-I200 PolarHBondContact O-N 3.24Å; I200-T202 PolarHBondContact O-N 2.77Å
201	C	38.7	Very low	55.7	Low	99 Å²	99	110.5 Å²	110.5	67%	0.669	62%	0.618	S	S	*	*			trans	-58.9	122	168.2	-65.5	0	0	0	0	108.5	E199 D203	E199-C201 VanDerWaalsContact C-N 3.32Å; E199-C201 PolarHBondContact O-N 2.73Å; C201-D203 PolarHBondContact O-N 3.21Å
202	T	38.8	Very low	54.1	Low	137 Å²	137	116.7 Å²	116.7	84%	0.84	66%	0.656	S	S	*	*			trans	-81.6	54.5	179.5	53.8	0	0	0	0	111.2	I200	I200-T202 PolarHBondContact O-N 2.77Å
203	D	36.6	Very low	52.7	Low	128 Å²	128	117.6 Å²	117.6	68%	0.684	67%	0.665	S	S	*	*			trans	-132.8	127	178.1	-77.5	-59.8	0	0	0	109.8	C201	C201-D203 PolarHBondContact O-N 3.21Å
204	T	41.6	Very low	51.4	Low	131 Å²	131	122.9 Å²	122.9	80%	0.804	69%	0.69	S	S	*	*	S	Bend	trans	68.7	130	178.6	69.1	0	0	0	0	117.9	S206	T204-S206 PolarHBondContact O-N 2.91Å
205	E	37.4	Very low	50.4	Low	207 Å²	207	125.5 Å²	125.5	97%	0.967	71%	0.713	S	S	*	*			trans	-70.5	107	169.3	-60.7	174.6	129	0	0	109.7
206	S	42.9	Very low	49.2	Very low	87 Å²	87	123.7 Å²	123.7	61%	0.608	71%	0.712	S	S	*	*			trans	-142.9	120	167	54.7	0	0	0	0	111.3	T204 L208	T204-S206 PolarHBondContact O-N 2.91Å; S206-L208 PolarHBondContact O-N 3.3Å
207	V	35.7	Very low	47.7	Very low	155 Å²	155	121.5 Å²	121.5	94%	0.939	70%	0.699	S	S	*	*			trans	-79.8	107.1	177.4	178	0	0	0	0	108.2
208	L	49.6	Very low	46.1	Very low	143 Å²	143	127 Å²	127	75%	0.749	73%	0.726	S	S	*	*			trans	-141.8	137.6	177.6	-95.3	166.1	0	0	0	111.4	S206 C210	S206-L208 PolarHBondContact O-N 3.3Å; L208-C210 PolarHBondContact O-N 2.9Å
209	D	38.7	Very low	44.5	Very low	162 Å²	162	124.4 Å²	124.4	87%	0.866	71%	0.712	S	S	*	*			trans	-66.3	119.5	-169.5	-60.1	-80	0	0	0	113.7	P211	D209-P211 WeakPolarHBondContact O-CD 3.5Å
210	C	38.6	Very low	43.3	Very low	113 Å²	113	126.9 Å²	126.9	76%	0.764	72%	0.724	S	S	*	*			trans	-92.7	113.4	172.1	-80.2	0	0	0	0	110.9	L208 T212	L208-C210 PolarHBondContact O-N 2.9Å; C210-T212 PolarHBondContact O-N 2.7Å
211	P	40.4	Very low	42.5	Very low	118 Å²	118	125.9 Å²	125.9	77%	0.766	73%	0.725	S	S	*	*			trans	-75.7	109.6	-175.4	29.2	-34.5	0	0	0	112.5	D209	D209-P211 WeakPolarHBondContact O-CD 3.5Å
212	T	40.7	Very low	42	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	72%	0.72	S	S	*	*			trans	42.1	74.8	162.1	53.2	0	0	0	0	115.8	C210 K214	C210-T212 PolarHBondContact O-N 2.7Å; T212-K214 PolarHBondContact O-N 3.28Å
213	L	48.4	Very low	41.6	Very low	127 Å²	127	125.7 Å²	125.7	67%	0.665	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-55.3	122.3	164.1	-81.6	167.2	0	0	0	110	S215	L213-S215 PolarHBondContact O-N 2.99Å
214	K	54.2	Low	41.4	Very low	180 Å²	180	127.4 Å²	127.4	78%	0.783	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-69.9	127.4	172.4	-69	176.7	-178.8	172.3	0	108.7	W193 T212	W193-K214 PolarHBondContact NE1-O 3.33Å; T212-K214 PolarHBondContact O-N 3.28Å
215	S	55.4	Low	40.8	Very low	110 Å²	110	125.2 Å²	125.2	77%	0.769	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-51.4	140.8	177.9	55	0	0	0	0	111.5	L213	L213-S215 PolarHBondContact O-N 2.99Å
216	A	51.3	Low	40.5	Very low	42 Å²	42	123.9 Å²	123.9	35%	0.347	71%	0.705	S	S	.	*	P	Polyproline II helix	trans	-54.4	145.5	175.2	0	0	0	0	0	111.2	W193 L218	W193-A216 HydrophobicContact CD2-CB 4.02Å; W193-A216 VanDerWaalsContact CE2-CA 3.49Å; W193-A216 HydrophobicContact CE3-CB 3.97Å; W193-A216 HydrophobicContact CH2-CB 3.72Å; W193-A216 HydrophobicContact CZ2-CB 3.73Å; W193-A216 HydrophobicContact CZ3-CB 3.81Å; A216-L218 PolarHBondContact O-N 2.93Å
217	P	49	Very low	39.8	Very low	57 Å²	57	127 Å²	127	37%	0.37	72%	0.715	S	S	.	*			trans	-62.7	107.3	165.6	27.3	-31.8	0	0	0	108	A189 V190 W193 A219	A189-P217 HydrophobicContact CB-CG 4.5Å; V190-P217 HydrophobicContact CG2-CG 4.2Å; W193-P217 HydrophobicContact CB-CG 4.21Å; W193-P217 HydrophobicContact CG-CG 4.49Å; P217-A219 PolarHBondContact O-N 2.8Å; P217-A219 VanDerWaalsContact O-N 3.08Å
218	L	42.4	Very low	39.7	Very low	167 Å²	167	124.3 Å²	124.3	87%	0.874	71%	0.709	S	S	*	*			trans	-62.4	110.9	178.2	-81.8	164.4	0	0	0	109.4	A216	A216-L218 PolarHBondContact O-N 2.93Å
219	A	41.1	Very low	38.7	Very low	38 Å²	38	122.7 Å²	122.7	31%	0.314	71%	0.71	S	S	.	*			trans	-67.5	143.7	163	0	0	0	0	0	109.2	E186 P217 T221	E186-A219 HydrophobicContact CG-CB 3.94Å; E186-A219 VanDerWaalsContact OE1-CA 3.28Å; E186-A219 WeakPolarHBondContact OE1-CA 3.47Å; E186-A219 VanDerWaalsContact OE1-CB 3.28Å; E186-A219 WeakPolarHBondContact OE1-CB 3.46Å; P217-A219 PolarHBondContact O-N 2.8Å; P217-A219 VanDerWaalsContact O-N 3.08Å; A219-T221 PolarHBondContact O-N 3.42Å; A219-T221 PolarHBondContact O-OG1 3.43Å
220	E	33.4	Very low	38.4	Very low	183 Å²	183	123 Å²	123	86%	0.855	71%	0.71	S	S	*	*			trans	-72.6	94.7	178.2	-71.8	-174.6	162.2	0	0	109.6	E186 E222	E186-E220 PolarHBondContact OE1-N 3.01Å; E220-E222 PolarHBondContact O-N 3.4Å
221	T	36.6	Very low	38.2	Very low	129 Å²	129	122.3 Å²	122.3	79%	0.791	71%	0.707	S	S	*	*			trans	-76	83.7	-174.5	9.3	0	0	0	0	111.8	A219	A219-T221 PolarHBondContact O-N 3.42Å; A219-T221 PolarHBondContact O-OG1 3.43Å
222	E	29.6	Very low	37.6	Very low	120 Å²	120	123.5 Å²	123.5	56%	0.561	71%	0.707	S	S	*	*			trans	-46.3	120.6	167.5	-86.1	-74.1	-179.8	0	0	111.1	E220 F224	E220-E222 PolarHBondContact O-N 3.4Å; E222-F224 PolarHBondContact O-N 3.06Å
223	P	31	Very low	37.4	Very low	112 Å²	112	122.5 Å²	122.5	73%	0.727	70%	0.703	S	S	*	*			trans	-69.9	108.9	-172.2	25.9	-33.8	0	0	0	111.3	A225	P223-A225 VanDerWaalsContact C-N 3.3Å; P223-A225 PolarHBondContact O-N 3.42Å
224	F	30.7	Very low	36.7	Very low	165 Å²	165	122 Å²	122	72%	0.724	71%	0.705	S	S	*	*			trans	-64.6	87.9	169.1	-89.1	-97.7	0	0	0	110.6	E222 Q226	E222-F224 PolarHBondContact O-N 3.06Å; F224-Q226 VanDerWaalsContact C-N 3.35Å; F224-Q226 PolarHBondContact O-N 3.04Å
225	A	28.8	Very low	35.6	Very low	85 Å²	85	120.2 Å²	120.2	70%	0.702	70%	0.704	S	S	*	*			trans	-62.8	89.6	175.6	0	0	0	0	0	111.4	P223 N227	P223-A225 VanDerWaalsContact C-N 3.3Å; P223-A225 PolarHBondContact O-N 3.42Å; A225-N227 PolarHBondContact O-N 2.7Å
226	Q	32.2	Very low	34.5	Very low	178 Å²	178	126.8 Å²	126.8	83%	0.832	71%	0.712	S	S	*	*			trans	-78.9	99.7	167	-67.8	-169.2	13.8	0	0	108.9	F224 A228	F224-Q226 VanDerWaalsContact C-N 3.35Å; F224-Q226 PolarHBondContact O-N 3.04Å; Q226-A228 VanDerWaalsContact C-N 3.27Å; Q226-A228 PolarHBondContact O-N 2.85Å
227	N	28.5	Very low	33.4	Very low	152 Å²	152	129.6 Å²	129.6	81%	0.813	73%	0.727	S	S	*	*			trans	-70.3	85.5	170.3	-70.2	-5.2	0	0	0	109.6	A225 S229	A225-N227 PolarHBondContact O-N 2.7Å; N227-S229 PolarHBondContact O-N 3.47Å
228	A	33	Very low	32.6	Very low	99 Å²	99	133.6 Å²	133.6	82%	0.818	75%	0.746	S	S	*	*			trans	-68.6	114.5	170.8	0	0	0	0	0	109.7	Q226	Q226-A228 VanDerWaalsContact C-N 3.27Å; Q226-A228 PolarHBondContact O-N 2.85Å
229	S	28.1	Very low	32.1	Very low	109 Å²	109	133 Å²	133	76%	0.762	74%	0.742	S	S	*	*			trans	-82	126.6	175.2	54.7	0	0	0	0	111.3	N227	N227-S229 PolarHBondContact O-N 3.47Å
230	L	33.2	Very low	31.7	Very low	168 Å²	168	136.4 Å²	136.4	88%	0.88	76%	0.759	S	S	*	*			trans	-158	130.3	155.9	-106.2	154.8	0	0	0	111.6
231	S	34.2	Very low	31.6	Very low	100 Å²	100	135.3 Å²	135.3	70%	0.699	75%	0.754	S	S	*	*			trans	-9.3	140.9	166.6	54.2	0	0	0	0	122.5
232	D	27.4	Very low	31.5	Very low	143 Å²	143	135.4 Å²	135.4	77%	0.765	75%	0.749	S	S	*	*			trans	-31.8	156.6	140.4	-102.7	-61.1	0	0	0	114.4
233	P	35.9	Very low	31.6	Very low	109 Å²	109	135.6 Å²	135.6	71%	0.708	75%	0.754	S	S	*	*				-152.4	156.3	52.1	41.1	-20.1	0	0	0	120.6
234	V	35.8	Very low	31.7	Very low	116 Å²	116	136.8 Å²	136.8	70%	0.703	75%	0.754	S	S	*	*			trans	59	120.2	133.5	177.7	0	0	0	0	121.4
235	N	30.7	Very low	32	Very low	142 Å²	142	136.7 Å²	136.7	76%	0.759	76%	0.756	S	S	*	*			trans	23.4	123.7	145.8	-61.7	-32	0	0	0	121
236	R	32.2	Very low	32.2	Very low	249 Å²	249	139.8 Å²	139.8	94%	0.94	76%	0.76	S	S	*	*				-156.2	155.3	102.7	-111	173.3	-176.4	177.9	1.6	112.4
237	C	28.5	Very low	32.2	Very low	100 Å²	100	141.9 Å²	141.9	68%	0.676	76%	0.76	S	S	*	*			trans	-105.5	175.5	-175.1	-51	0	0	0	0	112.1
238	N	31.9	Very low	32.4	Very low	142 Å²	142	141.7 Å²	141.7	76%	0.759	76%	0.759	S	S	*	*			trans	94.6	130.2	144.3	-67.7	-12.1	0	0	0	120.9
239	I	32.2	Very low	32.3	Very low	153 Å²	153	141.9 Å²	141.9	79%	0.785	76%	0.761	S	S	*	*			trans	80.4	143.1	139.1	-72	163.4	0	0	0	118.7
240	V	31.1	Very low	32.5	Very low	111 Å²	111	146.4 Å²	146.4	67%	0.673	77%	0.767	S	S	*	*			cis	-174.9	155.7	-42.1	119.4	0	0	0	0	109.8
241	Q	32.6	Very low	32.6	Very low	160 Å²	160	148 Å²	148	75%	0.748	77%	0.769	S	S	*	*			trans	75.7	149.6	157.5	-97.3	162.7	-5.7	0	0	122.8
242	N	33.5	Very low	32.6	Very low	130 Å²	130	152.8 Å²	152.8	70%	0.695	78%	0.778	S	S	*	*			trans	73.7	148.7	150.5	-62.2	-13.4	0	0	0	120.6
243	N	31.7	Very low	32.9	Very low	124 Å²	124	153 Å²	153	66%	0.663	78%	0.784	S	S	*	*			cis	-166.5	162.2	-41.1	-133.4	41.3	0	0	0	109.7
244	D	34.7	Very low	32.6	Very low	137 Å²	137	150.8 Å²	150.8	73%	0.733	78%	0.78	S	S	*	*			trans	57	133.9	158.1	-60.8	-53.4	0	0	0	120.8
245	Q	37	Very low	32.2	Very low	164 Å²	164	153.3 Å²	153.3	77%	0.766	79%	0.79	S	S	*	*				178.1	139.2	125.7	-90.4	-66.8	6.2	0	0	109.2
246	L	33	Very low	32.2	Very low	149 Å²	149	151.9 Å²	151.9	78%	0.78	79%	0.791	S	S	*	*			trans	35.4	108.1	157.8	-60	161.4	0	0	0	118.1
247	R	30.5	Very low	32	Very low	223 Å²	223	146 Å²	146	84%	0.842	78%	0.783	S	S	*	*			cis	69.2	126	30.8	-138.5	-169.7	-173.6	-179.8	4.1	115.6
248	N	33.6	Very low	32.1	Very low	147 Å²	147	150 Å²	150	79%	0.786	79%	0.791	S	S	*	*			trans	82.4	96.9	165.1	-56.7	-23.5	0	0	0	120.3
249	A	31.3	Very low	31.9	Very low	104 Å²	104	154.3 Å²	154.3	86%	0.86	80%	0.798	S	S	*	*				-163.2	123.5	129.2	0	0	0	0	0	111.5
250	K	31.8	Very low	31.7	Very low	203 Å²	203	157.7 Å²	157.7	88%	0.883	80%	0.802	S	S	*	*			trans	-130.4	108.7	164.5	-89.4	-172.5	176.5	179.6	0	108.3
251	H	36.1	Very low	31.4	Very low	202 Å²	202	159.2 Å²	159.2	94%	0.935	81%	0.806	S	S	*	*			trans	-140.5	164.4	164.2	-98.5	-85.8	0	0	0	111.1
252	K	33.4	Very low	31.3	Very low	201 Å²	201	156.6 Å²	156.6	87%	0.874	80%	0.801	S	S	*	*			trans	-136.8	106	-155.7	174.5	-169	175.5	-172.9	0	110
253	V	33.6	Very low	31.1	Very low	148 Å²	148	155.3 Å²	155.3	90%	0.897	80%	0.802	S	S	*	*			trans	-138.5	148.1	172.2	-175.4	0	0	0	0	107.9
254	G	29.3	Very low	31	Very low	61 Å²	61	153.3 Å²	153.3	63%	0.629	80%	0.803	S	S	*	*			trans	-114	-176.6	-179.7	0	0	0	0	0	113.5
255	N	28.4	Very low	30.6	Very low	169 Å²	169	155.1 Å²	155.1	90%	0.904	81%	0.811	S	S	*	*			trans	62.1	96.3	173.8	-59.9	-4.7	0	0	0	116.8
256	S	30.6	Very low	30.1	Very low	113 Å²	113	152.9 Å²	152.9	79%	0.79	81%	0.809	S	S	*	*				-163.4	167.6	113.1	-158.3	0	0	0	0	111.9
257	T	27.4	Very low	29.9	Very low	124 Å²	124	151.1 Å²	151.1	76%	0.761	81%	0.806	S	S	*	*			trans	-66.2	136.6	-175.1	48.6	0	0	0	0	114.2
258	H	31.2	Very low	29.9	Very low	184 Å²	184	146.3 Å²	146.3	85%	0.852	80%	0.802	S	S	*	*			trans	-125.4	147.9	161.7	-80.4	-1.9	0	0	0	111.2	R260	H258-R260 PolarHBondContact O-N 3.16Å
259	Y	27.3	Very low	29.6	Very low	233 Å²	233	143.5 Å²	143.5	91%	0.914	79%	0.791	S	S	*	*			trans	-66.8	119.2	-167.5	-83.8	-114.5	0	0	0	112.4	N261	Y259-N261 VanDerWaalsContact C-N 3.32Å; Y259-N261 PolarHBondContact O-N 2.9Å; Y259-N261 VanDerWaalsContact O-N 3.14Å
260	R	26.7	Very low	29.7	Very low	225 Å²	225	147.4 Å²	147.4	85%	0.849	79%	0.792	S	S	*	*			trans	-88.7	66.6	175.1	-159.9	-179.5	-155.6	171.3	7.2	111.3	H258 T262	H258-R260 PolarHBondContact O-N 3.16Å; R260-T262 HydrophobicContact CG-CG2 4.07Å; R260-T262 PolarHBondContact O-N 3.15Å
261	N	26.1	Very low	29.6	Very low	143 Å²	143	144.6 Å²	144.6	77%	0.765	79%	0.786	S	S	*	*			trans	-79.8	63.8	179.7	-158.2	12.5	0	0	0	111.7	Y259 S263	Y259-N261 VanDerWaalsContact C-N 3.32Å; Y259-N261 PolarHBondContact O-N 2.9Å; Y259-N261 VanDerWaalsContact O-N 3.14Å; N261-S263 PolarHBondContact O-N 3.04Å
262	T	29.7	Very low	29.5	Very low	104 Å²	104	140.6 Å²	140.6	64%	0.638	77%	0.771	S	S	*	*			trans	-94.6	83.9	179.9	50.1	0	0	0	0	110.7	R260 A264	R260-T262 HydrophobicContact CG-CG2 4.07Å; R260-T262 PolarHBondContact O-N 3.15Å; T262-A264 PolarHBondContact O-N 2.94Å
263	S	30.1	Very low	29.5	Very low	103 Å²	103	137.2 Å²	137.2	72%	0.72	76%	0.758	S	S	*	*			trans	-63.5	97.8	173.9	-65	0	0	0	0	111.6	N261 L265	N261-S263 PolarHBondContact O-N 3.04Å; S263-L265 PolarHBondContact O-N 3.46Å
264	A	28.2	Very low	29.7	Very low	83 Å²	83	133 Å²	133	69%	0.686	73%	0.731	S	S	*	*			trans	38.1	62.3	157.9	0	0	0	0	0	117.1	T262 V266	T262-A264 PolarHBondContact O-N 2.94Å; A264-V266 PolarHBondContact O-N 2.91Å
265	L	27.5	Very low	29.8	Very low	174 Å²	174	134.8 Å²	134.8	91%	0.911	72%	0.723	S	S	*	*			trans	-65.4	87	154	-87.1	166.8	0	0	0	108.8	S263 P267	S263-L265 PolarHBondContact O-N 3.46Å; L265-P267 WeakPolarHBondContact O-CD 3.16Å
266	V	27	Very low	30.2	Very low	118 Å²	118	132.2 Å²	132.2	72%	0.715	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-74.9	117.7	169.9	179.9	0	0	0	0	107.6	A264 V268	A264-V266 PolarHBondContact O-N 2.91Å; V266-V268 PolarHBondContact O-N 3.46Å
267	P	28.1	Very low	30.3	Very low	112 Å²	112	129 Å²	129	73%	0.727	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-69.8	117.6	177.8	27.9	-32.6	0	0	0	109.6	L265 P269	L265-P267 WeakPolarHBondContact O-CD 3.16Å; P267-P269 WeakPolarHBondContact O-CD 3.23Å
268	V	30	Very low	30.6	Very low	122 Å²	122	126 Å²	126	74%	0.739	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-65.9	122.7	171.5	177.4	0	0	0	0	108.5	V266 E270	V266-V268 PolarHBondContact O-N 3.46Å; V268-E270 PolarHBondContact O-N 2.97Å; V268-E270 VanDerWaalsContact O-N 3.14Å
269	P	28.6	Very low	30.6	Very low	87 Å²	87	122.7 Å²	122.7	57%	0.565	64%	0.641	S	S	*	*			trans	-74.2	106.2	177.7	-14.9	30.4	0	0	0	110.3	P267 N271 L272	P267-P269 WeakPolarHBondContact O-CD 3.23Å; P269-N271 PolarHBondContact O-N 3.41Å; P269-L272 PolarHBondContact O-N 3.39Å
270	E	33.5	Very low	30.8	Very low	187 Å²	187	115 Å²	115	87%	0.874	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-8.1	176.7	-65.9	-170.9	124.5	0	0	113.9	V268	V268-E270 PolarHBondContact O-N 2.97Å; V268-E270 VanDerWaalsContact O-N 3.14Å
271	N	29.7	Very low	31	Very low	143 Å²	143	107.3 Å²	107.3	77%	0.765	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.9	48.6	178.3	-66.7	-74.6	0	0	0	112.3	P269 E273	P269-N271 PolarHBondContact O-N 3.41Å; N271-E273 VanDerWaalsContact C-N 3.29Å; N271-E273 PolarHBondContact O-N 3.32Å
272	L	32.8	Very low	31.4	Very low	118 Å²	118	103.1 Å²	103.1	62%	0.618	58%	0.576	S	S	*	*			trans	-74.4	85.7	167.2	-156.1	82.2	0	0	0	109.7	P269	P269-L272 PolarHBondContact O-N 3.39Å
273	E	34.4	Very low	31.3	Very low	130 Å²	130	101.6 Å²	101.6	61%	0.607	57%	0.574	S	S	*	*			trans	-51.6	138.2	-174.3	-62.4	-173	143.7	0	0	112.8	N271 E275 H276	N271-E273 VanDerWaalsContact C-N 3.29Å; N271-E273 PolarHBondContact O-N 3.32Å; E273-E275 HydrophobicContact CB-CB 4.13Å; E273-E275 PolarHBondContact O-N 2.84Å; E273-H276 PolarHBondContact O-N 2.87Å
274	L	37.1	Very low	31.2	Very low	61 Å²	61	102.8 Å²	102.8	32%	0.319	57%	0.568	S	S	.	*	H	α-helix	trans	-57.4	-22.9	178.7	-96.9	131.2	0	0	0	113.5	F91 H276 L277 L278	F91-L274 HydrophobicContact CD2-CD2 4.08Å; F91-L274 HydrophobicContact CE2-CD1 3.69Å; F91-L274 HydrophobicContact CE2-CD2 3.99Å; F91-L274 HydrophobicContact CE2-CG 4.3Å; F91-L274 HydrophobicContact CZ-CD1 3.94Å; L274-H276 PolarHBondContact O-N 3.38Å; L274-L277 HydrophobicContact CD2-CD1 4.44Å; L274-L277 PolarHBondContact O-N 3.12Å; L274-L277 VanDerWaalsContact O-N 3.12Å; L274-L278 WeakPolarHBondContact O-CG 3.39Å; L274-L278 PolarHBondContact O-N 3.23Å
275	E	31.6	Very low	31.1	Very low	97 Å²	97	103 Å²	103	45%	0.453	56%	0.564	S	S	.	*	H	α-helix	trans	-42	-45.5	162.9	-88.3	-72	121	0	0	113.3	E273 L278 K279	E273-E275 HydrophobicContact CB-CB 4.13Å; E273-E275 PolarHBondContact O-N 2.84Å; E275-L278 PolarHBondContact O-N 2.93Å; E275-K279 WeakPolarHBondContact O-CB 3.42Å; E275-K279 WeakPolarHBondContact O-CD 3.33Å; E275-K279 VanDerWaalsContact O-CG 3.28Å; E275-K279 WeakPolarHBondContact O-CG 3.43Å; E275-K279 PolarHBondContact O-N 3.48Å; E275-K279 WeakPolarHBondContact OE2-CE 3.14Å; E275-K279 IonicContact OE2-NZ 2.72Å; E275-K279 PolarHBondContact OE2-NZ 3.1Å
276	H	37.1	Very low	31	Very low	116 Å²	116	99.7 Å²	99.7	54%	0.537	55%	0.546	S	S	.	.	H	α-helix	trans	-72.9	-34.6	-178.9	-86.7	-87.9	0	0	0	113.1	E273 L274 K279 S280	E273-H276 PolarHBondContact O-N 2.87Å; L274-H276 PolarHBondContact O-N 3.38Å; H276-K279 PolarHBondContact O-N 3.01Å; H276-S280 PolarHBondContact O-N 3.16Å
277	L	31.4	Very low	30.9	Very low	44 Å²	44	98.8 Å²	98.8	23%	0.23	55%	0.545	C	S	.	.	H	α-helix	trans	-67.5	-44.2	172.6	-70.3	171.7	0	0	0	110.7	L274 K279 S280 F281 K396	L274-L277 HydrophobicContact CD2-CD1 4.44Å; L274-L277 PolarHBondContact O-N 3.12Å; L274-L277 VanDerWaalsContact O-N 3.12Å; L277-K279 VanDerWaalsContact C-N 3.31Å; L277-K279 PolarHBondContact O-N 2.96Å; L277-S280 WeakPolarHBondContact CA-OG 3.44Å; L277-S280 PolarHBondContact O-N 2.9Å; L277-S280 PolarHBondContact O-OG 2.94Å; L277-F281 HydrophobicContact CB-CE2 4.41Å; L277-F281 WeakPolarHBondContact O-CD2 3.27Å; L277-F281 PolarHBondContact O-N 3.24Å; L277-K396 HydrophobicContact CD2-CD 4.25Å
278	L	34.7	Very low	30.7	Very low	63 Å²	63	98 Å²	98	33%	0.33	54%	0.542	S	S	.	.	H	α-helix	trans	-62.2	-36.2	174.8	-66.5	170.1	0	0	0	112.2	F91 L274 E275 F281 S282	F91-L278 HydrophobicContact CB-CD1 4.09Å; L274-L278 WeakPolarHBondContact O-CG 3.39Å; L274-L278 PolarHBondContact O-N 3.23Å; E275-L278 PolarHBondContact O-N 2.93Å; L278-F281 PolarHBondContact O-N 3.4Å; L278-S282 PolarHBondContact O-N 3.08Å; L278-S282 PolarHBondContact O-OG 2.97Å
279	K	31.5	Very low	30.7	Very low	114 Å²	114	99.1 Å²	99.1	50%	0.496	53%	0.534	S	S	.	.	H	α-helix	trans	-65.4	-38.4	170.2	-77.1	160.9	178.4	147.9	0	112.4	E275 H276 L277 F281 S282	E275-K279 WeakPolarHBondContact O-CB 3.42Å; E275-K279 WeakPolarHBondContact O-CD 3.33Å; E275-K279 VanDerWaalsContact O-CG 3.28Å; E275-K279 WeakPolarHBondContact O-CG 3.43Å; E275-K279 PolarHBondContact O-N 3.48Å; E275-K279 WeakPolarHBondContact OE2-CE 3.14Å; E275-K279 IonicContact OE2-NZ 2.72Å; E275-K279 PolarHBondContact OE2-NZ 3.1Å; H276-K279 PolarHBondContact O-N 3.01Å; L277-K279 VanDerWaalsContact C-N 3.31Å; L277-K279 PolarHBondContact O-N 2.96Å; K279-F281 PolarHBondContact O-N 2.85Å; K279-S282 WeakPolarHBondContact O-CB 3.22Å; K279-S282 PolarHBondContact O-N 3.11Å
280	S	30.1	Very low	30.5	Very low	71 Å²	71	103.1 Å²	103.1	50%	0.497	55%	0.545	S	S	.	.	H	α-helix	trans	-65.8	-34.8	172.4	59.5	0	0	0	0	113.4	H276 L277 S282	H276-S280 PolarHBondContact O-N 3.16Å; L277-S280 WeakPolarHBondContact CA-OG 3.44Å; L277-S280 PolarHBondContact O-N 2.9Å; L277-S280 PolarHBondContact O-OG 2.94Å; S280-S282 PolarHBondContact O-N 3.08Å
281	F	32.5	Very low	30.2	Very low	64 Å²	64	101.3 Å²	101.3	28%	0.281	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-4.9	170.8	-63.2	-53.7	0	0	0	114	L277 L278 K279 L399	L277-F281 HydrophobicContact CB-CE2 4.41Å; L277-F281 WeakPolarHBondContact O-CD2 3.27Å; L277-F281 PolarHBondContact O-N 3.24Å; L278-F281 PolarHBondContact O-N 3.4Å; K279-F281 PolarHBondContact O-N 2.85Å; F281-L399 HydrophobicContact CE1-CB 4.14Å; F281-L399 HydrophobicContact CE1-CD1 4.48Å; F281-L399 HydrophobicContact CE2-CD1 4.3Å; F281-L399 HydrophobicContact CZ-CB 4.07Å; F281-L399 HydrophobicContact CZ-CD1 3.68Å; F281-L399 HydrophobicContact CZ-CG 4.43Å
282	S	33.3	Very low	30.1	Very low	54 Å²	54	104 Å²	104	38%	0.378	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-3.3	-177.6	-57.9	0	0	0	0	114.7	L24 L278 K279 S280	L24-S282 VanDerWaalsContact CD1-OG 3.31Å; L24-S282 WeakPolarHBondContact CD1-OG 3.4Å; L24-S282 WeakPolarHBondContact CD2-O 3.02Å; L278-S282 PolarHBondContact O-N 3.08Å; L278-S282 PolarHBondContact O-OG 2.97Å; K279-S282 WeakPolarHBondContact O-CB 3.22Å; K279-S282 PolarHBondContact O-N 3.11Å; S280-S282 PolarHBondContact O-N 3.08Å
283	A	27.6	Very low	29.7	Very low	73 Å²	73	104 Å²	104	60%	0.603	55%	0.55	S	S	*	.	S	Bend	trans	-87.5	-7	-167.5	0	0	0	0	0	116.1
284	H	29.4	Very low	29.2	Very low	128 Å²	128	103.6 Å²	103.6	59%	0.593	55%	0.552	S	S	*	*			trans	-123.8	84	-169.2	-63.6	-27	0	0	0	113.1
285	S	24.4	Very low	28.9	Very low	88 Å²	88	107.6 Å²	107.6	62%	0.615	57%	0.569	S	S	*	*			trans	-72.5	142.6	163.2	-178	0	0	0	0	110.7
286	I	25.8	Very low	28.6	Very low	103 Å²	103	110.3 Å²	110.3	53%	0.528	59%	0.585	S	S	.	*				163	107.8	129.2	-81.3	157	0	0	0	111.4	R410	I286-R410 PolarHBondContact O-NH1 2.95Å
287	S	24.9	Very low	28.1	Very low	99 Å²	99	109.9 Å²	109.9	69%	0.692	60%	0.595	S	S	*	*			trans	62.8	160	144.5	-145.3	0	0	0	0	121.6
288	S	24.7	Very low	27.8	Very low	95 Å²	95	116.5 Å²	116.5	66%	0.664	62%	0.624	S	S	*	*			trans	-84.8	158.3	-160.5	-50.8	0	0	0	0	115.1	H290	S288-H290 PolarHBondContact O-N 3.23Å; S288-H290 VanDerWaalsContact O-N 3.14Å
289	Y	29.5	Very low	27.3	Very low	146 Å²	146	119.4 Å²	119.4	57%	0.573	65%	0.648	S	S	*	*			trans	-66.6	105.8	171.3	-56.1	-78.6	0	0	0	112
290	H	24.8	Very low	26.9	Very low	171 Å²	171	121.1 Å²	121.1	79%	0.792	66%	0.663	S	S	*	*			trans	-126.1	164.6	159	-90.8	-49.1	0	0	0	109.4	S288	S288-H290 PolarHBondContact O-N 3.23Å; S288-H290 VanDerWaalsContact O-N 3.14Å
291	L	27.6	Very low	26.6	Very low	150 Å²	150	123 Å²	123	79%	0.785	67%	0.674	S	S	*	*			trans	69.3	134.6	-160.1	-63.7	90.4	0	0	0	113.1
292	R	25.8	Very low	26.3	Very low	200 Å²	200	125.5 Å²	125.5	76%	0.755	69%	0.694	S	S	*	*			cis	-148.8	110.1	-2.2	-143.4	177.9	-169.3	164.7	2.9	110.3	N294	R292-N294 PolarHBondContact O-N 3.38Å
293	S	24.7	Very low	25.8	Very low	117 Å²	117	128.2 Å²	128.2	82%	0.818	71%	0.708	S	S	*	*			trans	-79.9	110.1	168.3	-177.7	0	0	0	0	109.4
294	N	25.4	Very low	25.7	Very low	122 Å²	122	133.8 Å²	133.8	65%	0.652	72%	0.719	S	S	*	*			trans	-118.5	73.8	171.6	-81.3	12.9	0	0	0	109.4	R292	R292-N294 PolarHBondContact O-N 3.38Å
295	H	29.8	Very low	25.4	Very low	144 Å²	144	133.4 Å²	133.4	67%	0.667	73%	0.725	S	S	*	*				-174.6	151.1	116.6	-106.2	-83.1	0	0	0	111.9
296	I	25.8	Very low	25.4	Very low	154 Å²	154	133.9 Å²	133.9	79%	0.79	73%	0.728	S	S	*	*			trans	-85.7	120.6	-172.7	-63.1	158.1	0	0	0	110.4
297	S	26.4	Very low	25.3	Very low	108 Å²	108	134.9 Å²	134.9	76%	0.755	74%	0.742	S	S	*	*			trans	-148.2	138.9	150.1	61.9	0	0	0	0	109.4	C299	S297-C299 PolarHBondContact O-N 3.24Å
298	H	24.4	Very low	25.6	Very low	183 Å²	183	135.5 Å²	135.5	85%	0.847	74%	0.742	S	S	*	*			trans	-76.6	114.4	-170.7	-67.6	-97.2	0	0	0	111.6
299	C	24	Very low	25.6	Very low	123 Å²	123	138.8 Å²	138.8	83%	0.831	75%	0.752	S	S	*	*			trans	-139.5	137.6	160.6	-86.6	0	0	0	0	109.1	S297	S297-C299 PolarHBondContact O-N 3.24Å
300	N	23.7	Very low	25.5	Very low	150 Å²	150	136.7 Å²	136.7	80%	0.802	76%	0.758	S	S	*	*			trans	-71.8	149.9	-168.4	-68.1	-45.9	0	0	0	112.7	V302	N300-V302 PolarHBondContact O-N 2.82Å; N300-V302 VanDerWaalsContact O-N 3.16Å
301	P	24.2	Very low	25.6	Very low	112 Å²	112	135.5 Å²	135.5	73%	0.727	76%	0.757	S	S	*	*			trans	-63.1	117	164.5	28.2	-33.1	0	0	0	109	V303	P301-V303 PolarHBondContact O-N 2.89Å
302	V	25.1	Very low	25.5	Very low	115 Å²	115	136 Å²	136	70%	0.697	75%	0.753	S	S	*	*			trans	-72.7	95.1	174.8	178	0	0	0	0	108.4	N300 F304	N300-V302 PolarHBondContact O-N 2.82Å; N300-V302 VanDerWaalsContact O-N 3.16Å; V302-F304 HydrophobicContact CG1-CD2 4.19Å; V302-F304 HydrophobicContact CG1-CE2 4Å; V302-F304 PolarHBondContact O-N 3.39Å
303	V	23.9	Very low	25.5	Very low	112 Å²	112	136.6 Å²	136.6	68%	0.679	76%	0.757	S	S	*	*			trans	-65.5	105.7	171.4	-177.3	0	0	0	0	107.9	P301 V305	P301-V303 PolarHBondContact O-N 2.89Å; V303-V305 HydrophobicContact CB-CG2 4.46Å; V303-V305 HydrophobicContact CG1-CG2 3.81Å; V303-V305 PolarHBondContact O-N 3.12Å
304	F	24.7	Very low	25.8	Very low	189 Å²	189	139 Å²	139	83%	0.829	76%	0.76	S	S	*	*			trans	-71	81.4	169.9	-86.9	-87	0	0	0	109.9	V302 S306	V302-F304 HydrophobicContact CG1-CD2 4.19Å; V302-F304 HydrophobicContact CG1-CE2 4Å; V302-F304 PolarHBondContact O-N 3.39Å; F304-S306 PolarHBondContact O-N 2.98Å; F304-S306 VanDerWaalsContact O-N 3.12Å
305	V	24.1	Very low	25.7	Very low	120 Å²	120	140.9 Å²	140.9	73%	0.727	77%	0.77	S	S	*	*			trans	-66.5	105.7	170.4	-178.7	0	0	0	0	108.3	V303 P307	V303-V305 HydrophobicContact CB-CG2 4.46Å; V303-V305 HydrophobicContact CG1-CG2 3.81Å; V303-V305 PolarHBondContact O-N 3.12Å; V305-P307 WeakPolarHBondContact O-CD 3.11Å
306	S	24.2	Very low	25.6	Very low	98 Å²	98	139.2 Å²	139.2	69%	0.685	77%	0.774	S	S	*	*			trans	-68.1	120.6	176.7	-64.6	0	0	0	0	111.2	F304 T308	F304-S306 PolarHBondContact O-N 2.98Å; F304-S306 VanDerWaalsContact O-N 3.12Å; S306-T308 PolarHBondContact O-N 2.97Å
307	P	23.8	Very low	25.8	Very low	125 Å²	125	140.9 Å²	140.9	81%	0.812	78%	0.779	S	S	*	*			trans	-84	105.4	179.4	32.1	-32.2	0	0	0	110.9	V305	V305-P307 WeakPolarHBondContact O-CD 3.11Å
308	T	30.8	Very low	25.8	Very low	112 Å²	112	145.2 Å²	145.2	69%	0.687	78%	0.784	S	S	*	*			trans	-129.2	107.9	168	56	0	0	0	0	111.4	S306	S306-T308 PolarHBondContact O-N 2.97Å
309	N	25.4	Very low	26	Very low	164 Å²	164	141.8 Å²	141.8	88%	0.877	78%	0.778	S	S	*	*			trans	-57.9	135.8	167	-70.7	-39.7	0	0	0	110.8
310	S	26.2	Very low	26.2	Very low	102 Å²	102	142.9 Å²	142.9	71%	0.713	78%	0.775	S	S	*	*				169.3	148.4	119.3	52.5	0	0	0	0	112.5
311	L	27.2	Very low	26.3	Very low	145 Å²	145	140.4 Å²	140.4	76%	0.759	77%	0.765	S	S	*	*			trans	67.9	148.2	164.4	-56.8	164.5	0	0	0	117.5
312	K	25.6	Very low	26.6	Very low	162 Å²	162	146 Å²	146	70%	0.704	77%	0.773	S	S	*	*			cis	-173.3	126.9	-37.1	-126.6	-172.9	-165	176.7	0	107.8
313	Y	25.8	Very low	26.9	Very low	211 Å²	211	149.1 Å²	149.1	83%	0.827	78%	0.778	S	S	*	*			trans	59.7	130.7	179.1	-58.2	-94.4	0	0	0	114
314	L	30.3	Very low	27.2	Very low	169 Å²	169	148.4 Å²	148.4	89%	0.885	77%	0.774	S	S	*	*				-151.9	160.6	57.1	-96.6	159.7	0	0	0	112.2
315	N	24.4	Very low	27.5	Very low	161 Å²	161	146.7 Å²	146.7	86%	0.861	77%	0.773	S	S	*	*			trans	-92.9	133.9	175.1	-65.3	-32.6	0	0	0	111.8
316	S	27.4	Very low	27.7	Very low	108 Å²	108	149 Å²	149	76%	0.755	78%	0.776	S	S	*	*			trans	-171.5	121.8	134.8	49.3	0	0	0	0	113.9
317	Q	30.9	Very low	28.1	Very low	190 Å²	190	153 Å²	153	89%	0.888	79%	0.788	S	S	*	*			trans	40.8	103.8	143.2	-69.8	162	-36.4	0	0	121.1
318	F	25.3	Very low	28.3	Very low	199 Å²	199	154 Å²	154	87%	0.873	79%	0.786	S	S	*	*			trans	-47.6	154.6	138.6	-85.9	-76.8	0	0	0	112.1
319	P	30	Very low	28.3	Very low	110 Å²	110	153 Å²	153	71%	0.714	78%	0.784	S	S	*	*				-157.8	155	80.1	40.8	-19.5	0	0	0	121.4
320	L	27.1	Very low	28.4	Very low	146 Å²	146	150.8 Å²	150.8	76%	0.764	77%	0.772	S	S	*	*			trans	66.4	125.7	134.1	-66.8	167.7	0	0	0	124.9
321	T	25.7	Very low	28.6	Very low	99 Å²	99	154.5 Å²	154.5	61%	0.607	77%	0.772	S	S	*	*			trans	63.7	121.2	133.6	57.7	0	0	0	0	123.9
322	Y	31.1	Very low	28.8	Very low	228 Å²	228	156.4 Å²	156.4	89%	0.894	77%	0.774	S	S	*	*				-139.6	116.9	117	-65.8	-75.1	0	0	0	107
323	K	31.3	Very low	29.1	Very low	182 Å²	182	154.3 Å²	154.3	79%	0.791	78%	0.777	S	S	*	*				57.4	134.5	81.3	-79.4	-157.7	171	-172.3	0	114.4
324	T	28.8	Very low	29.3	Very low	97 Å²	97	155.7 Å²	155.7	60%	0.595	78%	0.781	S	S	*	*			cis	158.2	148.9	-20.3	30.8	0	0	0	0	105.8
325	N	32.7	Very low	29	Very low	153 Å²	153	153.6 Å²	153.6	82%	0.818	78%	0.775	S	S	*	*			trans	166.9	97.4	149.8	-85.8	-5.3	0	0	0	106.4
326	E	27.8	Very low	29.3	Very low	169 Å²	169	153.1 Å²	153.1	79%	0.79	77%	0.771	S	S	*	*				71.4	98.9	68.4	-66	-163.5	-177.3	0	0	115.4
327	I	33	Very low	29.5	Very low	180 Å²	180	156.7 Å²	156.7	92%	0.923	77%	0.772	S	S	*	*			trans	-135.2	131.2	131.7	-59.3	-176.4	0	0	0	106
328	N	26.6	Very low	29.3	Very low	146 Å²	146	153 Å²	153	78%	0.781	77%	0.768	S	S	*	*			trans	-150.2	152.7	-176.7	-172.7	14.1	0	0	0	111.3
329	S	30.9	Very low	29.5	Very low	92 Å²	92	147.6 Å²	147.6	64%	0.643	76%	0.76	S	S	*	*			trans	71.2	161.2	170.2	89.5	0	0	0	0	115.7
330	N	29.2	Very low	29.3	Very low	118 Å²	118	151.9 Å²	151.9	63%	0.631	76%	0.762	S	S	*	*			cis	-158.6	168.1	8.4	-140.4	-30.1	0	0	0	114.4
331	Y	29.5	Very low	29.3	Very low	179 Å²	179	151 Å²	151	70%	0.702	75%	0.754	S	S	*	*			trans	69.2	111.7	152.4	-74.6	-56.6	0	0	0	125.8
332	K	30.6	Very low	29.5	Very low	185 Å²	185	152.6 Å²	152.6	80%	0.804	76%	0.759	S	S	*	*				87.8	139.9	125.2	-92.9	165	-177.9	171.6	0	122.7
333	P	32.7	Very low	29.3	Very low	118 Å²	118	148 Å²	148	77%	0.766	75%	0.754	S	S	*	*			trans	-115.2	161.7	179.2	42.4	-34.3	0	0	0	116.2
334	R	29.4	Very low	29	Very low	240 Å²	240	143.9 Å²	143.9	91%	0.906	75%	0.748	S	S	*	*			trans	-155	127.9	153	-91.4	177	177.6	-179.2	-2.3	106.1
335	V	24.8	Very low	29.1	Very low	126 Å²	126	149.2 Å²	149.2	76%	0.764	76%	0.763	S	S	*	*				67.8	105.7	52	-177.2	0	0	0	0	113.3
336	I	31.1	Very low	29.1	Very low	151 Å²	151	150.6 Å²	150.6	77%	0.774	76%	0.762	S	S	*	*			trans	-171.5	117.4	135.7	-96.3	151.8	0	0	0	111.5
337	K	30.1	Very low	29.1	Very low	182 Å²	182	147.4 Å²	147.4	79%	0.791	76%	0.758	S	S	*	*			trans	29.7	118.9	140.1	-49.3	-176.9	179.2	-179.6	0	118.7
338	S	27.3	Very low	29	Very low	114 Å²	114	143.7 Å²	143.7	80%	0.797	75%	0.749	S	S	*	*				106.8	154.1	81.6	66.5	0	0	0	0	111.6
339	A	29.6	Very low	29.2	Very low	85 Å²	85	140.7 Å²	140.7	70%	0.702	74%	0.744	S	S	*	*			cis	-164	172.6	-4.9	0	0	0	0	0	110.2
340	R	26.7	Very low	29.2	Very low	199 Å²	199	143.4 Å²	143.4	75%	0.751	75%	0.751	S	S	*	*			trans	55.3	113.4	151.1	-77.4	-166.4	128.5	130.6	14.3	118.8
341	E	26.8	Very low	29.3	Very low	128 Å²	128	143.4 Å²	143.4	60%	0.598	76%	0.755	S	S	*	*				86.8	155.3	77.6	-83.1	175.6	-161.7	0	0	113.5
342	N	29.3	Very low	29.3	Very low	132 Å²	132	139.5 Å²	139.5	71%	0.706	75%	0.754	S	S	*	*			trans	73.9	108.6	170.1	-51.1	-45.7	0	0	0	115.5
343	V	26.3	Very low	29.4	Very low	131 Å²	131	137.8 Å²	137.8	79%	0.794	75%	0.754	S	S	*	*				73.4	98.8	56	-179.1	0	0	0	0	112.5
344	S	26.3	Very low	29.2	Very low	97 Å²	97	136.2 Å²	136.2	68%	0.678	75%	0.745	S	S	*	*				169	136.5	123.7	43.8	0	0	0	0	109.9
345	K	30.9	Very low	29.3	Very low	209 Å²	209	131.8 Å²	131.8	91%	0.909	74%	0.739	S	S	*	*			trans	-129.8	121.3	156.6	-109.2	-173.2	176.1	-175.6	0	107.9
346	F	31.8	Very low	29.7	Very low	182 Å²	182	133.2 Å²	133.2	80%	0.798	74%	0.737	S	S	*	*			trans	-58	132.4	177.3	-77.6	-103	0	0	0	110
347	S	28	Very low	29.6	Very low	101 Å²	101	130 Å²	130	71%	0.706	73%	0.728	S	S	*	*				64.8	147.3	105.1	87.9	0	0	0	0	114.6
348	S	32	Very low	29.8	Very low	103 Å²	103	129.2 Å²	129.2	72%	0.72	73%	0.727	S	S	*	*			cis	-164.4	169.8	24.3	45.5	0	0	0	0	111.1
349	A	29.7	Very low	29.8	Very low	82 Å²	82	130.2 Å²	130.2	68%	0.678	73%	0.729	S	S	*	*			trans	67.2	137.2	162.3	0	0	0	0	0	116.5
350	D	31.6	Very low	30	Very low	149 Å²	149	130.8 Å²	130.8	80%	0.797	73%	0.733	S	S	*	*			cis	-135.6	143.7	-7.5	-70.3	-54.1	0	0	0	107.2
351	V	30.1	Very low	30.1	Very low	119 Å²	119	132 Å²	132	72%	0.721	74%	0.738	S	S	*	*			cis	87.8	108.1	40.3	178.2	0	0	0	0	113.7
352	S	30.7	Very low	30.4	Very low	96 Å²	96	131.4 Å²	131.4	67%	0.671	75%	0.748	S	S	*	*			trans	64.4	157.5	162.4	70.3	0	0	0	0	118.6
353	D	31.6	Very low	30.3	Very low	150 Å²	150	134 Å²	134	80%	0.802	75%	0.753	S	S	*	*			cis	-174.9	169.4	-27.6	-95.8	-35.9	0	0	0	107.7
354	S	29.6	Very low	30.6	Very low	84 Å²	84	136 Å²	136	59%	0.587	76%	0.757	S	S	*	*			cis	-170.3	177.7	-23.5	59	0	0	0	0	108.5
355	L	30.4	Very low	30.8	Very low	148 Å²	148	140.5 Å²	140.5	78%	0.775	77%	0.765	S	S	*	*			trans	65.3	167	163.8	-58.9	166.6	0	0	0	114.7
356	Q	33	Very low	30.5	Very low	155 Å²	155	137.8 Å²	137.8	72%	0.724	76%	0.759	S	S	*	*			cis	-152.4	122.3	-9.4	-123.6	163	14.9	0	0	107.3
357	S	29.3	Very low	30.5	Very low	83 Å²	83	134.4 Å²	134.4	58%	0.58	76%	0.755	S	S	*	*				82.5	167.9	102.4	68.3	0	0	0	0	118.1
358	H	34.6	Very low	30.5	Very low	167 Å²	167	137.6 Å²	137.6	77%	0.773	76%	0.758	S	S	*	*			trans	87.2	58.8	170	-53.6	-64.3	0	0	0	122.1
359	T	28.7	Very low	30.3	Very low	135 Å²	135	140.3 Å²	140.3	83%	0.828	76%	0.759	S	S	*	*				-0	117.4	121.7	-45.9	0	0	0	0	119.9
360	A	33	Very low	30.2	Very low	97 Å²	97	140.9 Å²	140.9	80%	0.802	76%	0.758	S	S	*	*			trans	-170.6	128.8	139.5	0	0	0	0	0	108.5
361	R	28.6	Very low	29.9	Very low	223 Å²	223	142.6 Å²	142.6	84%	0.842	76%	0.762	S	S	*	*			cis	83.9	71.1	18.3	-151.6	-165.2	-159.1	-150.2	10.3	116.9
362	S	32.7	Very low	29.9	Very low	117 Å²	117	144.5 Å²	144.5	82%	0.818	77%	0.766	S	S	*	*			trans	-127.4	151.3	148.6	64.6	0	0	0	0	110.5
363	K	28.5	Very low	29.8	Very low	187 Å²	187	148.5 Å²	148.5	81%	0.813	77%	0.774	S	S	*	*			trans	-117.8	132.1	179.1	-67.4	176.9	176	-179.5	0	109
364	I	31.1	Very low	29.4	Very low	171 Å²	171	147.4 Å²	147.4	88%	0.877	77%	0.773	S	S	*	*			trans	-126.8	153.1	160.4	-63.8	-174.6	0	0	0	108.8
365	K	30.9	Very low	29.4	Very low	193 Å²	193	148.6 Å²	148.6	84%	0.839	78%	0.778	S	S	*	*			trans	-79	145.9	-159.4	-62.7	169.2	178.7	173.2	0	113.4
366	I	25.1	Very low	29.1	Very low	152 Å²	152	147 Å²	147	78%	0.779	78%	0.779	S	S	*	*			trans	-75.1	141	153.8	-63.9	157.7	0	0	0	108.3
367	P	30.5	Very low	28.9	Very low	111 Å²	111	149.1 Å²	149.1	72%	0.721	79%	0.787	S	S	*	*			trans	-124.2	157.8	132.1	12.9	6.9	0	0	0	112
368	H	29.5	Very low	28.9	Very low	168 Å²	168	149 Å²	149	78%	0.778	79%	0.791	S	S	*	*			trans	-65.2	162.1	164.2	-56.7	-111.3	0	0	0	108.4
369	H	28	Very low	28.3	Very low	160 Å²	160	151 Å²	151	74%	0.741	80%	0.798	S	S	*	*			cis	-169.6	141.8	39.7	-163.3	-83.1	0	0	0	112.6
370	S	26	Very low	28.3	Very low	93 Å²	93	155.4 Å²	155.4	65%	0.65	80%	0.801	S	S	*	*			trans	62.1	151.5	160.6	51.3	0	0	0	0	121.7
371	Q	25.7	Very low	28	Very low	186 Å²	186	156.8 Å²	156.8	87%	0.869	80%	0.799	S	S	*	*			trans	74.4	82.2	171.4	-52.4	-166	29.3	0	0	117.7
372	I	30.4	Very low	27.9	Very low	159 Å²	159	156.1 Å²	156.1	82%	0.815	80%	0.802	S	S	*	*			trans	-136.8	96.2	155	-61	-179.4	0	0	0	104.3
373	E	28.6	Very low	27.6	Very low	180 Å²	180	157.7 Å²	157.7	84%	0.841	80%	0.8	S	S	*	*				77	129.2	89	-72.9	-167.8	142.2	0	0	114.7
374	T	24.4	Very low	27.5	Very low	127 Å²	127	153.7 Å²	153.7	78%	0.779	79%	0.794	S	S	*	*			trans	-77.7	138.6	-175.9	40.1	0	0	0	0	113	S376	T374-S376 PolarHBondContact O-N 3.36Å
375	P	27.9	Very low	27.5	Very low	108 Å²	108	151.6 Å²	151.6	70%	0.701	79%	0.794	S	S	*	*			trans	-70.2	110.8	162.3	29.9	-32	0	0	0	109.6	F377	P375-F377 PolarHBondContact O-N 3.02Å
376	S	24	Very low	27.3	Very low	114 Å²	114	148.9 Å²	148.9	80%	0.797	79%	0.789	S	S	*	*			trans	-72.7	95.4	178.3	57.9	0	0	0	0	111.4	T374	T374-S376 PolarHBondContact O-N 3.36Å
377	F	29.6	Very low	27.5	Very low	200 Å²	200	148.8 Å²	148.8	88%	0.877	78%	0.783	S	S	*	*			trans	-71.8	141.3	166.3	-90.4	-89.1	0	0	0	111.1	P375	P375-F377 PolarHBondContact O-N 3.02Å
378	A	28.3	Very low	27.5	Very low	82 Å²	82	151.7 Å²	151.7	68%	0.678	78%	0.784	S	S	*	*			trans	-74.7	164.1	-154.4	0	0	0	0	0	115.3	Y380	A378-Y380 PolarHBondContact O-N 3.39Å; A378-Y380 VanDerWaalsContact O-N 3.09Å
379	K	23.7	Very low	27.7	Very low	208 Å²	208	148.4 Å²	148.4	90%	0.904	77%	0.767	S	S	*	*			trans	-47.5	108.4	178.2	-61.3	169	-178.8	172.8	0	112.5
380	Y	28.5	Very low	28.4	Very low	228 Å²	228	145.5 Å²	145.5	89%	0.894	75%	0.754	S	S	*	*			trans	-97.7	125.9	148.4	-77.2	-84.1	0	0	0	108.4	A378	A378-Y380 PolarHBondContact O-N 3.39Å; A378-Y380 VanDerWaalsContact O-N 3.09Å
381	T	26.5	Very low	29.5	Very low	126 Å²	126	145 Å²	145	77%	0.773	75%	0.75	S	S	*	*			trans	-66.2	142.4	-176.3	37.8	0	0	0	0	111.3	I383	T381-I383 PolarHBondContact O-N 2.87Å
382	K	25.2	Very low	30.8	Very low	208 Å²	208	138.9 Å²	138.9	90%	0.904	73%	0.727	S	S	*	*			trans	-61.2	104.6	172.3	-71.3	-178.6	177.9	179.2	0	109.5
383	I	27.5	Very low	32.1	Very low	150 Å²	150	133.4 Å²	133.4	77%	0.769	71%	0.71	S	S	*	*			trans	-67.7	127.6	162.9	-59.7	177.1	0	0	0	106.7	T381 S385	T381-I383 PolarHBondContact O-N 2.87Å; I383-S385 PolarHBondContact O-N 2.61Å
384	P	25.9	Very low	33.5	Very low	104 Å²	104	126.6 Å²	126.6	68%	0.675	68%	0.678	S	S	*	*			trans	-65.6	123	-177.6	25.4	-33.4	0	0	0	110.4	N386	P384-N386 PolarHBondContact O-N 3.19Å
385	S	30.4	Very low	35.1	Very low	127 Å²	127	121.2 Å²	121.2	89%	0.888	64%	0.644	S	S	*	*	S	Bend	trans	-77.5	44.1	-173.4	61	0	0	0	0	113.4	I383	I383-S385 PolarHBondContact O-N 2.61Å
386	N	27.3	Very low	36.6	Very low	136 Å²	136	120.4 Å²	120.4	73%	0.727	63%	0.629	S	S	*	*			trans	-139.4	50.4	-169.9	-153.3	20.7	0	0	0	113.2	P384	P384-N386 PolarHBondContact O-N 3.19Å
387	K	30.3	Very low	38.5	Very low	150 Å²	150	115.5 Å²	115.5	65%	0.652	59%	0.593	S	S	*	*			trans	-125.9	99.2	160.9	-67.3	-159.8	-179	-169.7	0	109.1	F389	K387-F389 HydrophobicContact CB-CD2 4.11Å; K387-F389 HydrophobicContact CB-CE2 4.03Å; K387-F389 HydrophobicContact CD-CD2 4.5Å; K387-F389 HydrophobicContact CD-CE2 3.66Å; K387-F389 HydrophobicContact CD-CZ 4.2Å; K387-F389 HydrophobicContact CG-CE2 4.44Å; K387-F389 PolarHBondContact O-N 3.35Å; K387-F389 VanDerWaalsContact O-N 3.16Å
388	K	29	Very low	39.9	Very low	171 Å²	171	106.4 Å²	106.4	74%	0.743	55%	0.554	S	S	*	*			trans	-83.1	74.8	177.3	-71.8	-176.8	177.9	178.4	0	110.7	H390	K388-H390 PolarHBondContact O-N 3.25Å
389	F	34.7	Very low	41.5	Very low	99 Å²	99	103.2 Å²	103.2	43%	0.434	53%	0.525	S	S	.	.			trans	-83.4	92.6	173.8	-72.1	-54.8	0	0	0	111.5	K387	K387-F389 HydrophobicContact CB-CD2 4.11Å; K387-F389 HydrophobicContact CB-CE2 4.03Å; K387-F389 HydrophobicContact CD-CD2 4.5Å; K387-F389 HydrophobicContact CD-CE2 3.66Å; K387-F389 HydrophobicContact CD-CZ 4.2Å; K387-F389 HydrophobicContact CG-CE2 4.44Å; K387-F389 PolarHBondContact O-N 3.35Å; K387-F389 VanDerWaalsContact O-N 3.16Å
390	H	43.3	Very low	43.3	Very low	100 Å²	100	96.9 Å²	96.9	46%	0.463	50%	0.499	S	S	.	.			trans	-127.1	82.7	171.2	-66.3	-77	0	0	0	110.4	V40 K388 P392	V40-H390 PolarHBondContact O-CE1 2.85Å; V40-H390 VanDerWaalsContact O-CE1 3.29Å; K388-H390 PolarHBondContact O-N 3.25Å; H390-P392 WeakPolarHBondContact O-CD 3.16Å
391	S	49.3	Very low	44.7	Very low	81 Å²	81	88.9 Å²	88.9	57%	0.566	47%	0.467	S	S	*	.			trans	-93	94.5	163.7	-179.4	0	0	0	0	109.7	G393 F394	S391-G393 PolarHBondContact O-N 2.83Å; S391-F394 PolarHBondContact O-N 2.69Å; S391-F394 PolarHBondContact OG-N 3.01Å
392	P	51.5	Low	46.3	Very low	58 Å²	58	83.2 Å²	83.2	38%	0.377	43%	0.432	S	S	.	.	H	α-helix	trans	-62.6	-29.1	171.8	26.1	-34.3	0	0	0	111.6	Y37 H390 F394 L395 K396	Y37-P392 HydrophobicContact CE2-CB 3.53Å; Y37-P392 WeakPolarHBondContact OH-CB 3.42Å; H390-P392 WeakPolarHBondContact O-CD 3.16Å; P392-F394 VanDerWaalsContact C-N 3.29Å; P392-F394 PolarHBondContact O-N 3.06Å; P392-L395 PolarHBondContact O-N 3.14Å; P392-K396 PolarHBondContact O-N 3.33Å; P392-K396 VanDerWaalsContact O-N 3.13Å
393	G	58.6	Low	48	Very low	45 Å²	45	75.7 Å²	75.7	46%	0.464	40%	0.4	S	S	.	.	H	α-helix	trans	-59.5	-35.1	175.9	0	0	0	0	0	113.4	S391 K396 W397	S391-G393 PolarHBondContact O-N 2.83Å; G393-K396 PolarHBondContact O-N 2.84Å; G393-W397 PolarHBondContact O-N 2.92Å
394	F	56.7	Low	49.4	Very low	37 Å²	37	74.5 Å²	74.5	16%	0.162	39%	0.391	C	S	.	.	H	α-helix	trans	-66.8	-42	178.1	-176.7	-85.2	0	0	0	112.9	W125 L182 T184 S391 P392 K396 W397 I398	W125-F394 AromaticContact CD1-CD1 3.87Å; W125-F394 AromaticContact CD1-CE1 3.02Å; W125-F394 AromaticContact CD1-CZ 3.35Å; W125-F394 HydrophobicContact CD2-CE1 4.41Å; W125-F394 AromaticContact CG-CE1 3.84Å; W125-F394 HydrophobicContact CG-CE1 3.84Å; W125-F394 HydrophobicContact CG-CZ 4.24Å; W125-F394 AromaticContact NE1-CD1 3.46Å; W125-F394 AromaticContact NE1-CE1 3.1Å; W125-F394 AromaticContact NE1-CZ 3.84Å; L182-F394 HydrophobicContact CB-CZ 4.48Å; L182-F394 HydrophobicContact CD1-CZ 3.94Å; T184-F394 HydrophobicContact CG2-CD2 3.73Å; T184-F394 HydrophobicContact CG2-CE2 3.58Å; S391-F394 PolarHBondContact O-N 2.69Å; S391-F394 PolarHBondContact OG-N 3.01Å; P392-F394 VanDerWaalsContact C-N 3.29Å; P392-F394 PolarHBondContact O-N 3.06Å; F394-K396 VanDerWaalsContact C-N 3.35Å; F394-W397 HydrophobicContact CD2-CE3 4.21Å; F394-W397 AromaticContact CE2-CE3 3.72Å; F394-W397 HydrophobicContact CE2-CE3 3.72Å; F394-W397 AromaticContact CE2-CZ3 3.81Å; F394-W397 HydrophobicContact CE2-CZ3 3.81Å; F394-W397 AromaticContact CZ-CE3 3.91Å; F394-W397 HydrophobicContact CZ-CE3 3.91Å; F394-W397 AromaticContact CZ-CZ3 3.78Å; F394-W397 HydrophobicContact CZ-CZ3 3.78Å; F394-W397 WeakPolarHBondContact O-CB 3.38Å; F394-W397 PolarHBondContact O-N 3.19Å; F394-I398 HydrophobicContact CD1-CD1 4.34Å; F394-I398 HydrophobicContact CD1-CG1 4.49Å; F394-I398 HydrophobicContact CE1-CD1 3.44Å; F394-I398 VanDerWaalsContact CE1-CD1 3.44Å; F394-I398 HydrophobicContact CE1-CG1 3.78Å; F394-I398 HydrophobicContact CZ-CD1 4.03Å; F394-I398 HydrophobicContact CZ-CG1 4.16Å; F394-I398 PolarHBondContact O-N 3.38Å
395	L	58.1	Low	50.7	Low	14 Å²	14	70 Å²	70	7%	0.073	36%	0.361	C	S	.	.	H	α-helix	trans	-69.2	-35.2	176.6	-70.9	175.9	0	0	0	111.6	I33 Y37 W125 P392 I398 L399	I33-L395 HydrophobicContact CG2-CB 4.42Å; I33-L395 HydrophobicContact CG2-CD2 4.37Å; Y37-L395 HydrophobicContact CD2-CB 4.05Å; Y37-L395 HydrophobicContact CD2-CD1 3.9Å; Y37-L395 HydrophobicContact CG-CD1 4.42Å; W125-L395 HydrophobicContact CZ2-CD2 4.35Å; P392-L395 PolarHBondContact O-N 3.14Å; L395-I398 PolarHBondContact O-N 2.92Å; L395-L399 PolarHBondContact O-N 3.04Å
396	K	61	Low	51.9	Low	90 Å²	90	65.8 Å²	65.8	39%	0.391	33%	0.325	S	S	.	.	H	α-helix	trans	-59.8	-45.8	169.4	-174.9	-171.6	174.3	-146.1	0	111.3	L277 P392 G393 F394 I398 L399 E400	L277-K396 HydrophobicContact CD2-CD 4.25Å; P392-K396 PolarHBondContact O-N 3.33Å; P392-K396 VanDerWaalsContact O-N 3.13Å; G393-K396 PolarHBondContact O-N 2.84Å; F394-K396 VanDerWaalsContact C-N 3.35Å; K396-I398 VanDerWaalsContact C-N 3.34Å; K396-I398 PolarHBondContact O-N 2.83Å; K396-L399 WeakPolarHBondContact O-CB 3.43Å; K396-L399 PolarHBondContact O-N 3.27Å; K396-L399 VanDerWaalsContact O-N 3.14Å; K396-E400 WeakPolarHBondContact CE-OE1 3.36Å; K396-E400 IonicContact NZ-OE1 3.38Å; K396-E400 PolarHBondContact NZ-OE1 3.38Å; K396-E400 VanDerWaalsContact NZ-OE1 3.15Å; K396-E400 PolarHBondContact O-N 3.29Å; K396-E400 VanDerWaalsContact O-N 3.15Å
397	W	63.6	Low	53.1	Low	12 Å²	12	63.9 Å²	63.9	5%	0.045	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-40.7	176.5	169.7	62.8	0	0	0	112.8	L182 L183 T184 P185 G393 F394 L399 E400 R401	L182-W397 HydrophobicContact CB-CH2 3.85Å; L182-W397 HydrophobicContact CB-CZ3 3.85Å; L182-W397 HydrophobicContact CD2-CH2 4.08Å; L182-W397 HydrophobicContact CD2-CZ3 4.32Å; L182-W397 HydrophobicContact CG-CZ3 4.48Å; L183-W397 VanDerWaalsContact C-CZ2 3.47Å; L183-W397 WeakPolarHBondContact O-CZ2 3.37Å; T184-W397 HydrophobicContact CG2-CD2 4.24Å; T184-W397 HydrophobicContact CG2-CE3 3.96Å; T184-W397 HydrophobicContact CG2-CZ3 4.2Å; P185-W397 HydrophobicContact CG-CB 4.43Å; P185-W397 HydrophobicContact CG-CG 3.87Å; G393-W397 PolarHBondContact O-N 2.92Å; F394-W397 HydrophobicContact CD2-CE3 4.21Å; F394-W397 AromaticContact CE2-CE3 3.72Å; F394-W397 HydrophobicContact CE2-CE3 3.72Å; F394-W397 AromaticContact CE2-CZ3 3.81Å; F394-W397 HydrophobicContact CE2-CZ3 3.81Å; F394-W397 AromaticContact CZ-CE3 3.91Å; F394-W397 HydrophobicContact CZ-CE3 3.91Å; F394-W397 AromaticContact CZ-CZ3 3.78Å; F394-W397 HydrophobicContact CZ-CZ3 3.78Å; F394-W397 WeakPolarHBondContact O-CB 3.38Å; F394-W397 PolarHBondContact O-N 3.19Å; W397-L399 VanDerWaalsContact C-N 3.26Å; W397-L399 PolarHBondContact O-N 2.76Å; W397-E400 PolarHBondContact O-N 3.49Å; W397-R401 HydrophobicContact CD2-CB 4.44Å; W397-R401 HydrophobicContact CH2-CG 4.5Å; W397-R401 HydrophobicContact CZ2-CB 3.79Å; W397-R401 HydrophobicContact CZ2-CG 3.62Å; W397-R401 WeakPolarHBondContact O-CB 3.19Å; W397-R401 PolarHBondContact O-N 2.89Å
398	I	58.9	Low	53.8	Low	8 Å²	8	60.2 Å²	60.2	4%	0.041	31%	0.308	C	S	.	.	H	α-helix	trans	-55.3	-44.7	174.8	-86.3	-171.5	0	0	0	110.4	F29 I33 F394 L395 K396 R401 F402	F29-I398 HydrophobicContact CE1-CG2 3.68Å; F29-I398 HydrophobicContact CZ-CG2 4.02Å; I33-I398 HydrophobicContact CD1-CG2 3.93Å; I33-I398 HydrophobicContact CG1-CG2 3.94Å; I33-I398 HydrophobicContact CG2-CG2 4.42Å; F394-I398 HydrophobicContact CD1-CD1 4.34Å; F394-I398 HydrophobicContact CD1-CG1 4.49Å; F394-I398 HydrophobicContact CE1-CD1 3.44Å; F394-I398 VanDerWaalsContact CE1-CD1 3.44Å; F394-I398 HydrophobicContact CE1-CG1 3.78Å; F394-I398 HydrophobicContact CZ-CD1 4.03Å; F394-I398 HydrophobicContact CZ-CG1 4.16Å; F394-I398 PolarHBondContact O-N 3.38Å; L395-I398 PolarHBondContact O-N 2.92Å; K396-I398 VanDerWaalsContact C-N 3.34Å; K396-I398 PolarHBondContact O-N 2.83Å; I398-R401 PolarHBondContact O-N 2.82Å; I398-F402 HydrophobicContact CG2-CD2 4Å; I398-F402 VanDerWaalsContact O-CB 3.29Å; I398-F402 WeakPolarHBondContact O-CB 3.38Å; I398-F402 VanDerWaalsContact O-CD2 3.3Å; I398-F402 WeakPolarHBondContact O-CD2 3.46Å; I398-F402 PolarHBondContact O-N 3.14Å
399	L	61.4	Low	54.4	Low	15 Å²	15	56.2 Å²	56.2	8%	0.079	29%	0.288	C	S	.	.	H	α-helix	trans	-59.9	-51.9	177.5	-64.9	168.5	0	0	0	111.3	D30 I33 F281 L395 K396 W397 R401 F402 Q403	D30-L399 HydrophobicContact CB-CD2 3.74Å; I33-L399 HydrophobicContact CB-CD2 3.88Å; I33-L399 HydrophobicContact CB-CG 4.5Å; I33-L399 HydrophobicContact CG2-CD1 4.22Å; I33-L399 HydrophobicContact CG2-CD2 3.78Å; I33-L399 HydrophobicContact CG2-CG 3.84Å; F281-L399 HydrophobicContact CE1-CB 4.14Å; F281-L399 HydrophobicContact CE1-CD1 4.48Å; F281-L399 HydrophobicContact CE2-CD1 4.3Å; F281-L399 HydrophobicContact CZ-CB 4.07Å; F281-L399 HydrophobicContact CZ-CD1 3.68Å; F281-L399 HydrophobicContact CZ-CG 4.43Å; L395-L399 PolarHBondContact O-N 3.04Å; K396-L399 WeakPolarHBondContact O-CB 3.43Å; K396-L399 PolarHBondContact O-N 3.27Å; K396-L399 VanDerWaalsContact O-N 3.14Å; W397-L399 VanDerWaalsContact C-N 3.26Å; W397-L399 PolarHBondContact O-N 2.76Å; L399-R401 PolarHBondContact O-N 3.41Å; L399-F402 PolarHBondContact O-N 3.49Å; L399-Q403 WeakPolarHBondContact O-CB 3.11Å; L399-Q403 VanDerWaalsContact O-CG 3.24Å; L399-Q403 WeakPolarHBondContact O-CG 2.94Å; L399-Q403 PolarHBondContact O-N 3.28Å
400	E	60.7	Low	54.3	Low	76 Å²	76	58.4 Å²	58.4	36%	0.355	29%	0.294	S	S	.	.	H	α-helix	trans	-58.3	-47.3	179.4	-66.6	172	172.3	0	0	112.1	K396 W397 H404	K396-E400 WeakPolarHBondContact CE-OE1 3.36Å; K396-E400 IonicContact NZ-OE1 3.38Å; K396-E400 PolarHBondContact NZ-OE1 3.38Å; K396-E400 VanDerWaalsContact NZ-OE1 3.15Å; K396-E400 PolarHBondContact O-N 3.29Å; K396-E400 VanDerWaalsContact O-N 3.15Å; W397-E400 PolarHBondContact O-N 3.49Å; E400-H404 PolarHBondContact O-CD2 3.22Å; E400-H404 VanDerWaalsContact O-CD2 3.24Å; E400-H404 PolarHBondContact O-N 3.04Å
401	R	59.1	Low	53.6	Low	59 Å²	59	58.4 Å²	58.4	22%	0.223	30%	0.303	C	S	.	.	H	α-helix	trans	-71.8	-40.6	-177.6	-157.2	70.7	170.7	150.2	-0.2	112.2	A170 G171 W397 I398 L399 Q403 H404 L405	A170-R401 PolarHBondContact O-NH2 3.46Å; G171-R401 PolarHBondContact O-NE 3.04Å; G171-R401 PolarHBondContact O-NH2 3.35Å; W397-R401 HydrophobicContact CD2-CB 4.44Å; W397-R401 HydrophobicContact CH2-CG 4.5Å; W397-R401 HydrophobicContact CZ2-CB 3.79Å; W397-R401 HydrophobicContact CZ2-CG 3.62Å; W397-R401 WeakPolarHBondContact O-CB 3.19Å; W397-R401 PolarHBondContact O-N 2.89Å; I398-R401 PolarHBondContact O-N 2.82Å; L399-R401 PolarHBondContact O-N 3.41Å; R401-Q403 VanDerWaalsContact C-N 3.33Å; R401-Q403 PolarHBondContact O-N 3.42Å; R401-H404 PolarHBondContact O-N 2.77Å; R401-L405 HydrophobicContact CG-CD1 4.3Å; R401-L405 WeakPolarHBondContact O-CB 3.27Å; R401-L405 WeakPolarHBondContact O-CG 3.44Å; R401-L405 PolarHBondContact O-N 2.81Å
402	F	59.5	Low	52.6	Low	7 Å²	7	59.9 Å²	59.9	3%	0.031	31%	0.313	C	S	.	.	H	α-helix	trans	-69.6	-30.1	178.2	-86	-88.9	0	0	0	113	F29 E118 C121 I398 L399 L405 R406	F29-F402 HydrophobicContact CE1-CB 4.08Å; F29-F402 HydrophobicContact CE1-CD1 4.32Å; F29-F402 HydrophobicContact CE1-CD2 4.17Å; F29-F402 AromaticContact CE1-CG 3.88Å; F29-F402 HydrophobicContact CE1-CG 3.88Å; F29-F402 HydrophobicContact CZ-CD1 4.3Å; F29-F402 HydrophobicContact CZ-CD2 4.25Å; F29-F402 HydrophobicContact CZ-CG 4.15Å; E118-F402 HydrophobicContact CG-CD1 4.43Å; E118-F402 HydrophobicContact CG-CE1 4.14Å; C121-F402 HydrophobicContact CB-CE1 4.42Å; C121-F402 HydrophobicContact CB-CE2 4.19Å; C121-F402 HydrophobicContact CB-CZ 3.47Å; C121-F402 VanDerWaalsContact CB-CZ 3.47Å; I398-F402 HydrophobicContact CG2-CD2 4Å; I398-F402 VanDerWaalsContact O-CB 3.29Å; I398-F402 WeakPolarHBondContact O-CB 3.38Å; I398-F402 VanDerWaalsContact O-CD2 3.3Å; I398-F402 WeakPolarHBondContact O-CD2 3.46Å; I398-F402 PolarHBondContact O-N 3.14Å; L399-F402 PolarHBondContact O-N 3.49Å; F402-L405 HydrophobicContact CD1-CD1 4.2Å; F402-L405 HydrophobicContact CD2-CD1 4.47Å; F402-L405 HydrophobicContact CE1-CD1 4.11Å; F402-L405 HydrophobicContact CE2-CD1 4.4Å; F402-L405 HydrophobicContact CG-CD1 4.36Å; F402-L405 HydrophobicContact CZ-CD1 4.18Å; F402-R406 WeakPolarHBondContact O-CB 3.38Å; F402-R406 VanDerWaalsContact O-CG 3.32Å; F402-R406 WeakPolarHBondContact O-CG 3.39Å; F402-R406 PolarHBondContact O-N 3.42Å
403	Q	60.5	Low	51.5	Low	50 Å²	50	67.1 Å²	67.1	23%	0.234	33%	0.334	C	S	.	.	H	α-helix	trans	-65.4	-49.1	170.5	-73	168.8	2.1	0	0	111.2	D30 L399 R401 L405 R406 L407	D30-Q403 PolarHBondContact OD2-NE2 2.72Å; L399-Q403 WeakPolarHBondContact O-CB 3.11Å; L399-Q403 VanDerWaalsContact O-CG 3.24Å; L399-Q403 WeakPolarHBondContact O-CG 2.94Å; L399-Q403 PolarHBondContact O-N 3.28Å; R401-Q403 VanDerWaalsContact C-N 3.33Å; R401-Q403 PolarHBondContact O-N 3.42Å; Q403-L405 VanDerWaalsContact C-N 3.34Å; Q403-L405 PolarHBondContact O-N 2.77Å; Q403-R406 PolarHBondContact O-N 3.41Å; Q403-L407 WeakPolarHBondContact O-CG 3.39Å; Q403-L407 PolarHBondContact O-N 2.85Å
404	H	57.1	Low	50	Low	126 Å²	126	72.8 Å²	72.8	58%	0.583	35%	0.353	S	S	*	.	H	α-helix	trans	-58.7	-42.2	173.4	-80	-63.7	0	0	0	113.3	E400 R401 L407 S408	E400-H404 PolarHBondContact O-CD2 3.22Å; E400-H404 VanDerWaalsContact O-CD2 3.24Å; E400-H404 PolarHBondContact O-N 3.04Å; R401-H404 PolarHBondContact O-N 2.77Å; H404-L407 PolarHBondContact O-N 2.58Å; H404-S408 PolarHBondContact O-N 2.95Å
405	L	54.2	Low	48.5	Very low	8 Å²	8	75.4 Å²	75.4	4%	0.042	38%	0.376	C	S	.	.	H	α-helix	trans	-59.3	-53.4	175.3	-72.5	165.1	0	0	0	110.8	A170 A172 R401 F402 Q403 L407 S408 W409	A170-L405 HydrophobicContact CB-CD2 3.4Å; A172-L405 HydrophobicContact CB-CD1 3.72Å; A172-L405 HydrophobicContact CB-CD2 4.16Å; R401-L405 HydrophobicContact CG-CD1 4.3Å; R401-L405 WeakPolarHBondContact O-CB 3.27Å; R401-L405 WeakPolarHBondContact O-CG 3.44Å; R401-L405 PolarHBondContact O-N 2.81Å; F402-L405 HydrophobicContact CD1-CD1 4.2Å; F402-L405 HydrophobicContact CD2-CD1 4.47Å; F402-L405 HydrophobicContact CE1-CD1 4.11Å; F402-L405 HydrophobicContact CE2-CD1 4.4Å; F402-L405 HydrophobicContact CG-CD1 4.36Å; F402-L405 HydrophobicContact CZ-CD1 4.18Å; Q403-L405 VanDerWaalsContact C-N 3.34Å; Q403-L405 PolarHBondContact O-N 2.77Å; L405-L407 VanDerWaalsContact C-N 3.27Å; L405-L407 PolarHBondContact O-N 3.39Å; L405-S408 CarbonylContact O-C 3.57Å; L405-S408 WeakPolarHBondContact O-CA 3.45Å; L405-S408 PolarHBondContact O-N 2.68Å; L405-S408 PolarHBondContact O-OG 3.06Å; L405-W409 VanDerWaalsContact C-CD1 3.44Å; L405-W409 HydrophobicContact CD2-CZ2 4.47Å; L405-W409 VanDerWaalsContact O-CG 3.3Å; L405-W409 PolarHBondContact O-N 3.07Å
406	R	55.3	Low	46.9	Very low	39 Å²	39	80.9 Å²	80.9	15%	0.147	41%	0.414	C	S	.	.	H	α-helix	trans	-60.7	-34	-179.6	-73	179.9	-163.2	118.9	11.5	113.3	H27 D30 E118 F402 Q403 W409 R410	H27-R406 PolarHBondContact CE1-NE 2.89Å; H27-R406 VanDerWaalsContact ND1-CZ 3.32Å; H27-R406 PolarHBondContact ND1-NH1 3.03Å; D30-R406 IonicContact OD1-CZ 3.15Å; D30-R406 IonicContact OD1-NH1 2.82Å; D30-R406 PolarHBondContact OD1-NH1 2.95Å; E118-R406 IonicContact OE1-CZ 3.13Å; E118-R406 VanDerWaalsContact OE1-CZ 3.28Å; E118-R406 IonicContact OE1-NE 3.69Å; E118-R406 PolarHBondContact OE1-NE 3.21Å; E118-R406 IonicContact OE1-NH2 3.52Å; E118-R406 PolarHBondContact OE1-NH2 2.86Å; F402-R406 WeakPolarHBondContact O-CB 3.38Å; F402-R406 VanDerWaalsContact O-CG 3.32Å; F402-R406 WeakPolarHBondContact O-CG 3.39Å; F402-R406 PolarHBondContact O-N 3.42Å; Q403-R406 PolarHBondContact O-N 3.41Å; R406-W409 PolarHBondContact O-N 2.87Å; R406-R410 PolarHBondContact O-N 2.9Å
407	L	52.2	Low	45.4	Very low	97 Å²	97	83.5 Å²	83.5	51%	0.508	44%	0.437	S	S	.	.	H	α-helix	trans	-64.1	-44	171.8	-69	170.7	0	0	0	111.3	Q403 H404 L405 W409 R410	Q403-L407 WeakPolarHBondContact O-CG 3.39Å; Q403-L407 PolarHBondContact O-N 2.85Å; H404-L407 PolarHBondContact O-N 2.58Å; L405-L407 VanDerWaalsContact C-N 3.27Å; L405-L407 PolarHBondContact O-N 3.39Å; L407-W409 VanDerWaalsContact C-N 3.31Å; L407-W409 PolarHBondContact O-N 2.84Å; L407-R410 PolarHBondContact O-N 2.93Å
408	S	45.1	Very low	43.6	Very low	73 Å²	73	91.7 Å²	91.7	51%	0.51	48%	0.476	S	S	.	.	H	α-helix	trans	-69.5	-22.6	175.6	71.3	0	0	0	0	114.8	H404 L405	H404-S408 PolarHBondContact O-N 2.95Å; L405-S408 CarbonylContact O-C 3.57Å; L405-S408 WeakPolarHBondContact O-CA 3.45Å; L405-S408 PolarHBondContact O-N 2.68Å; L405-S408 PolarHBondContact O-OG 3.06Å
409	W	42.3	Very low	42.1	Very low	86 Å²	86	98.9 Å²	98.9	33%	0.326	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	0.5	177.9	-58.8	130.3	0	0	0	114.2	V166 A170 L405 R406 L407 P411	V166-W409 HydrophobicContact CB-CH2 4.37Å; V166-W409 HydrophobicContact CG1-CH2 3.41Å; V166-W409 VanDerWaalsContact CG1-CH2 3.41Å; V166-W409 HydrophobicContact CG1-CZ2 3.52Å; V166-W409 HydrophobicContact CG1-CZ3 4.05Å; A170-W409 HydrophobicContact CB-CH2 4.15Å; A170-W409 HydrophobicContact CB-CZ2 3.64Å; L405-W409 VanDerWaalsContact C-CD1 3.44Å; L405-W409 HydrophobicContact CD2-CZ2 4.47Å; L405-W409 VanDerWaalsContact O-CG 3.3Å; L405-W409 PolarHBondContact O-N 3.07Å; R406-W409 PolarHBondContact O-N 2.87Å; L407-W409 VanDerWaalsContact C-N 3.31Å; L407-W409 PolarHBondContact O-N 2.84Å; W409-P411 WeakPolarHBondContact O-CD 3.43Å
410	R	31.8	Very low	40.6	Very low	146 Å²	146	107.1 Å²	107.1	55%	0.551	55%	0.553	S	S	*	*	S	Bend	trans	-73.3	126.1	168.5	-74.9	-165.6	177.6	-156.4	-1.6	109.2	I286 R406 L407 S412	I286-R410 PolarHBondContact O-NH1 2.95Å; R406-R410 PolarHBondContact O-N 2.9Å; L407-R410 PolarHBondContact O-N 2.93Å; R410-S412 PolarHBondContact O-N 3.44Å
411	P	29.8	Very low	39	Very low	100 Å²	100	111.3 Å²	111.3	65%	0.649	58%	0.576	S	S	*	*			trans	-57.9	131.9	173.5	-25.2	35.3	0	0	0	111.5	W409 Y413	W409-P411 WeakPolarHBondContact O-CD 3.43Å; P411-Y413 HydrophobicContact CB-CD2 3.64Å; P411-Y413 HydrophobicContact CB-CE2 3.74Å; P411-Y413 PolarHBondContact O-N 2.91Å
412	S	27	Very low	37.6	Very low	112 Å²	112	117 Å²	117	78%	0.783	61%	0.607	S	S	*	*	S	Bend	trans	-75.5	63.4	-175.9	-49	0	0	0	0	112.9	R410	R410-S412 PolarHBondContact O-N 3.44Å
413	Y	27.6	Very low	36.3	Very low	209 Å²	209	124.7 Å²	124.7	82%	0.82	64%	0.643	S	S	*	*			trans	-108.1	44	173.7	-61.1	-59.8	0	0	0	111.7	P411	P411-Y413 HydrophobicContact CB-CD2 3.64Å; P411-Y413 HydrophobicContact CB-CE2 3.74Å; P411-Y413 PolarHBondContact O-N 2.91Å
414	L	27.3	Very low	34.9	Very low	164 Å²	164	127.7 Å²	127.7	86%	0.859	67%	0.667	S	S	*	*			trans	-132.8	62.6	171.1	-97.6	168.4	0	0	0	110.1
415	S	25.7	Very low	33.6	Very low	92 Å²	92	131 Å²	131	64%	0.643	68%	0.683	S	S	*	*	S	Bend	trans	-140.6	134.1	164.8	57	0	0	0	0	107.7
416	C	25.5	Very low	32.6	Very low	130 Å²	130	140.6 Å²	140.6	88%	0.878	72%	0.724	S	S	*	*	S	Bend	trans	72.9	46.4	175.8	-50.7	0	0	0	0	117.9
417	V	28.5	Very low	31.5	Very low	144 Å²	144	142 Å²	142	87%	0.873	75%	0.751	S	S	*	*			trans	-139.3	42.8	158.7	-157.5	0	0	0	0	112.3
418	E	26.4	Very low	30.4	Very low	185 Å²	185	147.1 Å²	147.1	86%	0.864	77%	0.769	S	S	*	*	S	Bend	trans	-148.5	46.9	-175.3	-148.4	155.6	-150.5	0	0	113.2
419	D	27.9	Very low	29.8	Very low	159 Å²	159	149.7 Å²	149.7	85%	0.85	78%	0.781	S	S	*	*	S	Bend	trans	-153	26.1	178.5	-129.9	-15.5	0	0	0	114.9
420	Q	28.8	Very low	29.2	Very low	188 Å²	188	150 Å²	150	88%	0.879	80%	0.797	S	S	*	*			trans	-138.8	60.2	176.1	-68.9	-165.6	22.7	0	0	113.5
421	I	28.1	Very low	29.1	Very low	164 Å²	164	151.6 Å²	151.6	84%	0.841	81%	0.811	S	S	*	*			trans	-119.7	67.3	160.3	-52.1	-177.9	0	0	0	108.5
422	M	29.2	Very low	29	Very low	179 Å²	179	152.1 Å²	152.1	88%	0.882	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-77.2	124.4	171	-78.4	-67	-75.9	0	0	109.9
423	H	32.2	Very low	29.1	Very low	167 Å²	167	153.5 Å²	153.5	77%	0.773	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-60.5	148.5	-178	-85.6	-86.5	0	0	0	113
424	P	30.6	Very low	29.4	Very low	114 Å²	114	151.7 Å²	151.7	74%	0.74	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.7	135.4	179	28.1	-35	0	0	0	111.6	K426	P424-K426 PolarHBondContact O-N 2.88Å
425	Q	30.2	Very low	29.5	Very low	196 Å²	196	150.3 Å²	150.3	92%	0.916	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-62.7	131.6	177.8	-68.4	-175.7	-10.5	0	0	111.9
426	K	33.7	Very low	29.9	Very low	209 Å²	209	150.5 Å²	150.5	91%	0.909	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-103.2	139.6	152.1	-75.5	-173.3	174.8	-178.3	0	108.4	P424	P424-K426 PolarHBondContact O-N 2.88Å
427	G	32	Very low	30	Very low	69 Å²	69	153 Å²	153	71%	0.711	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-86.2	162.2	-165.4	0	0	0	0	0	115.5
428	K	28.6	Very low	30.3	Very low	203 Å²	203	153 Å²	153	88%	0.883	80%	0.8	S	S	*	*			trans	32.5	124	141.9	-52.5	175.9	-178.5	177.5	0	116.3
429	T	32.6	Very low	30.5	Very low	127 Å²	127	150.3 Å²	150.3	78%	0.779	79%	0.788	S	S	*	*				-159.3	148	59.2	33.8	0	0	0	0	115.7
430	S	28.9	Very low	30.5	Very low	93 Å²	93	151.7 Å²	151.7	65%	0.65	78%	0.782	S	S	*	*			trans	59.7	125.5	138.2	-62	0	0	0	0	124.3
431	Q	31	Very low	30.5	Very low	180 Å²	180	150.9 Å²	150.9	84%	0.841	78%	0.778	S	S	*	*				78.6	145	128.8	-72.5	178.9	5.4	0	0	120.3
432	V	28.2	Very low	30.6	Very low	110 Å²	110	149 Å²	149	67%	0.667	77%	0.774	S	S	*	*			cis	-167.1	162.1	-16.6	74	0	0	0	0	111.6
433	M	28.1	Very low	30.6	Very low	141 Å²	141	146.1 Å²	146.1	70%	0.695	77%	0.769	S	S	*	*			trans	68.8	157.6	163.1	-67.4	-174.9	-167.6	0	0	117.7
434	K	33.1	Very low	30.4	Very low	172 Å²	172	143 Å²	143	75%	0.748	77%	0.766	S	S	*	*			cis	-152.3	153.7	-10.2	-122.5	164.2	-174.3	166.3	0	113.5
435	T	30.5	Very low	30.4	Very low	134 Å²	134	146.4 Å²	146.4	82%	0.822	77%	0.772	S	S	*	*			trans	-64.1	144.2	177.5	49.9	0	0	0	0	119.2
436	A	32.9	Very low	30.6	Very low	97 Å²	97	142.7 Å²	142.7	80%	0.802	77%	0.765	S	S	*	*			trans	-178.1	135.2	133.1	0	0	0	0	0	107.9
437	K	28.7	Very low	30.3	Very low	183 Å²	183	136.4 Å²	136.4	80%	0.796	75%	0.751	S	S	*	*			cis	100	138.1	36.2	-100.6	-150	169.4	-153	0	114.1
438	D	35.3	Very low	30.1	Very low	142 Å²	142	140.5 Å²	140.5	76%	0.759	76%	0.757	S	S	*	*			trans	105.5	152.8	165.1	-53.2	-8.8	0	0	0	117.7
439	E	28.9	Very low	30.2	Very low	129 Å²	129	139.8 Å²	139.8	60%	0.603	76%	0.757	S	S	*	*				-154	160.6	-65.7	-153.7	157.8	-136	0	0	111
440	Y	28.1	Very low	30.1	Very low	188 Å²	188	139.2 Å²	139.2	74%	0.737	76%	0.755	S	S	*	*			trans	66.4	155.2	174.2	-49.6	-73.5	0	0	0	117.6
441	H	28.7	Very low	30	Very low	171 Å²	171	140.3 Å²	140.3	79%	0.792	76%	0.76	S	S	*	*			cis	-149.5	165.3	-2.8	-143	4.4	0	0	0	110.8
442	V	30.6	Very low	29.9	Very low	125 Å²	125	139.8 Å²	139.8	76%	0.758	76%	0.758	S	S	*	*			trans	-146.5	142.1	-178.7	176.7	0	0	0	0	111.6
443	P	29.4	Very low	29.9	Very low	119 Å²	119	141.7 Å²	141.7	77%	0.773	76%	0.764	S	S	*	*			trans	-135.1	123.7	144.6	17.4	4.7	0	0	0	115.5
444	S	29.1	Very low	29.8	Very low	102 Å²	102	143.2 Å²	143.2	71%	0.713	77%	0.769	S	S	*	*			trans	41.7	109.6	144	57	0	0	0	0	123.2
445	H	30.9	Very low	29.5	Very low	185 Å²	185	139.2 Å²	139.2	86%	0.856	77%	0.768	S	S	*	*				-1	162.3	122.5	-71.4	-42.5	0	0	0	120.9
446	P	33.3	Very low	29.2	Very low	118 Å²	118	139.9 Å²	139.9	77%	0.766	77%	0.765	S	S	*	*			cis	-145.3	176	29.5	43	-23.4	0	0	0	120.2
447	A	27	Very low	28.7	Very low	76 Å²	76	139.1 Å²	139.1	63%	0.628	75%	0.754	S	S	*	*			trans	57.5	103.8	147.5	0	0	0	0	0	121.9
448	N	28.4	Very low	28.6	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	75%	0.754	S	S	*	*				157.5	109.6	114.9	-82.9	-34	0	0	0	112.8
449	Q	30.2	Very low	28.4	Very low	188 Å²	188	140.9 Å²	140.9	88%	0.879	75%	0.754	S	S	*	*			trans	167.7	127	142.4	-96.9	167.5	24.7	0	0	111.7
450	P	30.7	Very low	28.4	Very low	115 Å²	115	140.2 Å²	140.2	75%	0.747	76%	0.763	S	S	*	*			trans	-79.9	161.5	158.2	34.1	-32.2	0	0	0	111
451	P	27.8	Very low	29	Very low	116 Å²	116	135.1 Å²	135.1	75%	0.753	75%	0.745	S	S	*	*			trans	-74.9	159.3	-163.6	29.3	-36.6	0	0	0	115.4	N453	P451-N453 PolarHBondContact O-N 2.91Å; P451-N453 VanDerWaalsContact O-N 3.16Å
452	Q	28	Very low	29.3	Very low	169 Å²	169	129.7 Å²	129.7	79%	0.79	73%	0.726	S	S	*	*			trans	-68.8	104.7	177.6	-68	178	-15.6	0	0	111.9	H454	Q452-H454 PolarHBondContact O-N 2.95Å
453	N	27.7	Very low	29.5	Very low	151 Å²	151	128 Å²	128	81%	0.807	72%	0.717	S	S	*	*			trans	-73.6	109.5	163.6	-80.6	-31.8	0	0	0	109.7	P451 A455	P451-N453 PolarHBondContact O-N 2.91Å; P451-N453 VanDerWaalsContact O-N 3.16Å; N453-A455 PolarHBondContact O-N 2.91Å
454	H	27.2	Very low	29.9	Very low	172 Å²	172	125.6 Å²	125.6	80%	0.796	70%	0.703	S	S	*	*			trans	-69.8	77.2	166.1	-81.2	-77.9	0	0	0	110.4	Q452 I456	Q452-H454 PolarHBondContact O-N 2.95Å; H454-I456 PolarHBondContact O-N 3.25Å
455	A	25.5	Very low	30.2	Very low	88 Å²	88	123.9 Å²	123.9	73%	0.727	69%	0.687	S	S	*	*			trans	-64.7	117.9	172.7	0	0	0	0	0	109.8	N453 S457	N453-A455 PolarHBondContact O-N 2.91Å; A455-S457 PolarHBondContact O-N 2.93Å
456	I	24.4	Very low	30.7	Very low	148 Å²	148	116 Å²	116	76%	0.759	65%	0.65	S	S	*	*			trans	-64.7	109.1	170.5	-63.3	173.5	0	0	0	107.2	H454 H458	H454-I456 PolarHBondContact O-N 3.25Å; I456-H458 PolarHBondContact O-CD2 3.29Å; I456-H458 PolarHBondContact O-N 3.49Å
457	S	23.1	Very low	31.1	Very low	81 Å²	81	117.9 Å²	117.9	57%	0.566	64%	0.642	S	S	*	*			trans	-72.9	93	-176.5	41.9	0	0	0	0	111	A455 Y459	A455-S457 PolarHBondContact O-N 2.93Å; S457-Y459 VanDerWaalsContact C-N 3.31Å; S457-Y459 VanDerWaalsContact O-CD2 3.26Å; S457-Y459 WeakPolarHBondContact O-CD2 3.38Å; S457-Y459 PolarHBondContact O-N 2.83Å
458	H	26.1	Very low	31.6	Very low	170 Å²	170	121.3 Å²	121.3	79%	0.787	64%	0.639	S	S	*	*			trans	-64.9	91.7	164.5	-76.6	-96.7	0	0	0	109.3	I456 S460	I456-H458 PolarHBondContact O-CD2 3.29Å; I456-H458 PolarHBondContact O-N 3.49Å; H458-S460 VanDerWaalsContact C-N 3.31Å; H458-S460 PolarHBondContact O-N 2.9Å
459	Y	30.8	Very low	32.1	Very low	193 Å²	193	114.4 Å²	114.4	76%	0.757	60%	0.603	S	S	*	*			trans	-64.5	86.9	174	-79.5	-89.3	0	0	0	110.8	S457 F461	S457-Y459 VanDerWaalsContact C-N 3.31Å; S457-Y459 VanDerWaalsContact O-CD2 3.26Å; S457-Y459 WeakPolarHBondContact O-CD2 3.38Å; S457-Y459 PolarHBondContact O-N 2.83Å; Y459-F461 PolarHBondContact O-N 2.92Å; Y459-F461 VanDerWaalsContact O-N 3.14Å
460	S	30	Very low	32.8	Very low	115 Å²	115	106.6 Å²	106.6	80%	0.804	57%	0.566	S	S	*	*			trans	-72.6	98.5	172.7	55.4	0	0	0	0	109.8	H458 S462	H458-S460 VanDerWaalsContact C-N 3.31Å; H458-S460 PolarHBondContact O-N 2.9Å; S460-S462 PolarHBondContact O-N 3Å
461	F	40	Very low	33.1	Very low	81 Å²	81	104.8 Å²	104.8	36%	0.355	56%	0.556	S	S	.	*			trans	-61.2	130.5	175.6	-89.5	-94.2	0	0	0	111.3	L188 K192 E195 Y459	L188-F461 HydrophobicContact CD1-CZ 4.44Å; K192-F461 HydrophobicContact CG-CZ 4.25Å; E195-F461 WeakPolarHBondContact OE2-CE1 3.29Å; Y459-F461 PolarHBondContact O-N 2.92Å; Y459-F461 VanDerWaalsContact O-N 3.14Å
462	S	34.4	Very low	33.4	Very low	56 Å²	56	106.1 Å²	106.1	39%	0.392	56%	0.556	S	S	.	*			trans	-74.9	130.7	171.8	-176.8	0	0	0	0	110.4	S460 S464 N465	S460-S462 PolarHBondContact O-N 3Å; S462-S464 WeakPolarHBondContact CB-OG 3.47Å; S462-S464 PolarHBondContact O-N 3.45Å; S462-S464 PolarHBondContact OG-N 3.38Å; S462-S464 PolarHBondContact OG-OG 3.37Å; S462-N465 PolarHBondContact O-N 3.03Å
463	P	36.7	Very low	33.9	Very low	89 Å²	89	102.6 Å²	102.6	58%	0.578	55%	0.55	S	S	*	.	H	α-helix	trans	-58.6	-17.4	174.5	-25.8	35.5	0	0	0	114.7
464	S	37.7	Very low	34.2	Very low	69 Å²	69	98.8 Å²	98.8	48%	0.483	53%	0.529	S	S	.	.	H	α-helix	trans	-61.1	-46.3	174.5	52.9	0	0	0	0	112.6	S462 L466 R467	S462-S464 WeakPolarHBondContact CB-OG 3.47Å; S462-S464 PolarHBondContact O-N 3.45Å; S462-S464 PolarHBondContact OG-N 3.38Å; S462-S464 PolarHBondContact OG-OG 3.37Å; S464-L466 PolarHBondContact O-N 3.12Å; S464-R467 PolarHBondContact O-N 3.2Å
465	N	34.9	Very low	34.4	Very low	67 Å²	67	98.7 Å²	98.7	36%	0.358	53%	0.529	S	S	.	.	H	α-helix	trans	-70.8	-38.3	-170.7	-62.6	16.9	0	0	0	110.7	E195 S462 R467 R468 C469	E195-N465 WeakPolarHBondContact OE1-CB 3.28Å; E195-N465 PolarHBondContact OE1-ND2 3.37Å; S462-N465 PolarHBondContact O-N 3.03Å; N465-R467 VanDerWaalsContact C-N 3.29Å; N465-R467 PolarHBondContact O-N 2.94Å; N465-R468 WeakPolarHBondContact O-CB 3.42Å; N465-R468 PolarHBondContact O-N 2.83Å; N465-C469 PolarHBondContact O-N 3.31Å; N465-C469 VanDerWaalsContact O-N 3.13Å; N465-C469 PolarHBondContact O-SG 3.11Å
466	L	40.5	Very low	34.6	Very low	18 Å²	18	97.6 Å²	97.6	9%	0.094	53%	0.527	C	S	.	.	H	α-helix	trans	-63.6	-30.4	176.9	-71.9	171.9	0	0	0	112.9	A191 S464 C469 F470	A191-L466 HydrophobicContact CB-CD2 4.41Å; S464-L466 PolarHBondContact O-N 3.12Å; L466-C469 PolarHBondContact O-N 2.97Å; L466-F470 HydrophobicContact CD2-CE2 4.34Å; L466-F470 VanDerWaalsContact O-CD2 3.3Å; L466-F470 WeakPolarHBondContact O-CD2 3.31Å
467	R	41.4	Very low	34.7	Very low	159 Å²	159	100.3 Å²	100.3	60%	0.6	53%	0.533	S	S	*	.	H	α-helix	trans	-62.9	-49.4	172.2	-70.6	-171.4	178.8	-156.6	-0.3	110.9	S464 N465 C469 F470 S471	S464-R467 PolarHBondContact O-N 3.2Å; N465-R467 VanDerWaalsContact C-N 3.29Å; N465-R467 PolarHBondContact O-N 2.94Å; R467-C469 PolarHBondContact O-N 2.64Å; R467-F470 PolarHBondContact O-N 2.93Å; R467-F470 VanDerWaalsContact O-N 3.11Å; R467-S471 PolarHBondContact O-N 3.14Å; R467-S471 PolarHBondContact O-OG 3.08Å
468	R	38	Very low	35	Very low	148 Å²	148	101.3 Å²	101.3	56%	0.558	54%	0.54	S	S	*	.	H	α-helix	trans	-56.3	-35.7	178	-161.3	-177.4	-159.1	138.7	4.8	112.4	E199 N465 F470	E199-R468 VanDerWaalsContact CD-CZ 3.45Å; E199-R468 VanDerWaalsContact CD-NH2 3.27Å; E199-R468 IonicContact OE1-CZ 3.69Å; E199-R468 IonicContact OE1-NH1 2.8Å; E199-R468 PolarHBondContact OE1-NH1 2.97Å; E199-R468 IonicContact OE1-NH2 3.92Å; E199-R468 IonicContact OE2-CZ 3.18Å; E199-R468 IonicContact OE2-NH1 2.85Å; E199-R468 PolarHBondContact OE2-NH1 2.75Å; E199-R468 IonicContact OE2-NH2 2.68Å; E199-R468 PolarHBondContact OE2-NH2 2.83Å; N465-R468 WeakPolarHBondContact O-CB 3.42Å; N465-R468 PolarHBondContact O-N 2.83Å; R468-F470 VanDerWaalsContact C-N 3.3Å; R468-F470 PolarHBondContact O-N 3.5Å
469	C	40.1	Very low	35.3	Very low	10 Å²	10	99.9 Å²	99.9	7%	0.068	54%	0.538	C	S	.	.	H	α-helix	trans	-69	-19.6	-179.5	-64.2	0	0	0	0	115.1	A191 L194 N465 L466 R467	A191-C469 HydrophobicContact CB-CB 4.21Å; L194-C469 HydrophobicContact CD1-CB 4.05Å; N465-C469 PolarHBondContact O-N 3.31Å; N465-C469 VanDerWaalsContact O-N 3.13Å; N465-C469 PolarHBondContact O-SG 3.11Å; L466-C469 PolarHBondContact O-N 2.97Å; R467-C469 PolarHBondContact O-N 2.64Å
470	F	44	Very low	35.2	Very low	24 Å²	24	100.5 Å²	100.5	11%	0.105	55%	0.545	C	S	.	.	H	α-helix	trans	-127.7	-16	-172.7	-65.3	-67.6	0	0	0	115.2	Y174 K187 L466 R467 R468 L472 S473	Y174-F470 HydrophobicContact CD1-CE2 4.44Å; Y174-F470 AromaticContact CD2-CD2 3.32Å; Y174-F470 HydrophobicContact CD2-CD2 3.32Å; Y174-F470 AromaticContact CD2-CE2 3.43Å; Y174-F470 HydrophobicContact CD2-CE2 3.43Å; Y174-F470 VanDerWaalsContact CD2-CE2 3.43Å; Y174-F470 AromaticContact CD2-CG 3.99Å; Y174-F470 HydrophobicContact CD2-CG 3.99Å; Y174-F470 HydrophobicContact CD2-CZ 4.17Å; Y174-F470 HydrophobicContact CE1-CE2 4.46Å; Y174-F470 HydrophobicContact CE1-CZ 4.33Å; Y174-F470 HydrophobicContact CE2-CB 4.23Å; Y174-F470 AromaticContact CE2-CD1 3.78Å; Y174-F470 HydrophobicContact CE2-CD1 3.78Å; Y174-F470 AromaticContact CE2-CD2 3.27Å; Y174-F470 HydrophobicContact CE2-CD2 3.27Å; Y174-F470 AromaticContact CE2-CE1 3.93Å; Y174-F470 HydrophobicContact CE2-CE1 3.93Å; Y174-F470 AromaticContact CE2-CE2 3.46Å; Y174-F470 HydrophobicContact CE2-CE2 3.46Å; Y174-F470 VanDerWaalsContact CE2-CE2 3.46Å; Y174-F470 AromaticContact CE2-CG 3.46Å; Y174-F470 HydrophobicContact CE2-CG 3.46Å; Y174-F470 VanDerWaalsContact CE2-CG 3.46Å; Y174-F470 AromaticContact CE2-CZ 3.79Å; Y174-F470 HydrophobicContact CE2-CZ 3.79Å; Y174-F470 HydrophobicContact CG-CD2 4.27Å; Y174-F470 AromaticContact CG-CE2 3.95Å; Y174-F470 HydrophobicContact CG-CE2 3.95Å; Y174-F470 AromaticContact CZ-CE1 3.93Å; Y174-F470 AromaticContact CZ-CE2 3.99Å; Y174-F470 AromaticContact CZ-CZ 3.86Å; K187-F470 HydrophobicContact CB-CZ 4.28Å; L466-F470 HydrophobicContact CD2-CE2 4.34Å; L466-F470 VanDerWaalsContact O-CD2 3.3Å; L466-F470 WeakPolarHBondContact O-CD2 3.31Å; R467-F470 PolarHBondContact O-N 2.93Å; R467-F470 VanDerWaalsContact O-N 3.11Å; R468-F470 VanDerWaalsContact C-N 3.3Å; R468-F470 PolarHBondContact O-N 3.5Å; F470-L472 PolarHBondContact O-N 2.78Å; F470-L472 VanDerWaalsContact O-N 3.15Å; F470-S473 PolarHBondContact O-N 3.12Å
471	S	37.8	Very low	35.4	Very low	76 Å²	76	100.7 Å²	100.7	53%	0.531	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.8	172.7	-63.2	0	0	0	0	114.3	R467	R467-S471 PolarHBondContact O-N 3.14Å; R467-S471 PolarHBondContact O-OG 3.08Å
472	L	34	Very low	35	Very low	145 Å²	145	100.8 Å²	100.8	76%	0.759	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	6.1	179.7	-67.8	171.2	0	0	0	114.4	F470	F470-L472 PolarHBondContact O-N 2.78Å; F470-L472 VanDerWaalsContact O-N 3.15Å
473	S	37.7	Very low	34.9	Very low	94 Å²	94	103.6 Å²	103.6	66%	0.657	56%	0.556	S	S	*	*	S	Bend	trans	-115.4	-2.1	-174.4	-55.3	0	0	0	0	115.4	F470	F470-S473 PolarHBondContact O-N 3.12Å
474	D	34.4	Very low	34.8	Very low	71 Å²	71	106 Å²	106	38%	0.38	56%	0.559	S	S	.	*			trans	-121.6	12.3	-165.7	-106.3	-8.9	0	0	0	114.9	H178 G476	H178-D474 IonicContact CE1-OD2 2.83Å; H178-D474 PolarHBondContact CE1-OD2 3.11Å; H178-D474 IonicContact CG-OD2 2.92Å; H178-D474 IonicContact ND1-OD2 3.29Å; H178-D474 PolarHBondContact ND1-OD2 2.94Å; D474-G476 PolarHBondContact O-N 3.04Å
475	E	30.6	Very low	34.6	Very low	170 Å²	170	108.5 Å²	108.5	79%	0.794	57%	0.566	S	S	*	*			trans	-73.2	47.9	175.5	-70.2	-148.5	141.9	0	0	114	K477	E475-K477 PolarHBondContact O-N 3.13Å; E475-K477 VanDerWaalsContact O-N 3.11Å
476	G	29.7	Very low	34.5	Very low	65 Å²	65	111.6 Å²	111.6	67%	0.67	58%	0.581	S	S	*	*			trans	-81.4	77.3	175.1	0	0	0	0	0	113.4	D474	D474-G476 PolarHBondContact O-N 3.04Å
477	K	27.4	Very low	34.1	Very low	206 Å²	206	117.4 Å²	117.4	90%	0.896	61%	0.606	S	S	*	*	S	Bend	trans	84.1	95.9	171.3	-46.9	157.5	-176.6	171.9	0	116.8	E475	E475-K477 PolarHBondContact O-N 3.13Å; E475-K477 VanDerWaalsContact O-N 3.11Å
478	S	29.4	Very low	33.7	Very low	101 Å²	101	115.8 Å²	115.8	71%	0.706	61%	0.609	S	S	*	*				-162.1	157.1	116.8	72.3	0	0	0	0	112.5
479	N	31.4	Very low	33.3	Very low	141 Å²	141	114.2 Å²	114.2	75%	0.754	62%	0.62	S	S	*	*			trans	61.3	94.7	153.3	-56.9	-18.2	0	0	0	120.1	T481	N479-T481 PolarHBondContact O-N 3.02Å; N479-T481 VanDerWaalsContact O-N 3.11Å; N479-T481 PolarHBondContact O-OG1 3.13Å
480	K	29.6	Very low	32.7	Very low	206 Å²	206	118.8 Å²	118.8	90%	0.896	65%	0.651	S	S	*	*	S	Bend	trans	-3.2	89.1	145.3	-63.2	177.1	172.8	-178.6	0	117.8
481	T	33.2	Very low	31.9	Very low	118 Å²	118	122.4 Å²	122.4	72%	0.724	68%	0.68	S	S	*	*			trans	-156.4	-28.9	154.2	8.9	0	0	0	0	113.8	N479 D483	N479-T481 PolarHBondContact O-N 3.02Å; N479-T481 VanDerWaalsContact O-N 3.11Å; N479-T481 PolarHBondContact O-OG1 3.13Å; T481-D483 PolarHBondContact O-N 3.49Å
482	N	32.3	Very low	31.4	Very low	84 Å²	84	123.8 Å²	123.8	45%	0.449	69%	0.69	S	S	.	*	G	3₁₀ helix	trans	-86.3	7.5	-166.9	-66.7	-7.5	0	0	0	116.2	Q484 I485	N482-Q484 PolarHBondContact O-N 3.13Å; N482-I485 PolarHBondContact O-N 3.16Å
483	D	32.6	Very low	31.1	Very low	114 Å²	114	125.7 Å²	125.7	61%	0.61	70%	0.697	S	S	*	*	G	3₁₀ helix	trans	-61.3	-12.5	-178	-83.3	-54.5	0	0	0	115.2	T481	T481-D483 PolarHBondContact O-N 3.49Å
484	Q	33.9	Very low	30.4	Very low	139 Å²	139	130.3 Å²	130.3	65%	0.65	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-89.9	-24.9	-179.9	-158.8	63.3	28.1	0	0	113.5	N482	N482-Q484 PolarHBondContact O-N 3.13Å
485	I	33.1	Very low	30.2	Very low	123 Å²	123	131.3 Å²	131.3	63%	0.631	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.5	-37.7	-174	-63	176.9	0	0	0	111.2	N482 K487	N482-I485 PolarHBondContact O-N 3.16Å; I485-K487 VanDerWaalsContact C-N 3.27Å; I485-K487 PolarHBondContact O-N 3.37Å
486	I	33.2	Very low	30	Very low	131 Å²	131	128.8 Å²	128.8	67%	0.672	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-71.8	-20.4	-175.4	-63.9	176	0	0	0	112.4
487	K	32.3	Very low	29.7	Very low	141 Å²	141	135 Å²	135	61%	0.613	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-79.4	-23	-178.4	-75.5	175.9	-179.9	163.5	0	115.1	I485 C489	I485-K487 VanDerWaalsContact C-N 3.27Å; I485-K487 PolarHBondContact O-N 3.37Å; K487-C489 VanDerWaalsContact C-N 3.29Å; K487-C489 PolarHBondContact O-N 3.46Å
488	N	32	Very low	29.7	Very low	124 Å²	124	130.5 Å²	130.5	66%	0.663	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-79.6	-9.2	-175	-72.3	2.8	0	0	0	113.8
489	C	31.2	Very low	29.4	Very low	116 Å²	116	130.4 Å²	130.4	78%	0.784	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-103.3	20.6	-178.6	-63.6	0	0	0	0	113.5	K487	K487-C489 VanDerWaalsContact C-N 3.29Å; K487-C489 PolarHBondContact O-N 3.46Å
490	S	27.6	Very low	29.3	Very low	105 Å²	105	132.3 Å²	132.3	73%	0.734	73%	0.734	S	S	*	*	S	Bend	trans	-137.6	22.7	-172.5	-57.4	0	0	0	0	114.8
491	S	27.7	Very low	29.1	Very low	101 Å²	101	128.8 Å²	128.8	71%	0.706	72%	0.724	S	S	*	*	S	Bend	trans	-143.2	21.3	-173.9	68.3	0	0	0	0	116.1
492	S	26.7	Very low	28.9	Very low	105 Å²	105	130 Å²	130	73%	0.734	73%	0.725	S	S	*	*	S	Bend	trans	-128.5	133.7	177.1	-73.2	0	0	0	0	112
493	M	26.5	Very low	28.6	Very low	184 Å²	184	132 Å²	132	91%	0.906	74%	0.736	S	S	*	*			trans	80.3	44.9	179.9	-57.4	-177.5	-75.2	0	0	117.4
494	E	24.5	Very low	28.6	Very low	192 Å²	192	131.9 Å²	131.9	90%	0.897	74%	0.739	S	S	*	*				-89.3	146.7	127.7	-69.5	-166.4	143.6	0	0	108.7
495	A	29.2	Very low	28.3	Very low	91 Å²	91	133 Å²	133	75%	0.752	74%	0.744	S	S	*	*			trans	62.4	151	-175.6	0	0	0	0	0	115.6
496	S	27	Very low	28.4	Very low	118 Å²	118	132 Å²	132	83%	0.825	75%	0.748	S	S	*	*			cis	-155.1	171.1	-17.8	-110.8	0	0	0	0	110.5
497	F	23.8	Very low	28.5	Very low	196 Å²	196	133.3 Å²	133.3	86%	0.86	76%	0.756	S	S	*	*			trans	-75.5	163.1	-178	-83.3	-102.1	0	0	0	114.5
498	S	26	Very low	28.6	Very low	110 Å²	110	129.7 Å²	129.7	77%	0.769	76%	0.759	S	S	*	*			trans	76.4	154.8	161.2	-55.8	0	0	0	0	116.8
499	S	24.5	Very low	28.7	Very low	100 Å²	100	133.3 Å²	133.3	70%	0.699	77%	0.769	S	S	*	*			cis	178.9	174.9	-26.5	-90.9	0	0	0	0	105.9
500	E	28.2	Very low	28.7	Very low	180 Å²	180	132.7 Å²	132.7	84%	0.841	77%	0.766	S	S	*	*			trans	72	155.6	163.9	-62.8	-171.3	169.9	0	0	118.1
501	I	26.2	Very low	29	Very low	132 Å²	132	134.2 Å²	134.2	68%	0.677	77%	0.766	S	S	*	*			cis	-162.5	144.8	-42.2	-139.6	160.9	0	0	0	109.7
502	L	27.6	Very low	29.1	Very low	144 Å²	144	140 Å²	140	75%	0.754	77%	0.772	S	S	*	*			trans	62.6	168.8	165.7	-59	174.6	0	0	0	116.4
503	N	27.5	Very low	29.5	Very low	127 Å²	127	144.7 Å²	144.7	68%	0.679	78%	0.779	S	S	*	*			cis	-153.3	172.4	-0.2	-141.1	-11.1	0	0	0	113.8
504	V	31.6	Very low	29.6	Very low	110 Å²	110	147.4 Å²	147.4	67%	0.667	78%	0.779	S	S	*	*			trans	65.2	121.2	156.8	169.1	0	0	0	0	117
505	E	28.4	Very low	30	Very low	164 Å²	164	142.8 Å²	142.8	77%	0.766	77%	0.768	S	S	*	*			cis	106.4	119	23.1	178.6	-179	-146.6	0	0	113.4
506	S	35.4	Very low	30.2	Very low	100 Å²	100	143.5 Å²	143.5	70%	0.699	77%	0.768	S	S	*	*			trans	-179.3	119.5	131.4	56.6	0	0	0	0	114.7
507	N	34.1	Very low	30.4	Very low	159 Å²	159	148.5 Å²	148.5	85%	0.85	77%	0.77	S	S	*	*			trans	49.5	136.1	138.2	-58	-53.6	0	0	0	122.7
508	G	34.2	Very low	31	Very low	65 Å²	65	145.3 Å²	145.3	67%	0.67	77%	0.769	S	S	*	*			cis	157.2	179.9	-6.7	0	0	0	0	0	115.1
509	K	34.3	Very low	31.1	Very low	201 Å²	201	145.6 Å²	145.6	87%	0.874	77%	0.771	S	S	*	*			trans	71.7	104.2	171.9	-56.2	174.5	-177.2	174.5	0	115.6
510	S	31.3	Very low	31.7	Very low	103 Å²	103	149.6 Å²	149.6	72%	0.72	78%	0.776	S	S	*	*				85.9	144.5	87.8	87.3	0	0	0	0	112.7
511	D	35.5	Very low	31.9	Very low	137 Å²	137	148.5 Å²	148.5	73%	0.733	77%	0.771	S	S	*	*			cis	-149.3	-172	37.3	-124.8	-70	0	0	0	117.2
512	R	29.5	Very low	32.1	Very low	221 Å²	221	148.6 Å²	148.6	83%	0.834	77%	0.772	S	S	*	*			trans	-94.8	152.1	-160.6	-58.5	157.9	165.3	156.1	-7.2	117.9
513	K	34.9	Very low	32.5	Very low	204 Å²	204	148.8 Å²	148.8	89%	0.887	77%	0.769	S	S	*	*			trans	-176.1	129.9	134.1	-94.5	146.8	-172.7	177.2	0	108.6
514	R	28	Very low	32.5	Very low	241 Å²	241	149.5 Å²	149.5	91%	0.909	77%	0.771	S	S	*	*				57	132.6	66.5	-94.4	-167.4	175.2	-164.5	-0.5	113.4
515	S	32.3	Very low	32.5	Very low	95 Å²	95	153.1 Å²	153.1	66%	0.664	78%	0.779	S	S	*	*			cis	-163.5	173.2	10.3	56.5	0	0	0	0	116.1
516	S	33.4	Very low	32.5	Very low	106 Å²	106	149.9 Å²	149.9	74%	0.741	77%	0.774	S	S	*	*			trans	71.6	117.1	139.6	54.1	0	0	0	0	123.6
517	Y	32	Very low	32.1	Very low	223 Å²	223	153 Å²	153	88%	0.875	78%	0.777	S	S	*	*			trans	-70.4	165.8	144.9	-70.6	-94.4	0	0	0	111.3
518	P	35.4	Very low	32	Very low	130 Å²	130	153.9 Å²	153.9	84%	0.844	77%	0.774	S	S	*	*				-150	177.8	97.2	39.3	-21.6	0	0	0	116.4
519	S	28.7	Very low	31.7	Very low	115 Å²	115	156.2 Å²	156.2	80%	0.804	77%	0.771	S	S	*	*			trans	-100	160.3	-173.9	-45.5	0	0	0	0	115.4
520	K	36.2	Very low	31.7	Very low	185 Å²	185	153.9 Å²	153.9	80%	0.804	76%	0.763	S	S	*	*			trans	-146.9	123.8	164.9	-77.1	-163.2	178.4	-178.2	0	109.3
521	Q	32.5	Very low	31.7	Very low	157 Å²	157	157.7 Å²	157.7	73%	0.734	77%	0.768	S	S	*	*				73.1	134.6	81.8	-76.2	-178.7	-41.3	0	0	113.8
522	L	31	Very low	31.3	Very low	133 Å²	133	161.4 Å²	161.4	70%	0.696	77%	0.772	S	S	*	*			cis	-138.9	-174.4	-12.3	-60.6	105	0	0	0	107.2
523	H	35.8	Very low	31.4	Very low	149 Å²	149	156.6 Å²	156.6	69%	0.69	76%	0.763	S	S	*	*			cis	-133.4	176	4.6	-83.7	-87.5	0	0	0	108.5
524	L	26.9	Very low	31.1	Very low	141 Å²	141	154.7 Å²	154.7	74%	0.738	76%	0.757	S	S	*	*			cis	93.6	139.3	20.8	-133.3	84	0	0	0	117.4
525	F	31.6	Very low	31.3	Very low	187 Å²	187	148.3 Å²	148.3	82%	0.82	75%	0.749	S	S	*	*			trans	87.4	138.3	-176	-66.4	-73	0	0	0	118.5
526	S	28.3	Very low	31.1	Very low	96 Å²	96	150.2 Å²	150.2	67%	0.671	76%	0.757	S	S	*	*				177.7	129.4	-74.1	-177.2	0	0	0	0	112.2
527	H	28.8	Very low	31	Very low	164 Å²	164	150.4 Å²	150.4	76%	0.759	76%	0.764	S	S	*	*			trans	71.4	156.2	152.8	-118.5	-79.9	0	0	0	122.1
528	K	32.2	Very low	30.7	Very low	179 Å²	179	144.8 Å²	144.8	78%	0.778	76%	0.758	S	S	*	*			trans	79	145.9	156.9	-71.5	-176.5	178.3	-177.4	0	118.9
529	D	27.3	Very low	30.5	Very low	113 Å²	113	147.3 Å²	147.3	60%	0.604	76%	0.763	S	S	*	*			cis	-171.9	172.6	-28.4	-133	-34.4	0	0	0	112.2
530	H	34.3	Very low	30.2	Very low	153 Å²	153	149.2 Å²	149.2	71%	0.708	77%	0.765	S	S	*	*			trans	58.5	118.6	157.6	-68.8	93.1	0	0	0	123.4
531	H	30.4	Very low	29.9	Very low	182 Å²	182	146.5 Å²	146.5	84%	0.843	76%	0.763	S	S	*	*			trans	-4	148.2	146.7	-63.6	-85	0	0	0	123.9
532	R	26.8	Very low	29.7	Very low	216 Å²	216	143.2 Å²	143.2	82%	0.815	76%	0.758	S	S	*	*				120.4	155.2	120.7	-136	-176.5	-178.8	164.2	0.4	118
533	N	31.6	Very low	29.5	Very low	120 Å²	120	142.6 Å²	142.6	64%	0.642	76%	0.764	S	S	*	*			trans	79.2	113.1	170.2	-53.6	-20.2	0	0	0	115.6
534	H	30.3	Very low	29.4	Very low	164 Å²	164	141.9 Å²	141.9	76%	0.759	77%	0.77	S	S	*	*				64.4	119.6	72.2	-60.1	-61.7	0	0	0	111.1
535	S	31.3	Very low	29.2	Very low	107 Å²	107	139.2 Å²	139.2	75%	0.748	76%	0.763	S	S	*	*				-164.9	149.6	55.1	-70.7	0	0	0	0	116.1
536	V	28	Very low	29	Very low	135 Å²	135	139.6 Å²	139.6	82%	0.818	77%	0.765	S	S	*	*			trans	41.8	113.6	134.9	-172.9	0	0	0	0	120.7
537	A	31.7	Very low	29.1	Very low	109 Å²	109	139.9 Å²	139.9	90%	0.901	77%	0.773	S	S	*	*			trans	-157.3	95.7	138	0	0	0	0	0	110
538	S	25.7	Very low	29.2	Very low	105 Å²	105	139.4 Å²	139.4	73%	0.734	77%	0.769	S	S	*	*			trans	-107.2	130.3	-176.6	56.2	0	0	0	0	112.6
539	L	30.1	Very low	29.3	Very low	183 Å²	183	138.5 Å²	138.5	96%	0.958	77%	0.773	S	S	*	*			trans	-137.3	148.5	147.2	-81.9	-176.6	0	0	0	110.1
540	N	24.3	Very low	29.5	Very low	156 Å²	156	138.7 Å²	138.7	83%	0.834	77%	0.77	S	S	*	*			trans	-126	-160.2	-174.3	-162.1	-9.1	0	0	0	107.6
541	V	29.5	Very low	29.3	Very low	127 Å²	127	140.6 Å²	140.6	77%	0.77	78%	0.776	S	S	*	*			trans	78	130.9	168.4	-174	0	0	0	0	114.5
542	S	28.9	Very low	29.2	Very low	89 Å²	89	139.4 Å²	139.4	62%	0.622	77%	0.771	S	S	*	*			cis	-162.8	158.5	-21.2	52.9	0	0	0	0	110.2
543	S	25.4	Very low	29.5	Very low	119 Å²	119	134.7 Å²	134.7	83%	0.832	76%	0.762	S	S	*	*			trans	-68.1	146.8	160.2	42.2	0	0	0	0	111.4
544	V	33.5	Very low	29.4	Very low	134 Å²	134	136.4 Å²	136.4	81%	0.812	77%	0.771	S	S	*	*			trans	-132.9	141.3	168.7	-179.4	0	0	0	0	108.3
545	S	24.2	Very low	29.5	Very low	85 Å²	85	132.1 Å²	132.1	59%	0.594	77%	0.771	S	S	*	*			trans	-139.4	176.9	179.1	56.2	0	0	0	0	109.6
546	F	26.4	Very low	29.6	Very low	195 Å²	195	134.2 Å²	134.2	86%	0.855	77%	0.773	S	S	*	*			trans	71.7	154	-171.6	-52.2	-77.3	0	0	0	112.7
547	A	31.5	Very low	29.7	Very low	103 Å²	103	137.1 Å²	137.1	85%	0.851	77%	0.774	S	S	*	*			cis	-114.1	-179.7	20.7	0	0	0	0	0	116.3
548	K	29.5	Very low	29.7	Very low	153 Å²	153	137.7 Å²	137.7	67%	0.665	77%	0.772	S	S	*	*			trans	-138.1	123.8	-163	176	-161.3	-174.3	-159.6	0	110.3	H550	K548-H550 WeakPolarHBondContact CE-NE2 3.37Å; K548-H550 PolarHBondContact NZ-NE2 3.45Å; K548-H550 VanDerWaalsContact NZ-NE2 3.15Å
549	N	34	Very low	29.8	Very low	160 Å²	160	139.2 Å²	139.2	86%	0.856	78%	0.776	S	S	*	*			trans	-145.8	111.2	164.3	-75	-42.5	0	0	0	105.6
550	H	31.3	Very low	30.1	Very low	118 Å²	118	135.5 Å²	135.5	55%	0.546	76%	0.763	S	S	.	*				68.6	144	60	-85.9	-73.4	0	0	0	115.7	K548	K548-H550 WeakPolarHBondContact CE-NE2 3.37Å; K548-H550 PolarHBondContact NZ-NE2 3.45Å; K548-H550 VanDerWaalsContact NZ-NE2 3.15Å
551	F	31.1	Very low	30.2	Very low	192 Å²	192	139.1 Å²	139.1	84%	0.842	77%	0.765	S	S	*	*			trans	69.4	102.3	-165.8	-54.6	-74.9	0	0	0	113.4
552	Q	28.4	Very low	30.2	Very low	158 Å²	158	141.1 Å²	141.1	74%	0.738	77%	0.766	S	S	*	*			cis	93.5	141.7	18	-147.7	-165.2	-43.8	0	0	115.5
553	N	32.1	Very low	30.2	Very low	117 Å²	117	143.5 Å²	143.5	63%	0.626	77%	0.77	S	S	*	*			trans	80.5	106.4	175.8	-65.6	17.8	0	0	0	119
554	D	31.3	Very low	30.5	Very low	156 Å²	156	144.7 Å²	144.7	83%	0.834	77%	0.773	S	S	*	*				52.5	142.7	119.1	-45.1	-37.7	0	0	0	122.6
555	G	32	Very low	30.2	Very low	74 Å²	74	143.5 Å²	143.5	76%	0.763	77%	0.77	S	S	*	*			trans	163.7	46.2	166.5	0	0	0	0	0	121.5
556	I	33.4	Very low	30.5	Very low	151 Å²	151	145 Å²	145	77%	0.774	78%	0.778	S	S	*	*			trans	28.4	113.8	147.3	-59.6	170.4	0	0	0	119.8
557	K	29.6	Very low	30.8	Very low	195 Å²	195	141.9 Å²	141.9	85%	0.848	78%	0.777	S	S	*	*			trans	33.9	121.1	139	-49.1	171.3	-172.7	172.6	0	120.3
558	S	32.7	Very low	30.5	Very low	122 Å²	122	143.2 Å²	143.2	85%	0.853	78%	0.775	S	S	*	*				-171.6	167.4	124.7	62.5	0	0	0	0	113.9
559	V	27.5	Very low	30.5	Very low	136 Å²	136	143.7 Å²	143.7	82%	0.824	78%	0.784	S	S	*	*			trans	-151.2	155.9	-173.4	164.1	0	0	0	0	105.5
560	P	35.1	Very low	30.4	Very low	105 Å²	105	142.2 Å²	142.2	68%	0.682	78%	0.781	S	S	*	*			cis	-134.2	-173.4	9.1	26.7	-0.6	0	0	0	116.8
561	R	26.9	Very low	30.1	Very low	232 Å²	232	147 Å²	147	88%	0.875	79%	0.794	S	S	*	*			trans	23.3	131	144.6	-61.6	172.3	-177.9	174.2	0.4	120.3
562	Q	30.2	Very low	29.9	Very low	170 Å²	170	146.1 Å²	146.1	79%	0.794	80%	0.798	S	S	*	*				-174.1	143.3	96.4	-100.9	-169.1	-6.3	0	0	115.6
563	I	27.8	Very low	29.9	Very low	138 Å²	138	145.8 Å²	145.8	71%	0.708	80%	0.8	S	S	*	*			trans	28.2	123.8	139.6	-53.3	165.7	0	0	0	120.3
564	T	32	Very low	29.8	Very low	145 Å²	145	145.8 Å²	145.8	89%	0.89	81%	0.809	S	S	*	*			trans	-161.7	159.5	133.5	5.9	0	0	0	0	111.4
565	S	26.8	Very low	29.8	Very low	108 Å²	108	147.5 Å²	147.5	76%	0.755	81%	0.809	S	S	*	*			trans	-118.6	160.9	-167.2	51.7	0	0	0	0	114.1
566	P	30.3	Very low	29.8	Very low	117 Å²	117	152 Å²	152	76%	0.76	82%	0.816	S	S	*	*			trans	-91.5	163.4	-168.9	36.7	-37.2	0	0	0	115.4
567	P	32.5	Very low	29.5	Very low	129 Å²	129	149.2 Å²	149.2	84%	0.838	81%	0.814	S	S	*	*			trans	-92.7	162.6	175.6	37	-35.1	0	0	0	114.3
568	T	25.8	Very low	29.4	Very low	132 Å²	132	144.8 Å²	144.8	81%	0.81	81%	0.808	S	S	*	*			trans	-134.9	130.5	-178.7	-53.5	0	0	0	0	111.4
569	L	30.1	Very low	29.2	Very low	163 Å²	163	146.5 Å²	146.5	85%	0.853	81%	0.808	S	S	*	*			trans	-141	113.7	164.4	-77.7	175.2	0	0	0	107.8
570	V	30.6	Very low	28.9	Very low	129 Å²	129	150.3 Å²	150.3	78%	0.782	81%	0.814	S	S	*	*				93.1	137.8	73.4	162.7	0	0	0	0	112
571	R	25.1	Very low	28.4	Very low	219 Å²	219	150.9 Å²	150.9	83%	0.826	82%	0.82	S	S	*	*			trans	-85.4	159	-169.8	-55.3	177.9	-176.2	116.1	-1.4	112.4
572	N	27.6	Very low	28.4	Very low	173 Å²	173	149 Å²	149	93%	0.925	82%	0.824	S	S	*	*			trans	-141	158.2	137.5	-103.3	-35.8	0	0	0	110.5
573	I	28.2	Very low	28.1	Very low	151 Å²	151	149.2 Å²	149.2	77%	0.774	83%	0.825	S	S	*	*			trans	-123.1	127.5	-173.1	-61.8	170.6	0	0	0	109.3
574	S	31.2	Very low	28.2	Very low	116 Å²	116	153.9 Å²	153.9	81%	0.811	83%	0.834	S	S	*	*			trans	-144.1	127.5	165.3	56.9	0	0	0	0	110.1
575	K	30.4	Very low	28.2	Very low	193 Å²	193	152.2 Å²	152.2	84%	0.839	83%	0.827	S	S	*	*			trans	-79.1	130.2	174.4	-59.1	174.3	-178.2	177.5	0	109.5
576	N	31.5	Very low	28.1	Very low	169 Å²	169	150.6 Å²	150.6	90%	0.904	83%	0.828	S	S	*	*			trans	-169.7	168.7	131.6	-100	-17	0	0	0	111.2
577	A	27.1	Very low	28.1	Very low	91 Å²	91	157.3 Å²	157.3	75%	0.752	84%	0.838	S	S	*	*			trans	-100.2	176.1	-161.5	0	0	0	0	0	114.9
578	S	27.7	Very low	27.7	Very low	103 Å²	103	158.1 Å²	158.1	72%	0.72	84%	0.841	S	S	*	*			trans	95.9	131.4	165.9	79.7	0	0	0	0	118.8
579	N	27.9	Very low	27.9	Very low	158 Å²	158	157.6 Å²	157.6	85%	0.845	84%	0.843	S	S	*	*			trans	70.5	113.5	152.5	-56.5	-17.5	0	0	0	120
580	F	22.8	Very low	27.6	Very low	216 Å²	216	155.9 Å²	155.9	95%	0.947	84%	0.839	S	S	*	*			trans	-67.1	136.5	167.1	-88.7	-111.6	0	0	0	112
581	S	24.1	Very low	27.5	Very low	117 Å²	117	156.7 Å²	156.7	82%	0.818	84%	0.838	S	S	*	*			trans	-155.4	141.6	134.5	69.6	0	0	0	0	109.8
582	M	26.1	Very low	27.7	Very low	192 Å²	192	156.4 Å²	156.4	95%	0.946	84%	0.837	S	S	*	*			trans	-153.6	117.4	165.8	-155.8	170.5	77	0	0	110.5
583	Q	25.7	Very low	27.7	Very low	175 Å²	175	155.3 Å²	155.3	82%	0.818	83%	0.831	S	S	*	*			trans	-81.5	159.2	171.2	-57.5	168.7	-57.6	0	0	110.6
584	R	28	Very low	27.9	Very low	236 Å²	236	154.2 Å²	154.2	89%	0.891	84%	0.837	S	S	*	*				-176.6	146	119.2	-100.8	163.3	-173	-129.2	-1	113.3
585	S	32.4	Very low	27.6	Very low	109 Å²	109	151.9 Å²	151.9	76%	0.762	83%	0.831	S	S	*	*			trans	29.9	122.9	154.3	56.9	0	0	0	0	119.4
586	G	26	Very low	27.5	Very low	74 Å²	74	152.3 Å²	152.3	76%	0.763	83%	0.833	S	S	*	*			cis	100.5	102.5	9.1	0	0	0	0	0	112.5
587	W	29.9	Very low	27.3	Very low	259 Å²	259	149.8 Å²	149.8	98%	0.981	82%	0.823	S	S	*	*			trans	-133.4	140.9	170.2	-88.5	56.5	0	0	0	108
588	T	24.3	Very low	27.2	Very low	145 Å²	145	154.4 Å²	154.4	89%	0.89	83%	0.83	S	S	*	*			trans	-136.4	140.1	-179.5	44.9	0	0	0	0	111
589	S	29.8	Very low	27.1	Very low	122 Å²	122	152.7 Å²	152.7	85%	0.853	83%	0.828	S	S	*	*			trans	-142.2	137.7	161.8	56.3	0	0	0	0	108.8
590	T	24	Very low	27.1	Very low	127 Å²	127	153.7 Å²	153.7	78%	0.779	83%	0.833	S	S	*	*			trans	-109.4	158.6	-175.8	48.8	0	0	0	0	110.7
591	I	28.7	Very low	27.2	Very low	146 Å²	146	152.3 Å²	152.3	75%	0.749	83%	0.829	S	S	*	*				177.1	112.5	129.8	-90.4	154	0	0	0	111.8
592	R	29.2	Very low	27.3	Very low	212 Å²	212	158 Å²	158	80%	0.8	83%	0.832	S	S	*	*			trans	51.8	98.4	141.2	-51.7	-179.5	-161.2	-159.7	3.7	122.1
593	D	27.6	Very low	27.3	Very low	150 Å²	150	154.3 Å²	154.3	80%	0.802	82%	0.823	S	S	*	*				49	108.6	110.8	-47.2	-40.4	0	0	0	122.1
594	S	31	Very low	27.3	Very low	129 Å²	129	152.4 Å²	152.4	90%	0.902	83%	0.827	S	S	*	*				153.2	137.5	122.3	53.3	0	0	0	0	111.1
595	G	25.9	Very low	27.1	Very low	67 Å²	67	148 Å²	148	69%	0.691	82%	0.82	S	S	*	*			cis	-169.8	175.5	-7.2	0	0	0	0	0	110.9
596	F	27.5	Very low	26.7	Very low	201 Å²	201	148.2 Å²	148.2	88%	0.882	82%	0.822	S	S	*	*			trans	68.1	120.8	-171	-74.3	-103.1	0	0	0	115.1
597	V	27.5	Very low	26.7	Very low	116 Å²	116	148 Å²	148	70%	0.703	82%	0.819	S	S	*	*				77	118.8	50.5	175.6	0	0	0	0	110.4
598	E	25.9	Very low	26.5	Very low	189 Å²	189	140.1 Å²	140.1	88%	0.883	80%	0.804	S	S	*	*			cis	-156.4	170.8	8.7	-135.1	169.3	174.1	0	0	111.5
599	G	25.3	Very low	26.6	Very low	67 Å²	67	143.3 Å²	143.3	69%	0.691	81%	0.805	S	S	*	*			trans	131.9	83	156.6	0	0	0	0	0	120.6
600	L	27.6	Very low	26.4	Very low	179 Å²	179	144.4 Å²	144.4	94%	0.937	80%	0.8	S	S	*	*			trans	59	112.7	148	-64.4	170.2	0	0	0	121.7
601	H	24.6	Very low	26.6	Very low	186 Å²	186	145.9 Å²	145.9	86%	0.861	80%	0.798	S	S	*	*			trans	-64.3	149.1	162.7	-81.4	-134.9	0	0	0	114.2
602	R	27.1	Very low	26.6	Very low	236 Å²	236	143.4 Å²	143.4	89%	0.891	79%	0.794	S	S	*	*			trans	-140.5	144.4	136.4	-78	-161.3	174.2	-161.2	-1.8	111
603	P	24.6	Very low	26.5	Very low	116 Å²	116	139.2 Å²	139.2	75%	0.753	79%	0.787	S	S	*	*			trans	-84.5	134.4	-178.2	32.8	-33.8	0	0	0	112.4	I605	P603-I605 PolarHBondContact O-N 3.25Å
604	C	26.1	Very low	26.5	Very low	134 Å²	134	141.4 Å²	141.4	91%	0.905	79%	0.79	S	S	*	*			trans	-81.7	112.4	168.6	-66.2	0	0	0	0	110.2	S606	C604-S606 PolarHBondContact O-N 3.15Å
605	I	25.1	Very low	26.3	Very low	143 Å²	143	140.4 Å²	140.4	73%	0.733	78%	0.783	S	S	*	*			trans	-71.1	126.8	174.7	-61.7	171.6	0	0	0	108.8	P603 G607	P603-I605 PolarHBondContact O-N 3.25Å; I605-G607 PolarHBondContact O-N 3.08Å; I605-G607 VanDerWaalsContact O-N 3.13Å
606	S	24	Very low	26.5	Very low	115 Å²	115	146.9 Å²	146.9	80%	0.804	79%	0.792	S	S	*	*			trans	-74.2	101.8	172.8	-170.9	0	0	0	0	109.7	C604 S608	C604-S606 PolarHBondContact O-N 3.15Å; S606-S608 PolarHBondContact O-N 3.14Å
607	G	24.7	Very low	26.6	Very low	68 Å²	68	142.3 Å²	142.3	70%	0.701	79%	0.786	S	S	*	*			trans	-76.8	100.7	174.5	0	0	0	0	0	110.9	I605 F609	I605-G607 PolarHBondContact O-N 3.08Å; I605-G607 VanDerWaalsContact O-N 3.13Å; G607-F609 PolarHBondContact O-N 3.07Å
608	S	26.5	Very low	26.7	Very low	95 Å²	95	141.6 Å²	141.6	66%	0.664	79%	0.786	S	S	*	*			trans	-69.9	127.2	172.8	47.9	0	0	0	0	110.9	S606 I610	S606-S608 PolarHBondContact O-N 3.14Å; S608-I610 PolarHBondContact O-N 3.07Å
609	F	26.2	Very low	26.9	Very low	211 Å²	211	141.2 Å²	141.2	93%	0.925	78%	0.784	S	S	*	*			trans	-68.6	105	166	-100.6	-92.8	0	0	0	108.7	G607 Q611	G607-F609 PolarHBondContact O-N 3.07Å; F609-Q611 PolarHBondContact O-N 3.26Å; F609-Q611 VanDerWaalsContact O-N 3.08Å
610	I	26	Very low	27	Very low	145 Å²	145	143.7 Å²	143.7	74%	0.744	79%	0.791	S	S	*	*			trans	-71.2	104.6	177.9	-62.5	177.2	0	0	0	108.6	S608 S612	S608-I610 PolarHBondContact O-N 3.07Å; I610-S612 PolarHBondContact O-N 3.49Å; I610-S612 VanDerWaalsContact O-N 3.14Å
611	Q	28.5	Very low	27.2	Very low	158 Å²	158	139.9 Å²	139.9	74%	0.738	78%	0.779	S	S	*	*			trans	-68.1	106.5	168.9	-167.9	173.7	16.2	0	0	108.7	F609 N613	F609-Q611 PolarHBondContact O-N 3.26Å; F609-Q611 VanDerWaalsContact O-N 3.08Å; Q611-N613 VanDerWaalsContact C-N 3.27Å; Q611-N613 PolarHBondContact O-N 2.85Å
612	S	26.9	Very low	27.5	Very low	95 Å²	95	138.5 Å²	138.5	66%	0.664	77%	0.773	S	S	*	*			trans	-75.6	69.8	-170.3	44.4	0	0	0	0	113.1	I610 F614	I610-S612 PolarHBondContact O-N 3.49Å; I610-S612 VanDerWaalsContact O-N 3.14Å; S612-F614 VanDerWaalsContact C-N 3.34Å; S612-F614 PolarHBondContact O-N 2.84Å
613	N	27.8	Very low	27.6	Very low	123 Å²	123	133.6 Å²	133.6	66%	0.658	76%	0.762	S	S	*	*			trans	-65.9	85.8	174.3	-72.5	-42.8	0	0	0	111.6	Q611 S615	Q611-N613 VanDerWaalsContact C-N 3.27Å; Q611-N613 PolarHBondContact O-N 2.85Å; N613-S615 PolarHBondContact O-N 3.16Å
614	F	26.8	Very low	27.9	Very low	196 Å²	196	134.2 Å²	134.2	86%	0.86	75%	0.754	S	S	*	*			trans	-72.3	67.5	171.3	-99.7	-74.7	0	0	0	112	S612 K616	S612-F614 VanDerWaalsContact C-N 3.34Å; S612-F614 PolarHBondContact O-N 2.84Å; F614-K616 PolarHBondContact O-N 3.31Å
615	S	27.4	Very low	28.1	Very low	109 Å²	109	137.3 Å²	137.3	76%	0.762	75%	0.748	S	S	*	*			trans	-79	97.4	169.7	-60.5	0	0	0	0	110.4	N613 S617	N613-S615 PolarHBondContact O-N 3.16Å; S615-S617 PolarHBondContact O-N 2.85Å
616	K	29.7	Very low	28.3	Very low	202 Å²	202	137.8 Å²	137.8	88%	0.878	75%	0.752	S	S	*	*			trans	-73	113.8	166.3	-83	-172.6	173.4	-177.8	0	110	F614	F614-K616 PolarHBondContact O-N 3.31Å
617	S	30.6	Very low	28.8	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	75%	0.746	S	S	*	*			trans	-80.4	124.5	172.8	52.3	0	0	0	0	111.7	S615	S615-S617 PolarHBondContact O-N 2.85Å
618	S	28.7	Very low	29	Very low	101 Å²	101	145.6 Å²	145.6	71%	0.706	76%	0.757	S	S	*	*			trans	9.4	131.9	146.2	56.3	0	0	0	0	120
619	E	30.2	Very low	29.1	Very low	180 Å²	180	145.2 Å²	145.2	84%	0.841	75%	0.754	S	S	*	*				-168.6	127.5	104.2	-106.1	175.7	170.4	0	0	113.6
620	S	29	Very low	29.2	Very low	119 Å²	119	141.6 Å²	141.6	83%	0.832	74%	0.744	S	S	*	*			trans	55.2	147.2	158.6	93.6	0	0	0	0	119.8
621	S	31.6	Very low	29.2	Very low	100 Å²	100	139.7 Å²	139.7	70%	0.699	74%	0.744	S	S	*	*			cis	-153.8	157.7	3	59.4	0	0	0	0	112.5
622	H	30.5	Very low	29.2	Very low	157 Å²	157	136.7 Å²	136.7	73%	0.727	74%	0.74	S	S	*	*			trans	63.4	116.6	145	-95	-107.1	0	0	0	123.4
623	M	29	Very low	29.2	Very low	133 Å²	133	142.6 Å²	142.6	66%	0.655	75%	0.748	S	S	*	*			trans	71.1	145.2	146.5	-41.2	-70	76.3	0	0	117.6
624	H	30.7	Very low	29.1	Very low	128 Å²	128	146.2 Å²	146.2	59%	0.593	76%	0.758	S	S	*	*			cis	-161.9	161.6	-15.8	-132.7	-73	0	0	0	110
625	Y	31	Very low	29	Very low	200 Å²	200	141.7 Å²	141.7	78%	0.784	76%	0.756	S	S	*	*			trans	60.4	109.2	169.1	-65.5	-71.9	0	0	0	116.8
626	N	28.4	Very low	28.9	Very low	152 Å²	152	141.7 Å²	141.7	81%	0.813	76%	0.757	S	S	*	*			cis	74.4	145.9	42.5	-129	26.2	0	0	0	112.8
627	P	34	Very low	28.9	Very low	106 Å²	106	137.7 Å²	137.7	69%	0.688	75%	0.749	S	S	*	*				-134.6	176.2	-119.7	38.7	-18.8	0	0	0	115.9
628	R	29.7	Very low	28.7	Very low	242 Å²	242	139.9 Å²	139.9	91%	0.913	75%	0.752	S	S	*	*			trans	160.3	166.3	161.3	-92.3	152.9	-175.9	-164.5	1.2	108.8
629	S	28.7	Very low	28.7	Very low	87 Å²	87	141.1 Å²	141.1	61%	0.608	76%	0.761	S	S	*	*			cis	-165.7	175	-38.4	61.4	0	0	0	0	108.8
630	D	28	Very low	28.5	Very low	135 Å²	135	137.3 Å²	137.3	72%	0.722	75%	0.754	S	S	*	*			trans	54	91.1	152	-49.4	-45.8	0	0	0	121.7
631	S	27.1	Very low	28.5	Very low	105 Å²	105	138.4 Å²	138.4	73%	0.734	75%	0.751	S	S	*	*				83	131.3	116.6	81.8	0	0	0	0	122.9
632	S	27.3	Very low	28.1	Very low	95 Å²	95	140 Å²	140	66%	0.664	75%	0.751	S	S	*	*			trans	95.9	141.2	135.5	91.4	0	0	0	0	121.1
633	R	27.1	Very low	27.9	Very low	219 Å²	219	141.2 Å²	141.2	83%	0.826	75%	0.749	S	S	*	*			trans	78.1	101.6	156.5	-59.3	176.4	-162.9	-133.2	-1.8	120.6
634	K	26.1	Very low	27.6	Very low	198 Å²	198	144.3 Å²	144.3	86%	0.861	75%	0.754	S	S	*	*				76.1	132.3	129.3	-67.1	-174.6	172	-172.8	0	120.6
635	A	24.8	Very low	27.2	Very low	101 Å²	101	149.3 Å²	149.3	84%	0.835	77%	0.769	S	S	*	*			trans	68.9	142.3	151.6	0	0	0	0	0	117.5
636	S	25.6	Very low	27	Very low	110 Å²	110	146 Å²	146	77%	0.769	77%	0.769	S	S	*	*			cis	-161.5	-146.8	-12.8	57.9	0	0	0	0	109.2
637	V	29.2	Very low	26.8	Very low	117 Å²	117	142.3 Å²	142.3	71%	0.709	77%	0.768	S	S	*	*			trans	86.8	96.8	168.5	-168	0	0	0	0	117.5
638	N	25.3	Very low	26.5	Very low	153 Å²	153	142.9 Å²	142.9	82%	0.818	77%	0.774	S	S	*	*			trans	42.3	119.6	137.8	-56	-8.5	0	0	0	121.1
639	S	29.9	Very low	26.3	Very low	126 Å²	126	136.2 Å²	136.2	88%	0.881	77%	0.765	S	S	*	*				-149.2	142.6	103	30.8	0	0	0	0	111.7
640	S	24.9	Very low	26.1	Very low	101 Å²	101	143.7 Å²	143.7	71%	0.706	78%	0.779	S	S	*	*			trans	-81.4	144.8	-170	49.2	0	0	0	0	114.1
641	N	28.9	Very low	26	Very low	142 Å²	142	145.5 Å²	145.5	76%	0.759	79%	0.788	S	S	*	*			trans	-163.2	106.1	139.2	-97.3	-35.4	0	0	0	110.8
642	L	23.1	Very low	25.9	Very low	133 Å²	133	145.1 Å²	145.1	70%	0.696	79%	0.791	S	S	*	*			trans	-88.4	124.9	168.2	-80.8	94.8	0	0	0	109.7
643	W	27.3	Very low	25.8	Very low	183 Å²	183	146.1 Å²	146.1	69%	0.693	80%	0.795	S	S	*	*			trans	-134	135.3	163.3	-70.3	90.1	0	0	0	111.1
644	W	22.9	Very low	25.7	Very low	198 Å²	198	141.3 Å²	141.3	75%	0.75	80%	0.795	S	S	*	*			trans	-84.3	147.1	-143.5	-58.2	83	0	0	0	116.2
645	Y	22.4	Very low	25.7	Very low	233 Å²	233	139.3 Å²	139.3	91%	0.914	79%	0.792	S	S	*	*			trans	-91.6	113.2	159.6	-131.2	-92.5	0	0	0	108.5
646	T	25.7	Very low	25.7	Very low	130 Å²	130	145.6 Å²	145.6	80%	0.798	80%	0.795	S	S	*	*			trans	-143.3	123.7	164.5	49.4	0	0	0	0	110.3
647	G	24.5	Very low	25.7	Very low	75 Å²	75	144.7 Å²	144.7	77%	0.773	79%	0.794	S	S	*	*			trans	167	33.7	-174.3	0	0	0	0	0	113.5	S649	G647-S649 PolarHBondContact O-N 3.12Å
648	S	28.7	Very low	25.6	Very low	117 Å²	117	144.6 Å²	144.6	82%	0.818	80%	0.798	S	S	*	*			trans	-67	131	-167.9	-55.4	0	0	0	0	113.6
649	S	24.1	Very low	25.6	Very low	103 Å²	103	146.9 Å²	146.9	72%	0.72	80%	0.795	S	S	*	*			trans	-34.9	134.2	146.8	35.8	0	0	0	0	114.4	G647	G647-S649 PolarHBondContact O-N 3.12Å
650	R	26	Very low	25.4	Very low	243 Å²	243	146.1 Å²	146.1	92%	0.917	79%	0.79	S	S	*	*				-179.9	157.2	128.4	-96.9	157.4	-163.6	-122.2	1.4	113
651	L	24.7	Very low	25.6	Very low	174 Å²	174	146.4 Å²	146.4	91%	0.911	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-60.3	132.6	173.6	-63.2	156.4	0	0	0	111
652	A	26	Very low	25.5	Very low	96 Å²	96	149.8 Å²	149.8	79%	0.793	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-93.9	125.6	163	0	0	0	0	0	109.1
653	P	25	Very low	25.8	Very low	116 Å²	116	149.6 Å²	149.6	75%	0.753	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-77.8	165	-178.4	32.3	-35.7	0	0	0	112.6	I655	P653-I655 PolarHBondContact O-N 3.06Å
654	S	24.5	Very low	25.8	Very low	118 Å²	118	145.5 Å²	145.5	83%	0.825	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-55	121.6	177	-178.8	0	0	0	0	112.8
655	I	27	Very low	26.1	Very low	156 Å²	156	141.8 Å²	141.8	80%	0.8	80%	0.797	S	S	*	*			trans	-122.7	115.1	157.1	-62.8	-176.9	0	0	0	107.9	P653 A657	P653-I655 PolarHBondContact O-N 3.06Å; I655-A657 PolarHBondContact O-N 2.95Å
656	R	23.9	Very low	26.4	Very low	233 Å²	233	137.5 Å²	137.5	88%	0.879	79%	0.79	S	S	*	*			trans	-70	93.6	176.9	176.5	-170.6	-80.8	178.6	-7	109.7
657	A	26.6	Very low	26.8	Very low	92 Å²	92	138.5 Å²	138.5	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-86.9	137.1	164.9	0	0	0	0	0	110.4	I655	I655-A657 PolarHBondContact O-N 2.95Å
658	S	26	Very low	27.2	Very low	114 Å²	114	140.3 Å²	140.3	80%	0.797	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-75.6	150.5	-166.3	-58.5	0	0	0	0	114.6	S660	S658-S660 PolarHBondContact O-N 3.35Å
659	R	25	Very low	27.4	Very low	201 Å²	201	141.6 Å²	141.6	76%	0.758	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-53.1	128	166.6	-84.7	172.2	155.7	-177.1	6	111.6	Q661	R659-Q661 HydrophobicContact CB-CG 4.23Å; R659-Q661 VanDerWaalsContact CD-OE1 3.3Å; R659-Q661 HydrophobicContact CG-CG 4.39Å; R659-Q661 VanDerWaalsContact NH1-CD 3.34Å; R659-Q661 PolarHBondContact O-N 3.33Å
660	S	26.8	Very low	27.9	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	78%	0.783	S	S	*	*			trans	-89.9	75.1	153.9	44	0	0	0	0	109.9	S658 F662	S658-S660 PolarHBondContact O-N 3.35Å; S660-F662 PolarHBondContact O-N 3.26Å
661	Q	28.8	Very low	28.3	Very low	108 Å²	108	136.1 Å²	136.1	51%	0.505	77%	0.772	S	S	.	*			trans	-74.8	106.5	171.8	-86.1	-176.5	-80	0	0	110.4	R659 I663	R659-Q661 HydrophobicContact CB-CG 4.23Å; R659-Q661 VanDerWaalsContact CD-OE1 3.3Å; R659-Q661 HydrophobicContact CG-CG 4.39Å; R659-Q661 VanDerWaalsContact NH1-CD 3.34Å; R659-Q661 PolarHBondContact O-N 3.33Å; Q661-I663 HydrophobicContact CB-CD1 4.46Å; Q661-I663 HydrophobicContact CB-CG1 4.4Å; Q661-I663 PolarHBondContact O-N 2.85Å
662	F	25.7	Very low	28.8	Very low	212 Å²	212	135.8 Å²	135.8	93%	0.93	76%	0.763	S	S	*	*			trans	-68.8	95.6	157.8	-84.3	-89.2	0	0	0	108.9	S660	S660-F662 PolarHBondContact O-N 3.26Å
663	I	30.5	Very low	29	Very low	129 Å²	129	137.9 Å²	137.9	66%	0.662	76%	0.757	S	S	*	*			trans	-118.8	117.8	163.1	-67.7	174.8	0	0	0	106.5	Q661	Q661-I663 HydrophobicContact CB-CD1 4.46Å; Q661-I663 HydrophobicContact CB-CG1 4.4Å; Q661-I663 PolarHBondContact O-N 2.85Å
664	A	26.1	Very low	29.5	Very low	97 Å²	97	140.9 Å²	140.9	80%	0.802	75%	0.754	S	S	*	*			trans	-85.5	127.4	169.8	0	0	0	0	0	109.6
665	S	30	Very low	30.5	Very low	121 Å²	121	147.7 Å²	147.7	85%	0.846	77%	0.773	S	S	*	*			trans	-169.1	148.6	140.4	-109.7	0	0	0	0	111.5
666	N	29.7	Very low	30.7	Very low	143 Å²	143	147.3 Å²	147.3	77%	0.765	77%	0.771	S	S	*	*			trans	-78.4	170.9	-171.7	-60.3	-33	0	0	0	113.3
667	N	33.8	Very low	31	Very low	150 Å²	150	142.8 Å²	142.8	80%	0.802	77%	0.766	S	S	*	*			trans	74	140.8	157.7	-58.4	-19.3	0	0	0	117
668	V	31.5	Very low	31.3	Very low	113 Å²	113	145.6 Å²	145.6	69%	0.685	77%	0.766	S	S	*	*			cis	167.6	144.2	-23.5	132.6	0	0	0	0	104
669	N	34	Very low	31.6	Very low	145 Å²	145	147.5 Å²	147.5	78%	0.775	76%	0.764	S	S	*	*			trans	74.4	115.1	164.7	-75.6	-6.5	0	0	0	121.5
670	V	35.3	Very low	32	Very low	117 Å²	117	144.1 Å²	144.1	71%	0.709	76%	0.764	S	S	*	*				105	90.8	114.6	169.9	0	0	0	0	119.8
671	V	33.3	Very low	32.3	Very low	113 Å²	113	146.4 Å²	146.4	69%	0.685	76%	0.764	S	S	*	*				81.8	130.5	117.1	170.5	0	0	0	0	121.5
672	K	35.8	Very low	32.6	Very low	168 Å²	168	149.1 Å²	149.1	73%	0.73	78%	0.783	S	S	*	*			trans	73.9	108.3	157.2	-81.2	164.1	-168.9	-178.3	0	120.8
673	E	29.7	Very low	33.1	Very low	140 Å²	140	144.3 Å²	144.3	65%	0.654	77%	0.771	S	S	*	*				17.6	134.7	107.6	-54.5	175.4	139.2	0	0	117.9
674	Y	35.3	Very low	33.4	Very low	179 Å²	179	145.6 Å²	145.6	70%	0.702	78%	0.78	S	S	*	*				173.9	101.7	96.2	-94.6	-71.9	0	0	0	111
675	H	45.9	Very low	34	Very low	261 Å²	261	150 Å²	150	100%	1.208	78%	0.778	S	S	*	*				-171.8	0	123.6	-113.1	-62.7	0	0	0	113

Retrieved 675 of 675 residues in 320.1 ms (Link to these results)

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