A0A077ZCB7_TRITR Loading...

SH2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZCB7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 537 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	20.9	Very low	34.5	Very low	241 Å²	241	67.9 Å²	67.9	100%	1.187	35%	0.352	S	S	*	.				0	119.4	0	-73.8	-178.8	-169	0	0	106.8
2	N	30.8	Very low	36.2	Very low	148 Å²	148	63.7 Å²	63.7	79%	0.791	33%	0.332	S	S	*	.			trans	47.2	72.5	-175.5	-64.7	-5.3	0	0	0	113.8	P4	N2-P4 VanDerWaalsContact O-CD 3.3Å; N2-P4 WeakPolarHBondContact O-CD 3.4Å
3	D	27	Very low	38.1	Very low	98 Å²	98	60.2 Å²	60.2	52%	0.524	31%	0.313	S	S	.	.			trans	-60.4	116.5	171.1	-163.9	-10.2	0	0	0	108.8	L5 V6	D3-L5 PolarHBondContact O-N 3Å; D3-V6 HydrophobicContact CB-CG2 3.68Å; D3-V6 VanDerWaalsContact O-CG2 3.28Å; D3-V6 WeakPolarHBondContact O-CG2 3.33Å; D3-V6 PolarHBondContact O-N 3.23Å
4	P	32.2	Very low	40.4	Very low	57 Å²	57	56.1 Å²	56.1	37%	0.37	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-63	-42	-163.8	-24	34.1	0	0	0	112.2	N2 V6 P135 Y137	N2-P4 VanDerWaalsContact O-CD 3.3Å; N2-P4 WeakPolarHBondContact O-CD 3.4Å; P4-V6 PolarHBondContact O-N 2.97Å; P4-P135 HydrophobicContact CB-CG 4.39Å; P4-Y137 VanDerWaalsContact C-CZ 3.47Å; P4-Y137 WeakPolarHBondContact CA-OH 3.5Å; P4-Y137 HydrophobicContact CB-CE2 3.73Å; P4-Y137 WeakPolarHBondContact CB-OH 3.37Å; P4-Y137 WeakPolarHBondContact O-CE2 3.28Å; P4-Y137 PolarHBondContact O-OH 3.05Å
5	L	28.8	Very low	42.7	Very low	53 Å²	53	53.1 Å²	53.1	28%	0.277	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-64.1	-9.3	-174	-89.2	151.1	0	0	0	115.4	D3 A7 A16 Y137	D3-L5 PolarHBondContact O-N 3Å; L5-A7 VanDerWaalsContact C-N 3.26Å; L5-A7 PolarHBondContact O-N 3.28Å; L5-A16 HydrophobicContact CB-CB 3.43Å; L5-A16 VanDerWaalsContact CB-CB 3.43Å; L5-A16 HydrophobicContact CD1-CB 3.85Å; L5-A16 HydrophobicContact CD2-CB 3.61Å; L5-A16 HydrophobicContact CG-CB 3.79Å; L5-Y137 PolarHBondContact N-OH 2.85Å
6	V	33.3	Very low	44.5	Very low	37 Å²	37	50.2 Å²	50.2	22%	0.224	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-78.9	0.8	-173	-159.2	0	0	0	0	113.8	D3 P4 R295	D3-V6 HydrophobicContact CB-CG2 3.68Å; D3-V6 VanDerWaalsContact O-CG2 3.28Å; D3-V6 WeakPolarHBondContact O-CG2 3.33Å; D3-V6 PolarHBondContact O-N 3.23Å; P4-V6 PolarHBondContact O-N 2.97Å; V6-R295 VanDerWaalsContact O-CZ 3.26Å; V6-R295 PolarHBondContact O-NE 2.91Å; V6-R295 PolarHBondContact O-NH2 2.83Å
7	A	30.8	Very low	46	Very low	6 Å²	6	48.4 Å²	48.4	5%	0.05	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-87.1	-15.3	-178.6	0	0	0	0	0	115.1	L5 Y137 I142	L5-A7 VanDerWaalsContact C-N 3.26Å; L5-A7 PolarHBondContact O-N 3.28Å; A7-Y137 HydrophobicContact CB-CD2 3.86Å; A7-Y137 HydrophobicContact CB-CE2 4.31Å; A7-Y137 HydrophobicContact CB-CG 4.38Å; A7-I142 HydrophobicContact CB-CG1 4.24Å
8	A	36.9	Very low	47.7	Very low	10 Å²	10	45.9 Å²	45.9	8%	0.083	24%	0.244	C	C	.	.	S	Bend	trans	-114	141.7	-170.8	0	0	0	0	0	112	T12 P37	A8-T12 HydrophobicContact CB-CG2 3.48Å; A8-T12 VanDerWaalsContact CB-CG2 3.48Å; A8-T12 WeakPolarHBondContact O-CB 3.13Å; A8-P37 HydrophobicContact CB-CB 4.23Å; A8-P37 HydrophobicContact CB-CG 3.55Å
9	R	48.6	Very low	49.2	Very low	56 Å²	56	45 Å²	45	21%	0.211	24%	0.237	C	C	.	.			trans	10.7	133.9	162.5	-52.7	171.4	-179.7	-174.4	0.4	115.6	L11 T12 E13 Y35 Q239 H516	R9-L11 CarbonylContact O-C 3.54Å; R9-L11 PolarHBondContact O-N 3.4Å; R9-T12 WeakPolarHBondContact O-CA 3.12Å; R9-T12 WeakPolarHBondContact O-CB 3.39Å; R9-T12 PolarHBondContact O-N 2.62Å; R9-T12 PolarHBondContact O-OG1 2.95Å; R9-E13 PolarHBondContact O-N 3.07Å; R9-Y35 VanDerWaalsContact NH2-CD1 3.25Å; R9-Q239 HydrophobicContact CB-CG 4.33Å; R9-Q239 HydrophobicContact CG-CG 4.48Å; R9-H516 PolarHBondContact NH1-O 3.08Å
10	W	40.7	Very low	50.2	Low	39 Å²	39	47.8 Å²	47.8	15%	0.148	25%	0.252	C	S	.	.	H	α-helix	trans	-27.7	-51.2	173.3	176	65.2	0	0	0	116.8	T12 E13 L14 R237 C302	W10-T12 VanDerWaalsContact C-N 3.33Å; W10-E13 PolarHBondContact O-N 2.87Å; W10-L14 PolarHBondContact O-N 3.16Å; W10-R237 PolarHBondContact N-O 3.45Å; W10-C302 VanDerWaalsContact CD1-O 3.25Å; W10-C302 PolarHBondContact NE1-O 2.88Å
11	L	50	Low	51.2	Low	2 Å²	2	50.2 Å²	50.2	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-69	-32.4	-179.1	-123.8	151.5	0	0	0	112.2	R9 L14 V15 V422 V514 V515 Q517	R9-L11 CarbonylContact O-C 3.54Å; R9-L11 PolarHBondContact O-N 3.4Å; L11-L14 PolarHBondContact O-N 2.82Å; L11-V15 HydrophobicContact CD2-CG2 4.35Å; L11-V15 WeakPolarHBondContact O-CB 3.43Å; L11-V15 WeakPolarHBondContact O-CG2 3.28Å; L11-V15 PolarHBondContact O-N 3.27Å; L11-V422 HydrophobicContact CD2-CB 3.94Å; L11-V422 HydrophobicContact CD2-CG1 3.28Å; L11-V422 HydrophobicContact CG-CG1 4.34Å; L11-V514 WeakPolarHBondContact CD1-O 3.44Å; L11-V515 VanDerWaalsContact CB-O 3.26Å; L11-V515 WeakPolarHBondContact CB-O 3.46Å; L11-V515 HydrophobicContact CD2-CB 4.07Å; L11-V515 HydrophobicContact CD2-CG1 3.98Å; L11-V515 HydrophobicContact CD2-CG2 3.99Å; L11-Q517 HydrophobicContact CD1-CG 4.02Å
12	T	54.4	Low	53.8	Low	17 Å²	17	44.6 Å²	44.6	10%	0.104	23%	0.229	C	C	.	.	H	α-helix	trans	-65.1	-30.1	169	-40.2	0	0	0	0	113.6	A8 R9 W10 V15 A16	A8-T12 HydrophobicContact CB-CG2 3.48Å; A8-T12 VanDerWaalsContact CB-CG2 3.48Å; A8-T12 WeakPolarHBondContact O-CB 3.13Å; R9-T12 WeakPolarHBondContact O-CA 3.12Å; R9-T12 WeakPolarHBondContact O-CB 3.39Å; R9-T12 PolarHBondContact O-N 2.62Å; R9-T12 PolarHBondContact O-OG1 2.95Å; W10-T12 VanDerWaalsContact C-N 3.33Å; T12-V15 CarbonylContact O-C 3.57Å; T12-A16 WeakPolarHBondContact O-CA 3.45Å; T12-A16 WeakPolarHBondContact O-CB 3.19Å; T12-A16 PolarHBondContact O-N 2.95Å
13	E	61.4	Low	55.8	Low	18 Å²	18	40 Å²	40	8%	0.084	21%	0.207	C	C	.	.	H	α-helix	trans	-75	-37.9	173.5	-72	179.6	172.7	0	0	111.8	R9 W10 A16 A17 R237 R298	R9-E13 PolarHBondContact O-N 3.07Å; W10-E13 PolarHBondContact O-N 2.87Å; E13-A16 WeakPolarHBondContact O-CB 3.33Å; E13-A16 PolarHBondContact O-N 2.83Å; E13-A17 WeakPolarHBondContact O-CB 3.44Å; E13-A17 PolarHBondContact O-N 2.91Å; E13-R237 IonicContact OE1-CZ 3.09Å; E13-R237 IonicContact OE1-NE 3.68Å; E13-R237 IonicContact OE1-NH2 2.72Å; E13-R237 PolarHBondContact OE1-NH2 3.39Å; E13-R237 IonicContact OE2-NH2 2.66Å; E13-R298 IonicContact OE1-NH1 2.8Å; E13-R298 WeakPolarHBondContact OE2-CD 3.25Å; E13-R298 IonicContact OE2-CZ 2.79Å; E13-R298 IonicContact OE2-NE 3.67Å; E13-R298 IonicContact OE2-NH1 3.91Å; E13-R298 PolarHBondContact OE2-NH1 3.2Å
14	L	70.6	Confident	57.9	Low	4 Å²	4	41.3 Å²	41.3	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-48.9	168.5	172.5	62.3	0	0	0	110.1	W10 L11 A16 A17 L18 V414 L418 V422	W10-L14 PolarHBondContact O-N 3.16Å; L11-L14 PolarHBondContact O-N 2.82Å; L14-A16 VanDerWaalsContact C-N 3.29Å; L14-A16 PolarHBondContact O-N 3.14Å; L14-A17 PolarHBondContact O-N 2.68Å; L14-L18 HydrophobicContact CD1-CD1 4.23Å; L14-L18 HydrophobicContact CD1-CG 4.22Å; L14-L18 HydrophobicContact CG-CD1 4Å; L14-L18 HydrophobicContact CG-CG 4.42Å; L14-L18 WeakPolarHBondContact O-CB 3.06Å; L14-L18 WeakPolarHBondContact O-CG 3.05Å; L14-L18 PolarHBondContact O-N 2.84Å; L14-V414 HydrophobicContact CD1-CG1 3.51Å; L14-L418 HydrophobicContact CD2-CB 3.82Å; L14-V422 HydrophobicContact CD2-CG1 4.01Å; L14-V422 HydrophobicContact CD2-CG2 4.38Å
15	V	74.2	Confident	60.2	Low	10 Å²	10	39.6 Å²	39.6	6%	0.061	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-37.6	177.3	163.6	0	0	0	0	111.7	L11 T12 L18 Y19 L28 V515	L11-V15 HydrophobicContact CD2-CG2 4.35Å; L11-V15 WeakPolarHBondContact O-CB 3.43Å; L11-V15 WeakPolarHBondContact O-CG2 3.28Å; L11-V15 PolarHBondContact O-N 3.27Å; T12-V15 CarbonylContact O-C 3.57Å; V15-L18 CarbonylContact O-C 3.55Å; V15-L18 WeakPolarHBondContact O-CB 3.42Å; V15-L18 PolarHBondContact O-N 2.61Å; V15-Y19 HydrophobicContact CG1-CD2 3.6Å; V15-Y19 HydrophobicContact CG1-CE2 3.2Å; V15-Y19 WeakPolarHBondContact O-CD2 2.99Å; V15-Y19 PolarHBondContact O-N 3.21Å; V15-L28 HydrophobicContact CG1-CD1 4.12Å; V15-L28 HydrophobicContact CG2-CD2 4.12Å; V15-V515 HydrophobicContact CG2-CG1 3.85Å
16	A	71.2	Confident	62.6	Low	7 Å²	7	44 Å²	44	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-58.7	-55	172.7	0	0	0	0	0	110.6	L5 T12 E13 L14 L18 Y19 D20	L5-A16 HydrophobicContact CB-CB 3.43Å; L5-A16 VanDerWaalsContact CB-CB 3.43Å; L5-A16 HydrophobicContact CD1-CB 3.85Å; L5-A16 HydrophobicContact CD2-CB 3.61Å; L5-A16 HydrophobicContact CG-CB 3.79Å; T12-A16 WeakPolarHBondContact O-CA 3.45Å; T12-A16 WeakPolarHBondContact O-CB 3.19Å; T12-A16 PolarHBondContact O-N 2.95Å; E13-A16 WeakPolarHBondContact O-CB 3.33Å; E13-A16 PolarHBondContact O-N 2.83Å; L14-A16 VanDerWaalsContact C-N 3.29Å; L14-A16 PolarHBondContact O-N 3.14Å; A16-L18 PolarHBondContact O-N 2.93Å; A16-Y19 CarbonylContact O-C 3.58Å; A16-Y19 WeakPolarHBondContact O-CA 2.97Å; A16-Y19 WeakPolarHBondContact O-CB 3.22Å; A16-Y19 PolarHBondContact O-N 3.36Å; A16-D20 VanDerWaalsContact O-CG 3.28Å; A16-D20 PolarHBondContact O-N 2.74Å
17	A	69.9	Low	65.2	Low	20 Å²	20	44.6 Å²	44.6	17%	0.165	22%	0.222	C	C	.	.	H	α-helix	trans	-62.6	-31.9	178.8	0	0	0	0	0	112	E13 L14 K21 V414	E13-A17 WeakPolarHBondContact O-CB 3.44Å; E13-A17 PolarHBondContact O-N 2.91Å; L14-A17 PolarHBondContact O-N 2.68Å; A17-K21 WeakPolarHBondContact O-CG 2.9Å; A17-K21 PolarHBondContact O-N 3.47Å; A17-K21 VanDerWaalsContact O-N 3.16Å; A17-V414 HydrophobicContact CB-CG2 3.84Å
18	L	77.1	Confident	67.9	Low	4 Å²	4	44.8 Å²	44.8	2%	0.021	22%	0.222	C	C	.	.	H	α-helix	trans	-67.2	-37	173.1	-74.7	174.5	0	0	0	112.1	L14 V15 A16 K22 R25 L28 L416 A419 V422 L423	L14-L18 HydrophobicContact CD1-CD1 4.23Å; L14-L18 HydrophobicContact CD1-CG 4.22Å; L14-L18 HydrophobicContact CG-CD1 4Å; L14-L18 HydrophobicContact CG-CG 4.42Å; L14-L18 WeakPolarHBondContact O-CB 3.06Å; L14-L18 WeakPolarHBondContact O-CG 3.05Å; L14-L18 PolarHBondContact O-N 2.84Å; V15-L18 CarbonylContact O-C 3.55Å; V15-L18 WeakPolarHBondContact O-CB 3.42Å; V15-L18 PolarHBondContact O-N 2.61Å; A16-L18 PolarHBondContact O-N 2.93Å; L18-K22 PolarHBondContact O-N 2.8Å; L18-R25 VanDerWaalsContact CB-NH1 3.29Å; L18-R25 VanDerWaalsContact CD2-NH1 3.28Å; L18-R25 WeakPolarHBondContact O-CD 3.32Å; L18-R25 PolarHBondContact O-NH1 2.57Å; L18-L28 HydrophobicContact CB-CD1 4.41Å; L18-L28 HydrophobicContact CD1-CD2 4.39Å; L18-L416 HydrophobicContact CD2-CD2 3.83Å; L18-A419 HydrophobicContact CD1-CB 3.95Å; L18-A419 HydrophobicContact CD2-CB 3.94Å; L18-V422 HydrophobicContact CD1-CG2 3.68Å; L18-L423 HydrophobicContact CD1-CD2 4.29Å
19	Y	75.5	Confident	70.5	Confident	28 Å²	28	44.4 Å²	44.4	11%	0.11	22%	0.219	C	C	.	.	H	α-helix	trans	-73.2	-43.1	172.7	-75.3	-54.7	0	0	0	112.1	V15 A16 K21 K22 P23 R25 L28 R113	V15-Y19 HydrophobicContact CG1-CD2 3.6Å; V15-Y19 HydrophobicContact CG1-CE2 3.2Å; V15-Y19 WeakPolarHBondContact O-CD2 2.99Å; V15-Y19 PolarHBondContact O-N 3.21Å; A16-Y19 CarbonylContact O-C 3.58Å; A16-Y19 WeakPolarHBondContact O-CA 2.97Å; A16-Y19 WeakPolarHBondContact O-CB 3.22Å; A16-Y19 PolarHBondContact O-N 3.36Å; Y19-K21 PolarHBondContact O-N 2.82Å; Y19-K22 CarbonylContact O-C 3.6Å; Y19-K22 PolarHBondContact O-N 2.67Å; Y19-P23 WeakPolarHBondContact O-CA 3.44Å; Y19-P23 WeakPolarHBondContact O-CD 3.22Å; Y19-P23 VanDerWaalsContact O-CG 3.22Å; Y19-P23 WeakPolarHBondContact O-CG 3.4Å; Y19-R25 HydrophobicContact CD1-CG 3.85Å; Y19-R25 HydrophobicContact CE1-CG 3.77Å; Y19-L28 HydrophobicContact CD1-CD1 4.18Å; Y19-L28 HydrophobicContact CD2-CD1 4.39Å; Y19-L28 HydrophobicContact CE1-CD1 3.57Å; Y19-L28 HydrophobicContact CE2-CD1 3.84Å; Y19-L28 WeakPolarHBondContact OH-CB 3.47Å; Y19-L28 WeakPolarHBondContact OH-CD1 3.38Å; Y19-R113 PolarHBondContact OH-NH2 2.99Å
20	D	70.2	Confident	72.5	Confident	100 Å²	100	42.1 Å²	42.1	54%	0.535	21%	0.212	S	C	.	.	H	α-helix	trans	-56.5	-38.1	177.9	-67	-23.8	0	0	0	111	A16	A16-D20 VanDerWaalsContact O-CG 3.28Å; A16-D20 PolarHBondContact O-N 2.74Å
21	K	71.8	Confident	74.8	Confident	100 Å²	100	40.6 Å²	40.6	44%	0.435	21%	0.207	S	C	.	.	H	α-helix	trans	-73	-38.5	175	-73.5	-174.3	177.9	-168.7	0	113.9	A17 Y19	A17-K21 WeakPolarHBondContact O-CG 2.9Å; A17-K21 PolarHBondContact O-N 3.47Å; A17-K21 VanDerWaalsContact O-N 3.16Å; Y19-K21 PolarHBondContact O-N 2.82Å
22	K	75.6	Confident	76.9	Confident	123 Å²	123	40.5 Å²	40.5	54%	0.535	21%	0.206	S	C	.	.			trans	-146	87.9	-179.1	-169	-179.8	177.8	-176.8	0	110.1	L18 Y19 Q24 R25	L18-K22 PolarHBondContact O-N 2.8Å; Y19-K22 CarbonylContact O-C 3.6Å; Y19-K22 PolarHBondContact O-N 2.67Å; K22-Q24 VanDerWaalsContact C-N 3.33Å; K22-Q24 PolarHBondContact O-N 2.65Å; K22-R25 HydrophobicContact CB-CB 4.19Å; K22-R25 HydrophobicContact CD-CB 3.95Å; K22-R25 HydrophobicContact CG-CB 3.96Å; K22-R25 VanDerWaalsContact O-CB 3.26Å; K22-R25 WeakPolarHBondContact O-CB 3.43Å; K22-R25 WeakPolarHBondContact O-CD 3.25Å; K22-R25 VanDerWaalsContact O-CG 3.23Å; K22-R25 WeakPolarHBondContact O-CG 3.44Å; K22-R25 PolarHBondContact O-N 2.82Å
23	P	70.9	Confident	78.7	Confident	51 Å²	51	39.8 Å²	39.8	33%	0.331	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-28.8	-172.6	-25.9	34.5	0	0	0	114.6	Y19 R25 F117	Y19-P23 WeakPolarHBondContact O-CA 3.44Å; Y19-P23 WeakPolarHBondContact O-CD 3.22Å; Y19-P23 VanDerWaalsContact O-CG 3.22Å; Y19-P23 WeakPolarHBondContact O-CG 3.4Å; P23-R25 PolarHBondContact O-N 2.95Å; P23-F117 HydrophobicContact CB-CD2 3.2Å; P23-F117 HydrophobicContact CB-CE2 3.29Å; P23-F117 HydrophobicContact CB-CG 4.19Å; P23-F117 HydrophobicContact CB-CZ 4.35Å; P23-F117 HydrophobicContact CG-CD2 4.06Å; P23-F117 HydrophobicContact CG-CE2 3.74Å
24	Q	72	Confident	79.9	Confident	126 Å²	126	40.5 Å²	40.5	59%	0.589	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	23.2	176.3	-65	-169.9	-32.2	0	0	113.5	K22 N26 F117	K22-Q24 VanDerWaalsContact C-N 3.33Å; K22-Q24 PolarHBondContact O-N 2.65Å; Q24-N26 PolarHBondContact O-N 2.77Å; Q24-N26 PolarHBondContact O-OD1 2.92Å; Q24-F117 HydrophobicContact CG-CD1 3.44Å; Q24-F117 VanDerWaalsContact CG-CD1 3.44Å; Q24-F117 HydrophobicContact CG-CE1 3.14Å; Q24-F117 HydrophobicContact CG-CE2 4.25Å; Q24-F117 HydrophobicContact CG-CG 4.14Å; Q24-F117 HydrophobicContact CG-CZ 3.55Å
25	R	80.7	Confident	80.7	Confident	21 Å²	21	42.3 Å²	42.3	8%	0.079	21%	0.212	C	C	.	.			trans	-74.2	130	-179.5	74.3	-172.7	-61	149.3	9.5	110.1	L18 Y19 K22 P23 D27 L28	L18-R25 VanDerWaalsContact CB-NH1 3.29Å; L18-R25 VanDerWaalsContact CD2-NH1 3.28Å; L18-R25 WeakPolarHBondContact O-CD 3.32Å; L18-R25 PolarHBondContact O-NH1 2.57Å; Y19-R25 HydrophobicContact CD1-CG 3.85Å; Y19-R25 HydrophobicContact CE1-CG 3.77Å; K22-R25 HydrophobicContact CB-CB 4.19Å; K22-R25 HydrophobicContact CD-CB 3.95Å; K22-R25 HydrophobicContact CG-CB 3.96Å; K22-R25 VanDerWaalsContact O-CB 3.26Å; K22-R25 WeakPolarHBondContact O-CB 3.43Å; K22-R25 WeakPolarHBondContact O-CD 3.25Å; K22-R25 VanDerWaalsContact O-CG 3.23Å; K22-R25 WeakPolarHBondContact O-CG 3.44Å; K22-R25 PolarHBondContact O-N 2.82Å; P23-R25 PolarHBondContact O-N 2.95Å; R25-D27 VanDerWaalsContact CB-OD1 3.25Å; R25-D27 WeakPolarHBondContact CB-OD1 3.44Å; R25-D27 WeakPolarHBondContact CG-OD1 3.46Å; R25-D27 IonicContact CZ-OD1 2.73Å; R25-D27 IonicContact CZ-OD2 3.52Å; R25-D27 IonicContact NE-OD1 3.88Å; R25-D27 PolarHBondContact NE-OD1 3.26Å; R25-D27 IonicContact NE-OD2 3.45Å; R25-D27 IonicContact NH2-OD1 2.62Å; R25-D27 PolarHBondContact NH2-OD1 2.87Å; R25-D27 IonicContact NH2-OD2 3.03Å; R25-D27 PolarHBondContact NH2-OD2 3.37Å; R25-L28 HydrophobicContact CG-CD1 3.99Å; R25-L28 HydrophobicContact CG-CG 4.46Å
26	N	79.9	Confident	81.4	Confident	144 Å²	144	42 Å²	42	77%	0.77	21%	0.21	S	C	*	.			trans	-107.2	10.6	178.3	-61.5	-17.8	0	0	0	111.8	Q24 L28	Q24-N26 PolarHBondContact O-N 2.77Å; Q24-N26 PolarHBondContact O-OD1 2.92Å; N26-L28 VanDerWaalsContact C-N 3.33Å
27	D	86.7	Confident	82.1	Confident	50 Å²	50	42.7 Å²	42.7	27%	0.267	21%	0.214	S	C	.	.	S	Bend	trans	-96.5	17.2	179.6	64.1	-13.9	0	0	0	111.9	R25 L423 L424	R25-D27 VanDerWaalsContact CB-OD1 3.25Å; R25-D27 WeakPolarHBondContact CB-OD1 3.44Å; R25-D27 WeakPolarHBondContact CG-OD1 3.46Å; R25-D27 IonicContact CZ-OD1 2.73Å; R25-D27 IonicContact CZ-OD2 3.52Å; R25-D27 IonicContact NE-OD1 3.88Å; R25-D27 PolarHBondContact NE-OD1 3.26Å; R25-D27 IonicContact NE-OD2 3.45Å; R25-D27 IonicContact NH2-OD1 2.62Å; R25-D27 PolarHBondContact NH2-OD1 2.87Å; R25-D27 IonicContact NH2-OD2 3.03Å; R25-D27 PolarHBondContact NH2-OD2 3.37Å; D27-L423 CarbonylContact O-C 3.39Å; D27-L423 VanDerWaalsContact O-CA 3.25Å; D27-L423 WeakPolarHBondContact O-CA 3.45Å; D27-L423 WeakPolarHBondContact O-CD2 3.44Å; D27-L424 PolarHBondContact O-N 2.82Å
28	L	88.3	Confident	83.1	Confident	10 Å²	10	43 Å²	43	5%	0.052	21%	0.211	C	C	.	.	S	Bend	trans	-113.3	138.8	171.1	-80.4	170.1	0	0	0	109.3	V15 L18 Y19 R25 N26 V422 L423	V15-L28 HydrophobicContact CG1-CD1 4.12Å; V15-L28 HydrophobicContact CG2-CD2 4.12Å; L18-L28 HydrophobicContact CB-CD1 4.41Å; L18-L28 HydrophobicContact CD1-CD2 4.39Å; Y19-L28 HydrophobicContact CD1-CD1 4.18Å; Y19-L28 HydrophobicContact CD2-CD1 4.39Å; Y19-L28 HydrophobicContact CE1-CD1 3.57Å; Y19-L28 HydrophobicContact CE2-CD1 3.84Å; Y19-L28 WeakPolarHBondContact OH-CB 3.47Å; Y19-L28 WeakPolarHBondContact OH-CD1 3.38Å; R25-L28 HydrophobicContact CG-CD1 3.99Å; R25-L28 HydrophobicContact CG-CG 4.46Å; N26-L28 VanDerWaalsContact C-N 3.33Å; L28-V422 HydrophobicContact CD2-CG2 3.84Å; L28-L423 HydrophobicContact CD2-CD2 3.69Å; L28-L423 HydrophobicContact CG-CD2 3.89Å
29	P	90.3	Very high	83.9	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.013	21%	0.213	C	C	.	.	P	Polyproline II helix	trans	-63.7	151.8	175	29.5	-37.2	0	0	0	111	V422 L424 K511 S512 V515	P29-V422 WeakPolarHBondContact CD-O 3.43Å; P29-L424 HydrophobicContact CB-CD2 4.05Å; P29-K511 HydrophobicContact CB-CB 3.93Å; P29-K511 HydrophobicContact CG-CB 3.75Å; P29-S512 WeakPolarHBondContact CB-OG 3.06Å; P29-V515 HydrophobicContact CG-CB 4.03Å; P29-V515 HydrophobicContact CG-CG2 3.56Å
30	P	90.5	Very high	84.7	Confident	9 Å²	9	42.7 Å²	42.7	6%	0.058	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-66.5	146.8	173.9	26	-31	0	0	0	112	P110 L491 V503 S512	P30-P110 HydrophobicContact CB-CG 3.95Å; P30-L491 HydrophobicContact CG-CD1 4.2Å; P30-V503 HydrophobicContact CG-CG1 3.32Å; P30-S512 PolarHBondContact O-OG 2.97Å
31	C	90.4	Very high	85.7	Confident	6 Å²	6	38.5 Å²	38.5	4%	0.041	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-89.5	118.9	171.4	-176.9	0	0	0	0	109.6	V33 Y35 L36 E109 H516	C31-V33 PolarHBondContact O-N 3.03Å; C31-Y35 VanDerWaalsContact SG-C 3.56Å; C31-L36 HydrophobicContact CB-CD2 3.69Å; C31-E109 HydrophobicContact CB-CB 4.31Å; C31-E109 HydrophobicContact CB-CG 4.02Å; C31-E109 PolarHBondContact N-OE2 2.8Å; C31-E109 WeakPolarHBondContact O-CB 3.44Å; C31-H516 VanDerWaalsContact CA-NE2 3.27Å; C31-H516 WeakPolarHBondContact CA-NE2 3.09Å; C31-H516 WeakPolarHBondContact CB-CE1 3.31Å; C31-H516 WeakPolarHBondContact CB-NE2 3.4Å; C31-H516 PolarHBondContact SG-CE1 3.39Å; C31-H516 PolarHBondContact SG-ND1 3.2Å; C31-H516 VanDerWaalsContact SG-ND1 3.42Å
32	P	92.5	Very high	86.8	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.006	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-57.2	143.4	174.4	-16.5	25.8	0	0	0	110.5	E34 Y35 L36 L491 E501 I518	P32-E34 PolarHBondContact O-N 2.78Å; P32-Y35 HydrophobicContact CB-CD2 3.96Å; P32-Y35 HydrophobicContact CG-CD2 3.95Å; P32-Y35 WeakPolarHBondContact O-CA 3.13Å; P32-Y35 WeakPolarHBondContact O-CB 3.39Å; P32-Y35 PolarHBondContact O-N 3.06Å; P32-L36 PolarHBondContact O-N 3.13Å; P32-L491 HydrophobicContact CG-CB 4.32Å; P32-L491 HydrophobicContact CG-CD1 4.16Å; P32-E501 VanDerWaalsContact CA-OE2 3.29Å; P32-E501 WeakPolarHBondContact CA-OE2 3.44Å; P32-I518 HydrophobicContact CG-CD1 3.82Å
33	V	92.4	Very high	87.7	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.012	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-52.6	-39	-170.1	69.7	0	0	0	0	112.3	C31 Y35 L36 F39 I108 P499 E501	C31-V33 PolarHBondContact O-N 3.03Å; V33-Y35 PolarHBondContact O-N 3.44Å; V33-L36 HydrophobicContact CB-CD1 4.37Å; V33-L36 HydrophobicContact CG2-CD1 4.06Å; V33-L36 WeakPolarHBondContact O-CB 3.49Å; V33-L36 PolarHBondContact O-N 3.43Å; V33-L36 VanDerWaalsContact O-N 3.08Å; V33-F39 HydrophobicContact CG2-CB 4.47Å; V33-F39 HydrophobicContact CG2-CD2 3.73Å; V33-F39 HydrophobicContact CG2-CE2 4Å; V33-F39 HydrophobicContact CG2-CG 4.04Å; V33-F39 WeakPolarHBondContact O-CB 3.46Å; V33-F39 VanDerWaalsContact O-CD1 3.32Å; V33-F39 WeakPolarHBondContact O-CD1 3.48Å; V33-F39 VanDerWaalsContact O-CG 3.27Å; V33-F39 WeakPolarHBondContact O-CG 3.48Å; V33-I108 HydrophobicContact CB-CD1 4.24Å; V33-I108 HydrophobicContact CG2-CD1 3.95Å; V33-I108 HydrophobicContact CG2-CG2 4.49Å; V33-P499 HydrophobicContact CG1-CG 3.83Å; V33-E501 WeakPolarHBondContact CB-OE2 3.17Å; V33-E501 PolarHBondContact N-OE2 2.95Å
34	E	88.2	Confident	88.7	Confident	32 Å²	32	29.4 Å²	29.4	15%	0.15	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-67.5	-17.4	-179.3	70.6	173.6	171.9	0	0	114.2	P32 R493 S494 Y498	P32-E34 PolarHBondContact O-N 2.78Å; E34-R493 WeakPolarHBondContact OE1-CA 3.35Å; E34-S494 VanDerWaalsContact CD-N 3.33Å; E34-S494 PolarHBondContact OE1-N 3.23Å; E34-S494 WeakPolarHBondContact OE2-CB 3.27Å; E34-S494 PolarHBondContact OE2-N 2.95Å; E34-S494 PolarHBondContact OE2-OG 3.24Å; E34-Y498 HydrophobicContact CB-CD2 3.58Å; E34-Y498 HydrophobicContact CB-CE2 3.5Å; E34-Y498 VanDerWaalsContact CB-CE2 3.5Å; E34-Y498 HydrophobicContact CG-CD2 4.41Å; E34-Y498 WeakPolarHBondContact OE2-CD2 3.46Å; E34-Y498 WeakPolarHBondContact OE2-CE2 3.2Å
35	Y	86.9	Confident	89.5	Confident	42 Å²	42	25.1 Å²	25.1	17%	0.165	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-101.8	-0.6	177.9	-64.7	-60.2	0	0	0	112.8	R9 C31 P32 V33 I518	R9-Y35 VanDerWaalsContact NH2-CD1 3.25Å; C31-Y35 VanDerWaalsContact SG-C 3.56Å; P32-Y35 HydrophobicContact CB-CD2 3.96Å; P32-Y35 HydrophobicContact CG-CD2 3.95Å; P32-Y35 WeakPolarHBondContact O-CA 3.13Å; P32-Y35 WeakPolarHBondContact O-CB 3.39Å; P32-Y35 PolarHBondContact O-N 3.06Å; V33-Y35 PolarHBondContact O-N 3.44Å; Y35-I518 HydrophobicContact CD2-CD1 3.65Å; Y35-I518 HydrophobicContact CD2-CG1 3.94Å; Y35-I518 HydrophobicContact CE2-CB 4.43Å; Y35-I518 HydrophobicContact CE2-CD1 3.44Å; Y35-I518 VanDerWaalsContact CE2-CD1 3.44Å; Y35-I518 HydrophobicContact CE2-CG1 3.49Å; Y35-I518 VanDerWaalsContact CE2-CG1 3.49Å; Y35-I518 HydrophobicContact CE2-CG2 4.16Å
36	L	88.8	Confident	90	Very high	5 Å²	5	30.4 Å²	30.4	3%	0.026	16%	0.161	C	C	.	.			trans	-68.1	130.7	174.1	-63.3	174.6	0	0	0	111	C31 P32 V33 Y38 F39 I60 E109	C31-L36 HydrophobicContact CB-CD2 3.69Å; P32-L36 PolarHBondContact O-N 3.13Å; V33-L36 HydrophobicContact CB-CD1 4.37Å; V33-L36 HydrophobicContact CG2-CD1 4.06Å; V33-L36 WeakPolarHBondContact O-CB 3.49Å; V33-L36 PolarHBondContact O-N 3.43Å; V33-L36 VanDerWaalsContact O-N 3.08Å; L36-Y38 HydrophobicContact CB-CD2 4.49Å; L36-Y38 HydrophobicContact CB-CE2 4.3Å; L36-Y38 HydrophobicContact CD1-CE2 3.99Å; L36-Y38 PolarHBondContact O-N 3.38Å; L36-F39 HydrophobicContact CB-CB 3.8Å; L36-F39 PolarHBondContact O-N 2.7Å; L36-I60 HydrophobicContact CD1-CD1 4.27Å; L36-E109 HydrophobicContact CD1-CB 4.2Å; L36-E109 HydrophobicContact CD2-CB 3.61Å; L36-E109 HydrophobicContact CD2-CG 3.39Å; L36-E109 HydrophobicContact CG-CB 4.46Å
37	P	86.2	Confident	90.6	Very high	20 Å²	20	27 Å²	27	13%	0.13	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-28	179.3	-26.4	37	0	0	0	113.8	A8 Y137 A138 V141	A8-P37 HydrophobicContact CB-CB 4.23Å; A8-P37 HydrophobicContact CB-CG 3.55Å; P37-Y137 HydrophobicContact CB-CD1 3.44Å; P37-Y137 VanDerWaalsContact CB-CD1 3.44Å; P37-Y137 HydrophobicContact CB-CE1 3.7Å; P37-Y137 HydrophobicContact CB-CG 4.23Å; P37-Y137 CarbonylContact O-C 3.25Å; P37-Y137 VanDerWaalsContact O-CA 3.28Å; P37-Y137 WeakPolarHBondContact O-CA 3.43Å; P37-Y137 WeakPolarHBondContact O-CB 3.34Å; P37-A138 PolarHBondContact O-N 2.77Å; P37-V141 HydrophobicContact CB-CG1 4.41Å
38	Y	90.7	Very high	90.9	Very high	27 Å²	27	24.6 Å²	24.6	11%	0.106	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	15.9	179.2	51.2	-96.8	0	0	0	112.7	L36 H40 F58 I60 I112 P135 V136 Y137	L36-Y38 HydrophobicContact CB-CD2 4.49Å; L36-Y38 HydrophobicContact CB-CE2 4.3Å; L36-Y38 HydrophobicContact CD1-CE2 3.99Å; L36-Y38 PolarHBondContact O-N 3.38Å; Y38-H40 PolarHBondContact O-CD2 3.4Å; Y38-H40 VanDerWaalsContact O-CD2 3.3Å; Y38-F58 HydrophobicContact CD2-CE2 4.07Å; Y38-F58 HydrophobicContact CE2-CE2 4.23Å; Y38-F58 HydrophobicContact CG-CE2 4.45Å; Y38-I60 HydrophobicContact CD2-CD1 3.88Å; Y38-I60 HydrophobicContact CD2-CG1 4Å; Y38-I60 HydrophobicContact CE2-CD1 3.57Å; Y38-I60 HydrophobicContact CE2-CG1 4.19Å; Y38-I60 PolarHBondContact O-N 3.34Å; Y38-I112 HydrophobicContact CE2-CG2 4.04Å; Y38-P135 HydrophobicContact CD1-CB 3.7Å; Y38-P135 HydrophobicContact CE1-CB 4.43Å; Y38-P135 HydrophobicContact CG-CB 3.97Å; Y38-V136 VanDerWaalsContact CA-O 3.31Å; Y38-V136 WeakPolarHBondContact CA-O 3.41Å; Y38-V136 WeakPolarHBondContact CB-O 3.34Å; Y38-Y137 HydrophobicContact CD1-CD1 4.39Å; Y38-Y137 HydrophobicContact CD1-CE1 4.02Å
39	F	92.9	Very high	91.2	Very high	12 Å²	12	27.4 Å²	27.4	5%	0.053	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.8	165.4	175.5	-111	0	0	0	110.1	V33 L36 I60 L62 A138 Y498	V33-F39 HydrophobicContact CG2-CB 4.47Å; V33-F39 HydrophobicContact CG2-CD2 3.73Å; V33-F39 HydrophobicContact CG2-CE2 4Å; V33-F39 HydrophobicContact CG2-CG 4.04Å; V33-F39 WeakPolarHBondContact O-CB 3.46Å; V33-F39 VanDerWaalsContact O-CD1 3.32Å; V33-F39 WeakPolarHBondContact O-CD1 3.48Å; V33-F39 VanDerWaalsContact O-CG 3.27Å; V33-F39 WeakPolarHBondContact O-CG 3.48Å; L36-F39 HydrophobicContact CB-CB 3.8Å; L36-F39 PolarHBondContact O-N 2.7Å; F39-I60 CarbonylContact C-O 3.59Å; F39-I60 WeakPolarHBondContact CA-O 3.26Å; F39-I60 HydrophobicContact CD2-CB 4.25Å; F39-I60 HydrophobicContact CD2-CG2 3.95Å; F39-L62 HydrophobicContact CE2-CD2 3.98Å; F39-L62 HydrophobicContact CE2-CG 3.86Å; F39-L62 HydrophobicContact CZ-CD1 4.19Å; F39-L62 HydrophobicContact CZ-CD2 4.26Å; F39-L62 HydrophobicContact CZ-CG 3.8Å; F39-A138 WeakPolarHBondContact O-CB 3.48Å; F39-Y498 HydrophobicContact CE1-CE1 4.37Å; F39-Y498 HydrophobicContact CE1-CE2 4.32Å; F39-Y498 HydrophobicContact CZ-CE1 4.29Å
40	H	93.5	Very high	91.2	Very high	14 Å²	14	36 Å²	36	7%	0.065	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	12.8	-171.4	-73.1	-111.7	0	0	0	114	Y38 L43 R51 I60 F61 V136 Y137 A138	Y38-H40 PolarHBondContact O-CD2 3.4Å; Y38-H40 VanDerWaalsContact O-CD2 3.3Å; H40-L43 HydrophobicContact CB-CD1 3.77Å; H40-L43 HydrophobicContact CB-CG 4.45Å; H40-R51 VanDerWaalsContact CG-NH1 3.33Å; H40-R51 WeakPolarHBondContact ND1-CD 3.32Å; H40-R51 PolarHBondContact ND1-NH1 2.83Å; H40-I60 PolarHBondContact N-O 3.49Å; H40-F61 HydrophobicContact CB-CB 4.44Å; H40-V136 PolarHBondContact NE2-O 3.09Å; H40-Y137 PolarHBondContact CE1-O 3.08Å; H40-A138 VanDerWaalsContact CE1-CA 3.45Å; H40-A138 WeakPolarHBondContact CE1-CA 2.96Å; H40-A138 PolarHBondContact CE1-N 2.98Å; H40-A138 PolarHBondContact NE2-N 2.84Å
41	G	91.7	Very high	91.3	Very high	11 Å²	11	38.7 Å²	38.7	11%	0.113	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.5	-149.6	-177.7	0	0	0	0	0	112.6	F61 L62	G41-F61 CarbonylContact O-C 3.58Å; G41-F61 WeakPolarHBondContact O-CA 3.42Å; G41-F61 WeakPolarHBondContact O-CB 3.24Å; G41-L62 PolarHBondContact O-N 3Å
42	C	93.8	Very high	91.4	Very high	40 Å²	40	38.9 Å²	38.9	27%	0.27	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	116.5	-178.1	-50.7	0	0	0	0	111	L62 K64 L68	C42-L62 WeakPolarHBondContact CA-O 3.28Å; C42-L62 HydrophobicContact CB-CB 4.46Å; C42-K64 HydrophobicContact CB-CG 4.26Å; C42-K64 WeakPolarHBondContact O-CE 3.44Å; C42-K64 PolarHBondContact O-NZ 3.45Å; C42-L68 HydrophobicContact CB-CD2 4.07Å
43	L	94	Very high	91.3	Very high	12 Å²	12	46.3 Å²	46.3	6%	0.063	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	155.1	179.2	-54.4	174.6	0	0	0	111.4	H40 E47 A48 F61 L62 K64	H40-L43 HydrophobicContact CB-CD1 3.77Å; H40-L43 HydrophobicContact CB-CG 4.45Å; L43-E47 HydrophobicContact CB-CB 4.27Å; L43-E47 HydrophobicContact CD2-CB 4.42Å; L43-A48 HydrophobicContact CB-CB 4.46Å; L43-A48 HydrophobicContact CD1-CB 3.9Å; L43-F61 HydrophobicContact CB-CB 4.45Å; L43-F61 HydrophobicContact CB-CD2 3.74Å; L43-F61 HydrophobicContact CB-CE2 4.39Å; L43-F61 HydrophobicContact CB-CG 4.4Å; L43-F61 HydrophobicContact CD1-CB 4.04Å; L43-F61 HydrophobicContact CD1-CD2 4.49Å; L43-F61 HydrophobicContact CD1-CG 4.38Å; L43-F61 HydrophobicContact CG-CB 4.25Å; L43-F61 HydrophobicContact CG-CD2 4.44Å; L43-L62 PolarHBondContact N-O 3.46Å; L43-K64 PolarHBondContact O-N 3.39Å
44	S	93	Very high	91.2	Very high	31 Å²	31	54 Å²	54	22%	0.217	25%	0.245	C	C	.	.			trans	-75.9	157.5	157.3	64.5	0	0	0	0	110.3	Q46 E47 A48	S44-Q46 VanDerWaalsContact C-N 3.31Å; S44-Q46 PolarHBondContact O-N 2.82Å; S44-E47 WeakPolarHBondContact CB-OE2 3.09Å; S44-E47 PolarHBondContact N-OE2 2.94Å; S44-E47 PolarHBondContact O-N 3.43Å; S44-E47 VanDerWaalsContact O-N 3.11Å; S44-E47 WeakPolarHBondContact OG-CG 3.47Å; S44-E47 PolarHBondContact OG-N 2.99Å; S44-E47 PolarHBondContact OG-OE2 3.37Å; S44-A48 PolarHBondContact O-N 2.94Å; S44-A48 VanDerWaalsContact O-N 3.12Å
45	M	88.9	Confident	91.3	Very high	36 Å²	36	55.5 Å²	55.5	18%	0.177	26%	0.258	C	S	.	.	H	α-helix	trans	-54.1	-47.3	177.7	-173.6	62	172.3	0	0	112.1	E47 A48 E49 F61 L73 Q83	M45-E47 PolarHBondContact O-N 3.08Å; M45-A48 WeakPolarHBondContact O-CB 3.37Å; M45-A48 PolarHBondContact O-N 2.95Å; M45-E49 HydrophobicContact CE-CG 3.94Å; M45-E49 WeakPolarHBondContact CE-OE1 3.37Å; M45-E49 HydrophobicContact CG-CG 4.16Å; M45-E49 WeakPolarHBondContact O-CG 3.5Å; M45-E49 PolarHBondContact O-N 2.84Å; M45-E49 HydrophobicContact SD-CG 4.22Å; M45-F61 HydrophobicContact SD-CZ 4.28Å; M45-L73 HydrophobicContact CE-CD1 3.33Å; M45-L73 HydrophobicContact SD-CD1 3.8Å; M45-Q83 HydrophobicContact CE-CB 4.13Å
46	Q	91	Very high	91.5	Very high	132 Å²	132	54.6 Å²	54.6	62%	0.617	26%	0.256	S	S	*	.	H	α-helix	trans	-62.3	-29.5	-179.7	-64.1	177.4	9.9	0	0	113.6	S44 R50	S44-Q46 VanDerWaalsContact C-N 3.31Å; S44-Q46 PolarHBondContact O-N 2.82Å; Q46-R50 WeakPolarHBondContact O-CG 3.26Å; Q46-R50 PolarHBondContact O-NE 2.79Å
47	E	92.6	Very high	91.7	Very high	72 Å²	72	55 Å²	55	34%	0.336	26%	0.258	S	S	.	.	H	α-helix	trans	-75.1	-37.2	174.9	-71.6	165.4	140.4	0	0	111.3	L43 S44 M45 K64	L43-E47 HydrophobicContact CB-CB 4.27Å; L43-E47 HydrophobicContact CD2-CB 4.42Å; S44-E47 WeakPolarHBondContact CB-OE2 3.09Å; S44-E47 PolarHBondContact N-OE2 2.94Å; S44-E47 PolarHBondContact O-N 3.43Å; S44-E47 VanDerWaalsContact O-N 3.11Å; S44-E47 WeakPolarHBondContact OG-CG 3.47Å; S44-E47 PolarHBondContact OG-N 2.99Å; S44-E47 PolarHBondContact OG-OE2 3.37Å; M45-E47 PolarHBondContact O-N 3.08Å; E47-K64 IonicContact OE2-NZ 2.66Å
48	A	92.7	Very high	92.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-70.6	-45.3	178.7	0	0	0	0	0	112	L43 S44 M45 R50 R51 L59 F61 L73	L43-A48 HydrophobicContact CB-CB 4.46Å; L43-A48 HydrophobicContact CD1-CB 3.9Å; S44-A48 PolarHBondContact O-N 2.94Å; S44-A48 VanDerWaalsContact O-N 3.12Å; M45-A48 WeakPolarHBondContact O-CB 3.37Å; M45-A48 PolarHBondContact O-N 2.95Å; A48-R50 PolarHBondContact O-N 3.44Å; A48-R51 WeakPolarHBondContact O-CB 3.34Å; A48-R51 PolarHBondContact O-N 3.44Å; A48-L59 HydrophobicContact CB-CD1 4.33Å; A48-F61 HydrophobicContact CB-CD1 4.25Å; A48-F61 HydrophobicContact CB-CD2 4.37Å; A48-F61 HydrophobicContact CB-CE1 4.11Å; A48-F61 HydrophobicContact CB-CE2 4.2Å; A48-F61 HydrophobicContact CB-CG 4.38Å; A48-F61 HydrophobicContact CB-CZ 4.07Å; A48-L73 HydrophobicContact CB-CD2 3.7Å
49	E	93.4	Very high	92.4	Very high	69 Å²	69	53 Å²	53	32%	0.322	25%	0.247	S	C	.	.	H	α-helix	trans	-58.9	-33.5	-179.7	-73.1	-177.6	140.9	0	0	113.6	M45 R51 L52 L73 N81	M45-E49 HydrophobicContact CE-CG 3.94Å; M45-E49 WeakPolarHBondContact CE-OE1 3.37Å; M45-E49 HydrophobicContact CG-CG 4.16Å; M45-E49 WeakPolarHBondContact O-CG 3.5Å; M45-E49 PolarHBondContact O-N 2.84Å; M45-E49 HydrophobicContact SD-CG 4.22Å; E49-R51 PolarHBondContact O-N 2.79Å; E49-R51 VanDerWaalsContact O-N 3.13Å; E49-L52 PolarHBondContact O-N 2.76Å; E49-L73 HydrophobicContact CG-CD2 4.05Å; E49-N81 WeakPolarHBondContact CB-ND2 3.17Å; E49-N81 HydrophobicContact CG-CB 4.15Å; E49-N81 VanDerWaalsContact CG-ND2 3.34Å; E49-N81 WeakPolarHBondContact CG-ND2 3.06Å
50	R	91.6	Very high	92.5	Very high	183 Å²	183	52.4 Å²	52.4	69%	0.691	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-8.5	177	-75.5	-179.4	-114.9	178.1	-7	113.8	Q46 A48	Q46-R50 WeakPolarHBondContact O-CG 3.26Å; Q46-R50 PolarHBondContact O-NE 2.79Å; A48-R50 PolarHBondContact O-N 3.44Å
51	R	91.9	Very high	92.7	Very high	65 Å²	65	51.7 Å²	51.7	25%	0.245	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-13.8	-177.2	-57.5	-172.4	177.7	167.1	-4.1	113.7	H40 A48 E49 L59	H40-R51 VanDerWaalsContact CG-NH1 3.33Å; H40-R51 WeakPolarHBondContact ND1-CD 3.32Å; H40-R51 PolarHBondContact ND1-NH1 2.83Å; A48-R51 WeakPolarHBondContact O-CB 3.34Å; A48-R51 PolarHBondContact O-N 3.44Å; E49-R51 PolarHBondContact O-N 2.79Å; E49-R51 VanDerWaalsContact O-N 3.13Å; R51-L59 HydrophobicContact CB-CD2 3.72Å; R51-L59 HydrophobicContact CG-CD2 4.49Å
52	L	93.2	Very high	92.9	Very high	10 Å²	10	51.2 Å²	51.2	5%	0.052	24%	0.237	C	C	.	.			trans	-95.8	120.9	180	-54.3	-172.3	0	0	0	110.5	E49 D57 L59 L73 K75 V136	E49-L52 PolarHBondContact O-N 2.76Å; L52-D57 HydrophobicContact CB-CB 4.28Å; L52-D57 HydrophobicContact CD2-CB 4.01Å; L52-L59 HydrophobicContact CD2-CB 4.49Å; L52-L59 HydrophobicContact CD2-CD2 3.77Å; L52-L59 HydrophobicContact CD2-CG 3.99Å; L52-L59 HydrophobicContact CG-CD2 4.43Å; L52-L73 HydrophobicContact CD1-CB 4.24Å; L52-L73 HydrophobicContact CD1-CD2 3.76Å; L52-L73 HydrophobicContact CD1-CG 3.61Å; L52-L73 HydrophobicContact CG-CD2 4.19Å; L52-K75 HydrophobicContact CB-CB 4.07Å; L52-K75 HydrophobicContact CB-CD 4.25Å; L52-K75 HydrophobicContact CD1-CB 4.09Å; L52-V136 HydrophobicContact CD2-CB 4.31Å; L52-V136 HydrophobicContact CD2-CG2 3.77Å
53	E	90.3	Very high	93	Very high	157 Å²	157	49.4 Å²	49.4	73%	0.734	22%	0.224	S	C	*	.			trans	-106.9	-42.3	-175.2	-66.7	-175.4	175.6	0	0	112.1	D57	E53-D57 PolarHBondContact N-OD2 2.83Å; E53-D57 VanDerWaalsContact N-OD2 3.13Å
54	R	90.9	Very high	93	Very high	165 Å²	165	54.3 Å²	54.3	62%	0.623	25%	0.245	S	C	*	.	S	Bend	trans	-115.3	154.5	-169.9	-52.5	175.4	-176.1	179.9	0.4	111.8	N56 D57 K75	R54-N56 PolarHBondContact O-N 3.18Å; R54-D57 PolarHBondContact N-OD2 2.82Å; R54-D57 WeakPolarHBondContact O-CB 3.32Å; R54-D57 PolarHBondContact O-N 2.89Å; R54-D57 VanDerWaalsContact O-N 3.1Å; R54-K75 WeakPolarHBondContact O-CB 3.31Å; R54-K75 WeakPolarHBondContact O-CD 3.39Å
55	P	89.7	Confident	92.8	Very high	63 Å²	63	57.8 Å²	57.8	41%	0.409	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	139.1	172.1	-28	36.6	0	0	0	112.4	D57 N134	P55-D57 PolarHBondContact O-N 3.43Å; P55-N134 PolarHBondContact O-ND2 2.66Å
56	N	90.3	Very high	92.8	Very high	22 Å²	22	59 Å²	59	12%	0.118	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	11.5	-177.3	-52.1	-65.8	0	0	0	114.7	R54 K75 D77 R131 S133 N134	R54-N56 PolarHBondContact O-N 3.18Å; N56-K75 WeakPolarHBondContact CA-O 3.49Å; N56-K75 PolarHBondContact N-O 3.04Å; N56-D77 PolarHBondContact ND2-OD1 3.19Å; N56-R131 WeakPolarHBondContact CB-O 3.42Å; N56-R131 WeakPolarHBondContact OD1-CB 3.4Å; N56-R131 PolarHBondContact OD1-N 3.18Å; N56-R131 PolarHBondContact OD1-O 3.25Å; N56-S133 PolarHBondContact O-N 3.07Å; N56-N134 PolarHBondContact O-N 3.43Å
57	D	93.8	Very high	92.8	Very high	14 Å²	14	60.4 Å²	60.4	8%	0.075	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	133.6	159.9	-75.3	1.4	0	0	0	109	L52 E53 R54 P55 V74 K75 N134 V136	L52-D57 HydrophobicContact CB-CB 4.28Å; L52-D57 HydrophobicContact CD2-CB 4.01Å; E53-D57 PolarHBondContact N-OD2 2.83Å; E53-D57 VanDerWaalsContact N-OD2 3.13Å; R54-D57 PolarHBondContact N-OD2 2.82Å; R54-D57 WeakPolarHBondContact O-CB 3.32Å; R54-D57 PolarHBondContact O-N 2.89Å; R54-D57 VanDerWaalsContact O-N 3.1Å; P55-D57 PolarHBondContact O-N 3.43Å; D57-V74 CarbonylContact O-C 3.54Å; D57-V74 WeakPolarHBondContact O-CA 3.38Å; D57-K75 PolarHBondContact O-N 2.87Å; D57-N134 CarbonylContact C-O 3.58Å; D57-N134 VanDerWaalsContact CA-O 3.29Å; D57-N134 WeakPolarHBondContact CA-O 3.3Å; D57-N134 VanDerWaalsContact OD1-CB 3.25Å; D57-N134 WeakPolarHBondContact OD1-CB 3.18Å; D57-N134 PolarHBondContact OD1-ND2 3.45Å; D57-V136 HydrophobicContact CB-CG2 3.68Å
58	F	94.8	Very high	92.8	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.018	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	156.4	176.6	76.1	-87.2	0	0	0	112.8	Y38 V72 L73 V74 I112 L132 N134 P135 V136	Y38-F58 HydrophobicContact CD2-CE2 4.07Å; Y38-F58 HydrophobicContact CE2-CE2 4.23Å; Y38-F58 HydrophobicContact CG-CE2 4.45Å; F58-V72 HydrophobicContact CB-CG1 4.45Å; F58-V72 HydrophobicContact CD2-CG1 4.39Å; F58-L73 CarbonylContact C-O 3.56Å; F58-L73 WeakPolarHBondContact CA-O 3.4Å; F58-L73 WeakPolarHBondContact CB-O 3.35Å; F58-V74 HydrophobicContact CB-CB 4.38Å; F58-V74 HydrophobicContact CB-CG1 4.2Å; F58-V74 HydrophobicContact CB-CG2 3.99Å; F58-I112 HydrophobicContact CE2-CG2 3.9Å; F58-I112 HydrophobicContact CZ-CG2 4.39Å; F58-L132 HydrophobicContact CB-CD2 3.77Å; F58-L132 HydrophobicContact CD1-CB 3.79Å; F58-L132 HydrophobicContact CD1-CD2 4.25Å; F58-L132 HydrophobicContact CD2-CB 4.48Å; F58-L132 HydrophobicContact CD2-CD2 4.17Å; F58-L132 HydrophobicContact CE1-CB 3.79Å; F58-L132 HydrophobicContact CG-CB 4.13Å; F58-L132 HydrophobicContact CG-CD2 3.82Å; F58-L132 HydrophobicContact CG-CG 4.47Å; F58-L132 HydrophobicContact CZ-CB 4.16Å; F58-N134 WeakPolarHBondContact CD1-O 3.3Å; F58-N134 PolarHBondContact N-O 2.67Å; F58-P135 HydrophobicContact CE1-CB 3.85Å; F58-P135 HydrophobicContact CE1-CG 4.31Å; F58-P135 VanDerWaalsContact CE1-N 3.3Å; F58-P135 HydrophobicContact CE2-CB 4.17Å; F58-P135 HydrophobicContact CZ-CB 3.6Å; F58-P135 HydrophobicContact CZ-CG 4.29Å; F58-V136 PolarHBondContact O-N 2.86Å
59	L	95.6	Very high	92.9	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	165.4	171.3	62.2	80.1	0	0	0	111	A48 R51 L52 F61 V72 L73 V136	A48-L59 HydrophobicContact CB-CD1 4.33Å; R51-L59 HydrophobicContact CB-CD2 3.72Å; R51-L59 HydrophobicContact CG-CD2 4.49Å; L52-L59 HydrophobicContact CD2-CB 4.49Å; L52-L59 HydrophobicContact CD2-CD2 3.77Å; L52-L59 HydrophobicContact CD2-CG 3.99Å; L52-L59 HydrophobicContact CG-CD2 4.43Å; L59-F61 HydrophobicContact CD1-CB 4.23Å; L59-F61 HydrophobicContact CD1-CD1 3.6Å; L59-F61 HydrophobicContact CD1-CE1 4.39Å; L59-F61 HydrophobicContact CD1-CG 4.23Å; L59-V72 WeakPolarHBondContact O-CA 3.3Å; L59-L73 HydrophobicContact CD1-CB 4.03Å; L59-L73 HydrophobicContact CG-CB 4.27Å; L59-L73 PolarHBondContact N-O 3.15Å; L59-L73 PolarHBondContact O-N 3.1Å; L59-V136 HydrophobicContact CB-CB 4.44Å
60	I	96	Very high	93	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	139.8	173.1	-54.4	178.7	0	0	0	109.3	L36 Y38 F39 H40 T71 V72 I108 I112	L36-I60 HydrophobicContact CD1-CD1 4.27Å; Y38-I60 HydrophobicContact CD2-CD1 3.88Å; Y38-I60 HydrophobicContact CD2-CG1 4Å; Y38-I60 HydrophobicContact CE2-CD1 3.57Å; Y38-I60 HydrophobicContact CE2-CG1 4.19Å; Y38-I60 PolarHBondContact O-N 3.34Å; F39-I60 CarbonylContact C-O 3.59Å; F39-I60 WeakPolarHBondContact CA-O 3.26Å; F39-I60 HydrophobicContact CD2-CB 4.25Å; F39-I60 HydrophobicContact CD2-CG2 3.95Å; H40-I60 PolarHBondContact N-O 3.49Å; I60-T71 WeakPolarHBondContact CA-O 3.25Å; I60-V72 HydrophobicContact CG1-CG2 4.46Å; I60-I108 HydrophobicContact CD1-CG2 3.88Å; I60-I112 HydrophobicContact CD1-CB 4.38Å; I60-I112 HydrophobicContact CD1-CD1 3.87Å; I60-I112 HydrophobicContact CD1-CG1 3.61Å; I60-I112 HydrophobicContact CD1-CG2 4.24Å
61	F	96.5	Very high	93.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	164.7	175.2	71.7	-69.7	0	0	0	110.4	H40 G41 L43 M45 A48 L59 N63 T71 L73	H40-F61 HydrophobicContact CB-CB 4.44Å; G41-F61 CarbonylContact O-C 3.58Å; G41-F61 WeakPolarHBondContact O-CA 3.42Å; G41-F61 WeakPolarHBondContact O-CB 3.24Å; L43-F61 HydrophobicContact CB-CB 4.45Å; L43-F61 HydrophobicContact CB-CD2 3.74Å; L43-F61 HydrophobicContact CB-CE2 4.39Å; L43-F61 HydrophobicContact CB-CG 4.4Å; L43-F61 HydrophobicContact CD1-CB 4.04Å; L43-F61 HydrophobicContact CD1-CD2 4.49Å; L43-F61 HydrophobicContact CD1-CG 4.38Å; L43-F61 HydrophobicContact CG-CB 4.25Å; L43-F61 HydrophobicContact CG-CD2 4.44Å; M45-F61 HydrophobicContact SD-CZ 4.28Å; A48-F61 HydrophobicContact CB-CD1 4.25Å; A48-F61 HydrophobicContact CB-CD2 4.37Å; A48-F61 HydrophobicContact CB-CE1 4.11Å; A48-F61 HydrophobicContact CB-CE2 4.2Å; A48-F61 HydrophobicContact CB-CG 4.38Å; A48-F61 HydrophobicContact CB-CZ 4.07Å; L59-F61 HydrophobicContact CD1-CB 4.23Å; L59-F61 HydrophobicContact CD1-CD1 3.6Å; L59-F61 HydrophobicContact CD1-CE1 4.39Å; L59-F61 HydrophobicContact CD1-CG 4.23Å; F61-N63 HydrophobicContact CD2-CB 4.44Å; F61-N63 HydrophobicContact CE2-CB 3.79Å; F61-N63 HydrophobicContact CZ-CB 4.23Å; F61-T71 HydrophobicContact CD1-CG2 4.37Å; F61-T71 HydrophobicContact CE1-CG2 3.56Å; F61-T71 HydrophobicContact CZ-CG2 3.91Å; F61-T71 PolarHBondContact N-O 3.28Å; F61-T71 PolarHBondContact O-N 2.73Å; F61-L73 HydrophobicContact CD1-CB 4.47Å; F61-L73 HydrophobicContact CE1-CB 3.96Å
62	L	96.9	Very high	93.4	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	120.4	167.2	-54.6	-173.9	0	0	0	108.4	F39 G41 C42 L43 K64 L68 P70 Y498	F39-L62 HydrophobicContact CE2-CD2 3.98Å; F39-L62 HydrophobicContact CE2-CG 3.86Å; F39-L62 HydrophobicContact CZ-CD1 4.19Å; F39-L62 HydrophobicContact CZ-CD2 4.26Å; F39-L62 HydrophobicContact CZ-CG 3.8Å; G41-L62 PolarHBondContact O-N 3Å; C42-L62 WeakPolarHBondContact CA-O 3.28Å; C42-L62 HydrophobicContact CB-CB 4.46Å; L43-L62 PolarHBondContact N-O 3.46Å; L62-K64 PolarHBondContact O-N 3.15Å; L62-L68 HydrophobicContact CB-CB 4.23Å; L62-L68 HydrophobicContact CB-CD2 4.31Å; L62-P70 HydrophobicContact CD2-CB 3.92Å; L62-P70 HydrophobicContact CD2-CG 3.82Å; L62-Y498 HydrophobicContact CD1-CD1 3.38Å; L62-Y498 HydrophobicContact CD1-CE1 3.85Å; L62-Y498 HydrophobicContact CD1-CG 4.37Å
63	N	95.3	Very high	93.5	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.016	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	109.3	-173.4	-176	4.7	0	0	0	111.4	F61 T65 D66 L68 K69 Q83	F61-N63 HydrophobicContact CD2-CB 4.44Å; F61-N63 HydrophobicContact CE2-CB 3.79Å; F61-N63 HydrophobicContact CZ-CB 4.23Å; N63-T65 PolarHBondContact ND2-OG1 3.21Å; N63-T65 PolarHBondContact O-N 3.15Å; N63-T65 VanDerWaalsContact O-N 3.11Å; N63-T65 PolarHBondContact OD1-N 3.23Å; N63-T65 PolarHBondContact OD1-OG1 2.82Å; N63-D66 HydrophobicContact CB-CB 4.08Å; N63-D66 WeakPolarHBondContact ND2-CB 3.3Å; N63-D66 CarbonylContact O-C 3.45Å; N63-D66 PolarHBondContact O-N 3.02Å; N63-D66 VanDerWaalsContact O-N 3.1Å; N63-L68 VanDerWaalsContact O-CA 3.27Å; N63-L68 WeakPolarHBondContact O-CA 3.41Å; N63-L68 PolarHBondContact O-N 2.94Å; N63-K69 PolarHBondContact N-O 3.17Å; N63-Q83 PolarHBondContact ND2-NE2 3.19Å
64	K	93.9	Very high	93.6	Very high	115 Å²	115	40.1 Å²	40.1	50%	0.5	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-22.5	176.1	-73.5	179.8	-179.1	161.1	0	113.8	C42 L43 E47 L62 L68	C42-K64 HydrophobicContact CB-CG 4.26Å; C42-K64 WeakPolarHBondContact O-CE 3.44Å; C42-K64 PolarHBondContact O-NZ 3.45Å; L43-K64 PolarHBondContact O-N 3.39Å; E47-K64 IonicContact OE2-NZ 2.66Å; L62-K64 PolarHBondContact O-N 3.15Å; K64-L68 HydrophobicContact CG-CD2 4.21Å
65	T	89.5	Confident	93.7	Very high	103 Å²	103	34 Å²	34	63%	0.632	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-6.2	-178.5	62.7	0	0	0	0	113.6	N63	N63-T65 PolarHBondContact ND2-OG1 3.21Å; N63-T65 PolarHBondContact O-N 3.15Å; N63-T65 VanDerWaalsContact O-N 3.11Å; N63-T65 PolarHBondContact OD1-N 3.23Å; N63-T65 PolarHBondContact OD1-OG1 2.82Å
66	D	89.3	Confident	93.7	Very high	62 Å²	62	31 Å²	31	33%	0.332	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.3	59.9	-178	-175.2	33	0	0	0	109	N63 L68 K69	N63-D66 HydrophobicContact CB-CB 4.08Å; N63-D66 WeakPolarHBondContact ND2-CB 3.3Å; N63-D66 CarbonylContact O-C 3.45Å; N63-D66 PolarHBondContact O-N 3.02Å; N63-D66 VanDerWaalsContact O-N 3.1Å; D66-L68 PolarHBondContact O-N 3.21Å; D66-K69 WeakPolarHBondContact O-CB 3.3Å; D66-K69 PolarHBondContact O-N 3.46Å; D66-K69 WeakPolarHBondContact OD2-CD 3.37Å
67	D	90	Very high	93.4	Very high	161 Å²	161	35 Å²	35	86%	0.861	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	48	36.5	174.2	-62.8	-31.9	0	0	0	115.9	K69	D67-K69 PolarHBondContact O-N 2.88Å
68	L	93	Very high	93	Very high	60 Å²	60	38.6 Å²	38.6	31%	0.314	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	26.8	-177.3	-57.6	176.1	0	0	0	113.9	C42 L62 N63 K64 D66	C42-L68 HydrophobicContact CB-CD2 4.07Å; L62-L68 HydrophobicContact CB-CB 4.23Å; L62-L68 HydrophobicContact CB-CD2 4.31Å; N63-L68 VanDerWaalsContact O-CA 3.27Å; N63-L68 WeakPolarHBondContact O-CA 3.41Å; N63-L68 PolarHBondContact O-N 2.94Å; K64-L68 HydrophobicContact CG-CD2 4.21Å; D66-L68 PolarHBondContact O-N 3.21Å
69	K	94.3	Very high	92.5	Very high	55 Å²	55	40 Å²	40	24%	0.239	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	130.6	176.5	-165.6	170.4	-168.5	169.2	0	111.2	N63 D66 D67 T71 P85 Q87	N63-K69 PolarHBondContact N-O 3.17Å; D66-K69 WeakPolarHBondContact O-CB 3.3Å; D66-K69 PolarHBondContact O-N 3.46Å; D66-K69 WeakPolarHBondContact OD2-CD 3.37Å; D67-K69 PolarHBondContact O-N 2.88Å; K69-T71 PolarHBondContact O-N 3.29Å; K69-T71 PolarHBondContact O-OG1 3.36Å; K69-P85 HydrophobicContact CD-CB 3.93Å; K69-Q87 VanDerWaalsContact CE-OE1 3.28Å
70	P	96.6	Very high	92.2	Very high	15 Å²	15	44.8 Å²	44.8	10%	0.097	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	128.5	174.9	-17.5	29.7	0	0	0	110	L62 I86 I108 P499	L62-P70 HydrophobicContact CD2-CB 3.92Å; L62-P70 HydrophobicContact CD2-CG 3.82Å; P70-I86 HydrophobicContact CB-CB 4.3Å; P70-I86 HydrophobicContact CB-CD1 4.37Å; P70-I86 WeakPolarHBondContact O-CB 3.49Å; P70-I86 PolarHBondContact O-N 2.82Å; P70-I108 HydrophobicContact CB-CD1 3.85Å; P70-I108 HydrophobicContact CG-CD1 4.17Å; P70-P499 HydrophobicContact CB-CG 4.41Å; P70-P499 HydrophobicContact CG-CB 3.69Å; P70-P499 HydrophobicContact CG-CG 3.61Å
71	T	95.9	Very high	91.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	135	-168.6	-65.7	0	0	0	0	109.9	I60 F61 K69 Q83	I60-T71 WeakPolarHBondContact CA-O 3.25Å; F61-T71 HydrophobicContact CD1-CG2 4.37Å; F61-T71 HydrophobicContact CE1-CG2 3.56Å; F61-T71 HydrophobicContact CZ-CG2 3.91Å; F61-T71 PolarHBondContact N-O 3.28Å; F61-T71 PolarHBondContact O-N 2.73Å; K69-T71 PolarHBondContact O-N 3.29Å; K69-T71 PolarHBondContact O-OG1 3.36Å; T71-Q83 HydrophobicContact CG2-CG 3.37Å; T71-Q83 VanDerWaalsContact CG2-NE2 3.35Å
72	V	95.1	Very high	91.5	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	124.1	167.1	-167.4	0	0	0	0	108.6	F58 L59 I60 V74 V84 I86 I96 I112 L132	F58-V72 HydrophobicContact CB-CG1 4.45Å; F58-V72 HydrophobicContact CD2-CG1 4.39Å; L59-V72 WeakPolarHBondContact O-CA 3.3Å; I60-V72 HydrophobicContact CG1-CG2 4.46Å; V72-V74 HydrophobicContact CG1-CG2 3.72Å; V72-V84 HydrophobicContact CB-CB 4.48Å; V72-V84 PolarHBondContact N-O 2.8Å; V72-V84 PolarHBondContact O-N 2.86Å; V72-I86 HydrophobicContact CG2-CD1 3.8Å; V72-I86 HydrophobicContact CG2-CG1 3.87Å; V72-I96 HydrophobicContact CG2-CD1 4.13Å; V72-I112 HydrophobicContact CG2-CD1 3.41Å; V72-I112 VanDerWaalsContact CG2-CD1 3.41Å; V72-L132 HydrophobicContact CG1-CD1 4.34Å; V72-L132 HydrophobicContact CG1-CD2 3.73Å
73	L	95	Very high	91.2	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.1	168	-169.3	69.2	0	0	0	108.6	M45 A48 E49 L52 F58 L59 F61 N81 C82	M45-L73 HydrophobicContact CE-CD1 3.33Å; M45-L73 HydrophobicContact SD-CD1 3.8Å; A48-L73 HydrophobicContact CB-CD2 3.7Å; E49-L73 HydrophobicContact CG-CD2 4.05Å; L52-L73 HydrophobicContact CD1-CB 4.24Å; L52-L73 HydrophobicContact CD1-CD2 3.76Å; L52-L73 HydrophobicContact CD1-CG 3.61Å; L52-L73 HydrophobicContact CG-CD2 4.19Å; F58-L73 CarbonylContact C-O 3.56Å; F58-L73 WeakPolarHBondContact CA-O 3.4Å; F58-L73 WeakPolarHBondContact CB-O 3.35Å; L59-L73 HydrophobicContact CD1-CB 4.03Å; L59-L73 HydrophobicContact CG-CB 4.27Å; L59-L73 PolarHBondContact N-O 3.15Å; L59-L73 PolarHBondContact O-N 3.1Å; F61-L73 HydrophobicContact CD1-CB 4.47Å; F61-L73 HydrophobicContact CE1-CB 3.96Å; L73-N81 HydrophobicContact CD1-CB 4.16Å; L73-C82 WeakPolarHBondContact CA-O 3.42Å
74	V	94.1	Very high	91	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	137.6	-178.7	-165.7	0	0	0	0	110	D57 F58 V72 N81 C82 L122 C130 R131 L132	D57-V74 CarbonylContact O-C 3.54Å; D57-V74 WeakPolarHBondContact O-CA 3.38Å; F58-V74 HydrophobicContact CB-CB 4.38Å; F58-V74 HydrophobicContact CB-CG1 4.2Å; F58-V74 HydrophobicContact CB-CG2 3.99Å; V72-V74 HydrophobicContact CG1-CG2 3.72Å; V74-N81 CarbonylContact O-C 3.58Å; V74-C82 PolarHBondContact N-O 3.48Å; V74-C82 PolarHBondContact O-N 3.42Å; V74-L122 HydrophobicContact CG2-CD1 4.42Å; V74-C130 HydrophobicContact CB-CB 4.09Å; V74-C130 HydrophobicContact CG1-CB 3.81Å; V74-R131 WeakPolarHBondContact CG1-O 3.27Å; V74-L132 HydrophobicContact CB-CD2 4.4Å; V74-L132 HydrophobicContact CG1-CD2 4.21Å; V74-L132 HydrophobicContact CG2-CD2 3.28Å
75	K	92.4	Very high	91	Very high	36 Å²	36	45.3 Å²	45.3	16%	0.157	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	114.2	172	-167.3	169.1	-165.8	65.6	0	109.4	L52 R54 N56 D57 G79 N81	L52-K75 HydrophobicContact CB-CB 4.07Å; L52-K75 HydrophobicContact CB-CD 4.25Å; L52-K75 HydrophobicContact CD1-CB 4.09Å; R54-K75 WeakPolarHBondContact O-CB 3.31Å; R54-K75 WeakPolarHBondContact O-CD 3.39Å; N56-K75 WeakPolarHBondContact CA-O 3.49Å; N56-K75 PolarHBondContact N-O 3.04Å; D57-K75 PolarHBondContact O-N 2.87Å; K75-G79 PolarHBondContact NZ-O 3.4Å; K75-N81 PolarHBondContact NZ-OD1 2.84Å
76	A	89.3	Confident	91.3	Very high	2 Å²	2	40.6 Å²	40.6	2%	0.017	22%	0.218	C	C	.	.			trans	-67.2	163.8	177.5	0	0	0	0	0	111.7	N78 G79 E80 L128 C130	A76-N78 VanDerWaalsContact CB-OD1 3.27Å; A76-N78 WeakPolarHBondContact CB-OD1 3.33Å; A76-N78 PolarHBondContact O-N 3.17Å; A76-G79 PolarHBondContact O-N 3.46Å; A76-E80 WeakPolarHBondContact CB-O 3.42Å; A76-E80 PolarHBondContact N-O 3.07Å; A76-L128 HydrophobicContact CB-CB 4.47Å; A76-C130 VanDerWaalsContact CB-SG 3.54Å
77	D	84.1	Confident	91.6	Very high	105 Å²	105	40.2 Å²	40.2	56%	0.561	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-25.2	179.1	-71.1	-23.8	0	0	0	113.2	N56 G79	N56-D77 PolarHBondContact ND2-OD1 3.19Å; D77-G79 PolarHBondContact O-N 2.94Å
78	N	85	Confident	91.8	Very high	90 Å²	90	37 Å²	37	48%	0.481	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-3	174.1	71.2	-9.3	0	0	0	113.4	A76 E80 L128	A76-N78 VanDerWaalsContact CB-OD1 3.27Å; A76-N78 WeakPolarHBondContact CB-OD1 3.33Å; A76-N78 PolarHBondContact O-N 3.17Å; N78-E80 VanDerWaalsContact ND2-CD 3.31Å; N78-E80 PolarHBondContact ND2-OE2 3.12Å; N78-E80 WeakPolarHBondContact OD1-CB 3.45Å; N78-E80 PolarHBondContact OD1-N 3.3Å; N78-L128 WeakPolarHBondContact ND2-CD2 3.28Å
79	G	85.1	Confident	91.9	Very high	32 Å²	32	36.3 Å²	36.3	33%	0.33	19%	0.187	S	C	.	.	S	Bend	trans	89.4	-7.5	-178.5	0	0	0	0	0	115.1	K75 A76 D77	K75-G79 PolarHBondContact NZ-O 3.4Å; A76-G79 PolarHBondContact O-N 3.46Å; D77-G79 PolarHBondContact O-N 2.94Å
80	E	88.8	Confident	91.7	Very high	101 Å²	101	41.5 Å²	41.5	47%	0.472	22%	0.217	S	C	.	.			trans	-74.8	151.4	175.4	-64.3	178.6	157.4	0	0	111	A76 N78 L128	A76-E80 WeakPolarHBondContact CB-O 3.42Å; A76-E80 PolarHBondContact N-O 3.07Å; N78-E80 VanDerWaalsContact ND2-CD 3.31Å; N78-E80 PolarHBondContact ND2-OE2 3.12Å; N78-E80 WeakPolarHBondContact OD1-CB 3.45Å; N78-E80 PolarHBondContact OD1-N 3.3Å; E80-L128 HydrophobicContact CB-CD1 4.12Å; E80-L128 WeakPolarHBondContact OE2-CD1 3.27Å
81	N	89.7	Confident	91.5	Very high	32 Å²	32	44.1 Å²	44.1	17%	0.171	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	126.8	178.1	-63	-33.5	0	0	0	109.7	E49 L73 V74 K75	E49-N81 WeakPolarHBondContact CB-ND2 3.17Å; E49-N81 HydrophobicContact CG-CB 4.15Å; E49-N81 VanDerWaalsContact CG-ND2 3.34Å; E49-N81 WeakPolarHBondContact CG-ND2 3.06Å; L73-N81 HydrophobicContact CD1-CB 4.16Å; V74-N81 CarbonylContact O-C 3.58Å; K75-N81 PolarHBondContact NZ-OD1 2.84Å
82	C	89.2	Confident	91.4	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.007	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.7	179.1	-69.4	0	0	0	0	110.5	L73 V74 L128 C130	L73-C82 WeakPolarHBondContact CA-O 3.42Å; V74-C82 PolarHBondContact N-O 3.48Å; V74-C82 PolarHBondContact O-N 3.42Å; C82-L128 WeakPolarHBondContact SG-CB 3.4Å; C82-L128 WeakPolarHBondContact SG-CD1 3.37Å; C82-C130 PolarHBondContact SG-SG 3.11Å
83	Q	89.7	Confident	91.4	Very high	54 Å²	54	44.3 Å²	44.3	25%	0.252	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	133.6	172.5	-179.9	166.6	3.7	0	0	110.1	M45 N63 T71	M45-Q83 HydrophobicContact CE-CB 4.13Å; N63-Q83 PolarHBondContact ND2-NE2 3.19Å; T71-Q83 HydrophobicContact CG2-CG 3.37Å; T71-Q83 VanDerWaalsContact CG2-NE2 3.35Å
84	V	91.6	Very high	91.5	Very high	13 Å²	13	44.4 Å²	44.4	8%	0.079	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	105.6	174.7	-171.6	0	0	0	0	108.9	V72 I96	V72-V84 HydrophobicContact CB-CB 4.48Å; V72-V84 PolarHBondContact N-O 2.8Å; V72-V84 PolarHBondContact O-N 2.86Å; V84-I96 HydrophobicContact CG1-CB 4.47Å; V84-I96 HydrophobicContact CG1-CG1 4.45Å; V84-I96 HydrophobicContact CG1-CG2 3.34Å
85	P	93.3	Very high	91.6	Very high	29 Å²	29	47 Å²	47	19%	0.188	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	136.6	177.8	28.4	-32.8	0	0	0	110.6	K69	K69-P85 HydrophobicContact CD-CB 3.93Å
86	I	95.7	Very high	91.6	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.021	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-87	123.3	171.9	-50.4	177.7	0	0	0	107.5	P70 V72 Y94 I96 I108 L111 I112	P70-I86 HydrophobicContact CB-CB 4.3Å; P70-I86 HydrophobicContact CB-CD1 4.37Å; P70-I86 WeakPolarHBondContact O-CB 3.49Å; P70-I86 PolarHBondContact O-N 2.82Å; V72-I86 HydrophobicContact CG2-CD1 3.8Å; V72-I86 HydrophobicContact CG2-CG1 3.87Å; I86-Y94 HydrophobicContact CG2-CD1 3.93Å; I86-I96 HydrophobicContact CG1-CD1 4.39Å; I86-I96 HydrophobicContact CG1-CG1 4.17Å; I86-I108 HydrophobicContact CD1-CD1 4.42Å; I86-I108 HydrophobicContact CD1-CG1 4.41Å; I86-I108 HydrophobicContact CD1-CG2 3.73Å; I86-L111 HydrophobicContact CG2-CD2 3.84Å; I86-I112 HydrophobicContact CD1-CD1 4.15Å
87	Q	95.6	Very high	91.7	Very high	55 Å²	55	49.3 Å²	49.3	26%	0.257	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	154.4	179.8	-54.3	-65.4	-22.9	0	0	110	K69 Y94 W95	K69-Q87 VanDerWaalsContact CE-OE1 3.28Å; Q87-Y94 VanDerWaalsContact O-CA 3.25Å; Q87-Y94 WeakPolarHBondContact O-CA 3.35Å; Q87-W95 HydrophobicContact CB-CD2 3.79Å; Q87-W95 HydrophobicContact CB-CE3 4.44Å; Q87-W95 HydrophobicContact CB-CG 4.1Å; Q87-W95 HydrophobicContact CB-CH2 4.44Å; Q87-W95 HydrophobicContact CB-CZ2 3.75Å; Q87-W95 HydrophobicContact CG-CD2 4.17Å; Q87-W95 HydrophobicContact CG-CE3 4.35Å; Q87-W95 HydrophobicContact CG-CH2 4Å; Q87-W95 HydrophobicContact CG-CZ2 3.76Å; Q87-W95 HydrophobicContact CG-CZ3 4.28Å; Q87-W95 PolarHBondContact N-O 2.84Å; Q87-W95 PolarHBondContact O-N 2.77Å
88	R	95.2	Very high	91.9	Very high	94 Å²	94	51.3 Å²	51.3	36%	0.355	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	131	170.9	-171.1	-174.8	-179.8	-86.3	5.9	108.8	G92 V93 Y94 E502	R88-G92 VanDerWaalsContact CZ-CA 3.43Å; R88-V93 VanDerWaalsContact CA-O 3.3Å; R88-V93 WeakPolarHBondContact CA-O 3.36Å; R88-Y94 HydrophobicContact CB-CD1 4.01Å; R88-Y94 HydrophobicContact CB-CE1 3.88Å; R88-Y94 WeakPolarHBondContact CD-OH 3.45Å; R88-Y94 HydrophobicContact CG-CD1 4.23Å; R88-Y94 HydrophobicContact CG-CE1 3.95Å; R88-Y94 HydrophobicContact CG-CE2 4.4Å; R88-E502 IonicContact CZ-OE1 3.55Å; R88-E502 IonicContact NH2-OE1 3.67Å; R88-E502 PolarHBondContact NH2-OE1 2.8Å; R88-E502 IonicContact NH2-OE2 3.78Å
89	N	94.3	Very high	92.1	Very high	45 Å²	45	52.8 Å²	52.8	24%	0.241	27%	0.274	C	S	.	.			trans	-89.9	174.7	175	72.6	10.6	0	0	0	112.3	C91 G92 V93	N89-C91 PolarHBondContact O-N 3.44Å; N89-C91 WeakPolarHBondContact OD1-CA 3.41Å; N89-C91 WeakPolarHBondContact OD1-CB 3.35Å; N89-C91 PolarHBondContact OD1-N 3.11Å; N89-C91 VanDerWaalsContact OD1-N 3.12Å; N89-G92 PolarHBondContact O-N 2.96Å; N89-G92 PolarHBondContact OD1-N 3.04Å; N89-V93 PolarHBondContact N-O 3.04Å; N89-V93 PolarHBondContact OD1-N 2.83Å
90	D	91.1	Very high	92.4	Very high	164 Å²	164	51.7 Å²	51.7	88%	0.877	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-25.2	-179.4	-63.4	-25.1	0	0	0	113.1	G92	D90-G92 PolarHBondContact O-N 2.8Å
91	C	92.3	Very high	92.6	Very high	70 Å²	70	49.9 Å²	49.9	47%	0.473	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-13.8	174.4	-60.4	0	0	0	0	112.5	N89 R106 L486	N89-C91 PolarHBondContact O-N 3.44Å; N89-C91 WeakPolarHBondContact OD1-CA 3.41Å; N89-C91 WeakPolarHBondContact OD1-CB 3.35Å; N89-C91 PolarHBondContact OD1-N 3.11Å; N89-C91 VanDerWaalsContact OD1-N 3.12Å; C91-R106 VanDerWaalsContact C-NH1 3.33Å; C91-R106 PolarHBondContact O-NH1 3.25Å; C91-L486 WeakPolarHBondContact O-CD1 3.48Å
92	G	92.3	Very high	92.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.282	C	S	.	.			trans	90.3	19.9	-175.7	0	0	0	0	0	115.4	R88 N89 D90 R106	R88-G92 VanDerWaalsContact CZ-CA 3.43Å; N89-G92 PolarHBondContact O-N 2.96Å; N89-G92 PolarHBondContact OD1-N 3.04Å; D90-G92 PolarHBondContact O-N 2.8Å; G92-R106 VanDerWaalsContact O-CD 3.28Å; G92-R106 WeakPolarHBondContact O-CD 3.26Å
93	V	96.4	Very high	92.8	Very high	4 Å²	4	57 Å²	57	2%	0.024	30%	0.303	C	S	.	.			trans	-89.2	129.3	173.5	179	0	0	0	0	110.2	R88 N89 E104 Y105	R88-V93 VanDerWaalsContact CA-O 3.3Å; R88-V93 WeakPolarHBondContact CA-O 3.36Å; N89-V93 PolarHBondContact N-O 3.04Å; N89-V93 PolarHBondContact OD1-N 2.83Å; V93-E104 HydrophobicContact CG2-CB 4.23Å; V93-E104 HydrophobicContact CG2-CG 4.36Å; V93-Y105 CarbonylContact C-O 3.6Å; V93-Y105 WeakPolarHBondContact CA-O 3.21Å
94	Y	97.1	Very high	93	Very high	2 Å²	2	59.6 Å²	59.6	1%	0.008	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	138.1	170.9	-69.3	-83.1	0	0	0	111.7	I86 Q87 R88 Y105 R106 I108 P499 P500 E501	I86-Y94 HydrophobicContact CG2-CD1 3.93Å; Q87-Y94 VanDerWaalsContact O-CA 3.25Å; Q87-Y94 WeakPolarHBondContact O-CA 3.35Å; R88-Y94 HydrophobicContact CB-CD1 4.01Å; R88-Y94 HydrophobicContact CB-CE1 3.88Å; R88-Y94 WeakPolarHBondContact CD-OH 3.45Å; R88-Y94 HydrophobicContact CG-CD1 4.23Å; R88-Y94 HydrophobicContact CG-CE1 3.95Å; R88-Y94 HydrophobicContact CG-CE2 4.4Å; Y94-Y105 PolarHBondContact N-O 2.77Å; Y94-R106 WeakPolarHBondContact CE2-O 3.38Å; Y94-I108 HydrophobicContact CD1-CD1 4.41Å; Y94-I108 HydrophobicContact CD1-CG1 3.86Å; Y94-I108 HydrophobicContact CE1-CD1 4.13Å; Y94-I108 HydrophobicContact CE1-CG1 3.96Å; Y94-I108 HydrophobicContact CG-CG1 4.16Å; Y94-P499 HydrophobicContact CE1-CB 4.22Å; Y94-P499 WeakPolarHBondContact OH-CB 3.17Å; Y94-P500 VanDerWaalsContact OH-C 3.32Å; Y94-P500 PolarHBondContact OH-O 3.37Å; Y94-E501 HydrophobicContact CE2-CG 4.15Å
95	W	95.8	Very high	93.1	Very high	54 Å²	54	61.2 Å²	61.2	21%	0.205	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	156.3	178.6	63	-83.1	0	0	0	111.9	Q87 D97 E98 D100 I101	Q87-W95 HydrophobicContact CB-CD2 3.79Å; Q87-W95 HydrophobicContact CB-CE3 4.44Å; Q87-W95 HydrophobicContact CB-CG 4.1Å; Q87-W95 HydrophobicContact CB-CH2 4.44Å; Q87-W95 HydrophobicContact CB-CZ2 3.75Å; Q87-W95 HydrophobicContact CG-CD2 4.17Å; Q87-W95 HydrophobicContact CG-CE3 4.35Å; Q87-W95 HydrophobicContact CG-CH2 4Å; Q87-W95 HydrophobicContact CG-CZ2 3.76Å; Q87-W95 HydrophobicContact CG-CZ3 4.28Å; Q87-W95 PolarHBondContact N-O 2.84Å; Q87-W95 PolarHBondContact O-N 2.77Å; W95-D97 VanDerWaalsContact CE3-C 3.4Å; W95-E98 HydrophobicContact CH2-CG 4.09Å; W95-E98 HydrophobicContact CZ3-CG 3.87Å; W95-D100 HydrophobicContact CB-CB 3.9Å; W95-I101 HydrophobicContact CB-CG1 4Å; W95-I101 HydrophobicContact CD2-CD1 4.25Å; W95-I101 HydrophobicContact CD2-CG1 4.11Å; W95-I101 HydrophobicContact CG-CD1 4.34Å; W95-I101 HydrophobicContact CG-CG1 3.74Å
96	I	92.9	Very high	93.2	Very high	23 Å²	23	61.9 Å²	61.9	12%	0.118	32%	0.319	C	S	.	.	S	Bend	trans	-113.6	-43.2	171.2	-74.1	164.7	0	0	0	109.5	V72 V84 I86 D100 L111 I112 Y115 L122	V72-I96 HydrophobicContact CG2-CD1 4.13Å; V84-I96 HydrophobicContact CG1-CB 4.47Å; V84-I96 HydrophobicContact CG1-CG1 4.45Å; V84-I96 HydrophobicContact CG1-CG2 3.34Å; I86-I96 HydrophobicContact CG1-CD1 4.39Å; I86-I96 HydrophobicContact CG1-CG1 4.17Å; I96-D100 PolarHBondContact N-OD2 3.49Å; I96-D100 VanDerWaalsContact N-OD2 3.15Å; I96-L111 HydrophobicContact CD1-CD2 4.24Å; I96-L111 HydrophobicContact CD1-CG 4.35Å; I96-L111 HydrophobicContact CG1-CD2 4.16Å; I96-I112 HydrophobicContact CD1-CD1 4.07Å; I96-Y115 HydrophobicContact CB-CE2 4.31Å; I96-Y115 HydrophobicContact CD1-CD2 4.42Å; I96-Y115 HydrophobicContact CD1-CE2 4.28Å; I96-L122 HydrophobicContact CG2-CD2 3.48Å; I96-L122 VanDerWaalsContact CG2-CD2 3.48Å
97	D	89.9	Confident	93.1	Very high	64 Å²	64	61.9 Å²	61.9	34%	0.342	32%	0.319	S	S	.	.	S	Bend	trans	-113.3	146.3	173.5	-179.2	-86.9	0	0	0	109.5	W95 N99 D100 Y115	W95-D97 VanDerWaalsContact CE3-C 3.4Å; D97-N99 PolarHBondContact O-N 2.81Å; D97-N99 VanDerWaalsContact O-N 3.07Å; D97-N99 WeakPolarHBondContact OD1-CB 3.49Å; D97-N99 VanDerWaalsContact OD1-CG 3.3Å; D97-N99 PolarHBondContact OD1-N 3.05Å; D97-N99 PolarHBondContact OD1-ND2 2.69Å; D97-D100 PolarHBondContact N-OD2 3.4Å; D97-D100 VanDerWaalsContact O-CB 3.25Å; D97-D100 WeakPolarHBondContact O-CB 3.37Å; D97-D100 PolarHBondContact O-N 2.95Å; D97-Y115 VanDerWaalsContact CB-OH 3.3Å; D97-Y115 WeakPolarHBondContact CB-OH 3.33Å
98	E	87.9	Confident	93.1	Very high	146 Å²	146	59.2 Å²	59.2	68%	0.682	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-57.6	-27.5	-176.8	-68.5	-175.8	172.2	0	0	112.7	W95 D100 I101	W95-E98 HydrophobicContact CH2-CG 4.09Å; W95-E98 HydrophobicContact CZ3-CG 3.87Å; E98-D100 PolarHBondContact O-N 2.82Å; E98-I101 WeakPolarHBondContact O-CB 3.41Å; E98-I101 WeakPolarHBondContact O-CG1 3.37Å; E98-I101 PolarHBondContact O-N 2.9Å
99	N	89.4	Confident	93	Very high	122 Å²	122	55.5 Å²	55.5	65%	0.652	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-67.7	-19.9	175.6	-61.6	-63.5	0	0	0	113	D97 I101	D97-N99 PolarHBondContact O-N 2.81Å; D97-N99 VanDerWaalsContact O-N 3.07Å; D97-N99 WeakPolarHBondContact OD1-CB 3.49Å; D97-N99 VanDerWaalsContact OD1-CG 3.3Å; D97-N99 PolarHBondContact OD1-N 3.05Å; D97-N99 PolarHBondContact OD1-ND2 2.69Å; N99-I101 VanDerWaalsContact C-N 3.25Å; N99-I101 PolarHBondContact O-N 3.37Å
100	D	91.8	Very high	92.8	Very high	9 Å²	9	54.7 Å²	54.7	5%	0.048	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-73	-20.5	178.1	-52.9	-32.5	0	0	0	111.9	W95 I96 D97 E98 V102 A103 Y105 L111 Y115 K120	W95-D100 HydrophobicContact CB-CB 3.9Å; I96-D100 PolarHBondContact N-OD2 3.49Å; I96-D100 VanDerWaalsContact N-OD2 3.15Å; D97-D100 PolarHBondContact N-OD2 3.4Å; D97-D100 VanDerWaalsContact O-CB 3.25Å; D97-D100 WeakPolarHBondContact O-CB 3.37Å; D97-D100 PolarHBondContact O-N 2.95Å; E98-D100 PolarHBondContact O-N 2.82Å; D100-V102 PolarHBondContact O-N 3.28Å; D100-A103 WeakPolarHBondContact O-CB 3.32Å; D100-A103 PolarHBondContact O-N 2.83Å; D100-Y105 HydrophobicContact CB-CE2 4.49Å; D100-L111 HydrophobicContact CB-CD1 4.08Å; D100-Y115 PolarHBondContact OD1-OH 3.35Å; D100-Y115 VanDerWaalsContact OD2-CE2 3.25Å; D100-Y115 WeakPolarHBondContact OD2-CE2 3.49Å; D100-Y115 PolarHBondContact OD2-OH 3.01Å; D100-K120 IonicContact OD1-NZ 2.72Å; D100-K120 PolarHBondContact OD1-NZ 2.66Å
101	I	93.8	Very high	92.9	Very high	62 Å²	62	46.9 Å²	46.9	32%	0.318	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-58	-36.3	179.5	-62.8	172.6	0	0	0	110.8	W95 E98 N99 A103 E104	W95-I101 HydrophobicContact CB-CG1 4Å; W95-I101 HydrophobicContact CD2-CD1 4.25Å; W95-I101 HydrophobicContact CD2-CG1 4.11Å; W95-I101 HydrophobicContact CG-CD1 4.34Å; W95-I101 HydrophobicContact CG-CG1 3.74Å; E98-I101 WeakPolarHBondContact O-CB 3.41Å; E98-I101 WeakPolarHBondContact O-CG1 3.37Å; E98-I101 PolarHBondContact O-N 2.9Å; N99-I101 VanDerWaalsContact C-N 3.25Å; N99-I101 PolarHBondContact O-N 3.37Å; I101-A103 PolarHBondContact O-N 3.33Å; I101-E104 PolarHBondContact O-N 3.26Å; I101-E104 VanDerWaalsContact O-N 3.1Å
102	V	92.7	Very high	92.9	Very high	128 Å²	128	43.6 Å²	43.6	78%	0.776	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-65.4	-27.6	-179.4	-176.3	0	0	0	0	112.3	D100 E104	D100-V102 PolarHBondContact O-N 3.28Å; V102-E104 VanDerWaalsContact C-N 3.27Å
103	A	90.6	Very high	92.7	Very high	54 Å²	54	45.8 Å²	45.8	45%	0.446	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-80.6	-8.9	177.9	0	0	0	0	0	113.1	D100 I101 Y105	D100-A103 WeakPolarHBondContact O-CB 3.32Å; D100-A103 PolarHBondContact O-N 2.83Å; I101-A103 PolarHBondContact O-N 3.33Å; A103-Y105 VanDerWaalsContact C-N 3.33Å; A103-Y105 HydrophobicContact CB-CD2 3.91Å; A103-Y105 HydrophobicContact CB-CE1 4.27Å; A103-Y105 HydrophobicContact CB-CE2 3.41Å; A103-Y105 VanDerWaalsContact CB-CE2 3.41Å; A103-Y105 PolarHBondContact O-N 3.21Å
104	E	93	Very high	92.3	Very high	110 Å²	110	47.2 Å²	47.2	51%	0.514	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	41.6	176.1	-61.6	-162.7	-174.2	0	0	115.2	V93 I101 V102 R106	V93-E104 HydrophobicContact CG2-CB 4.23Å; V93-E104 HydrophobicContact CG2-CG 4.36Å; I101-E104 PolarHBondContact O-N 3.26Å; I101-E104 VanDerWaalsContact O-N 3.1Å; V102-E104 VanDerWaalsContact C-N 3.27Å; E104-R106 WeakPolarHBondContact O-CG 3.48Å; E104-R106 PolarHBondContact O-N 3.21Å; E104-R106 VanDerWaalsContact O-N 3.11Å; E104-R106 PolarHBondContact O-NE 2.97Å; E104-R106 IonicContact OE2-CZ 2.79Å; E104-R106 IonicContact OE2-NH2 3.6Å; E104-R106 PolarHBondContact OE2-NH2 3.46Å
105	Y	94.4	Very high	92	Very high	46 Å²	46	47.2 Å²	47.2	18%	0.18	25%	0.245	C	C	.	.			trans	-60.4	116.6	176.9	-61.6	-64.5	0	0	0	111.6	V93 Y94 D100 A103 P110 L111 S114	V93-Y105 CarbonylContact C-O 3.6Å; V93-Y105 WeakPolarHBondContact CA-O 3.21Å; Y94-Y105 PolarHBondContact N-O 2.77Å; D100-Y105 HydrophobicContact CB-CE2 4.49Å; A103-Y105 VanDerWaalsContact C-N 3.33Å; A103-Y105 HydrophobicContact CB-CD2 3.91Å; A103-Y105 HydrophobicContact CB-CE1 4.27Å; A103-Y105 HydrophobicContact CB-CE2 3.41Å; A103-Y105 VanDerWaalsContact CB-CE2 3.41Å; A103-Y105 PolarHBondContact O-N 3.21Å; Y105-P110 HydrophobicContact CD1-CB 3.78Å; Y105-P110 HydrophobicContact CE1-CB 4.16Å; Y105-L111 HydrophobicContact CD1-CB 4.45Å; Y105-L111 HydrophobicContact CD2-CB 3.9Å; Y105-L111 HydrophobicContact CD2-CD1 3.59Å; Y105-L111 HydrophobicContact CD2-CG 4.32Å; Y105-L111 HydrophobicContact CE2-CB 4.49Å; Y105-L111 HydrophobicContact CE2-CD1 3.86Å; Y105-L111 HydrophobicContact CG-CB 3.86Å; Y105-L111 HydrophobicContact CG-CD1 4.41Å; Y105-S114 WeakPolarHBondContact OH-CB 3.06Å; Y105-S114 PolarHBondContact OH-OG 3.35Å
106	R	94.6	Very high	91.6	Very high	44 Å²	44	46.5 Å²	46.5	17%	0.166	25%	0.251	C	S	.	.			trans	-97.9	-2.9	179.3	-52.8	-56	179.5	150.7	-0.6	114.2	C91 G92 Y94 E104 M488 E502	C91-R106 VanDerWaalsContact C-NH1 3.33Å; C91-R106 PolarHBondContact O-NH1 3.25Å; G92-R106 VanDerWaalsContact O-CD 3.28Å; G92-R106 WeakPolarHBondContact O-CD 3.26Å; Y94-R106 WeakPolarHBondContact CE2-O 3.38Å; E104-R106 WeakPolarHBondContact O-CG 3.48Å; E104-R106 PolarHBondContact O-N 3.21Å; E104-R106 VanDerWaalsContact O-N 3.11Å; E104-R106 PolarHBondContact O-NE 2.97Å; E104-R106 IonicContact OE2-CZ 2.79Å; E104-R106 IonicContact OE2-NH2 3.6Å; E104-R106 PolarHBondContact OE2-NH2 3.46Å; R106-M488 HydrophobicContact CG-CE 4.34Å; R106-E502 HydrophobicContact CB-CB 4.36Å; R106-E502 WeakPolarHBondContact CB-O 3.49Å; R106-E502 PolarHBondContact O-N 2.72Å
107	S	94.5	Very high	91	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.021	26%	0.264	C	S	.	.	S	Bend	trans	-134.5	151.3	172.6	166.5	0	0	0	0	108.9	E109 P110 E501	S107-E109 VanDerWaalsContact C-N 3.3Å; S107-E109 PolarHBondContact O-N 3.16Å; S107-E109 PolarHBondContact OG-N 2.58Å; S107-P110 WeakPolarHBondContact O-CD 3.49Å; S107-E501 WeakPolarHBondContact CA-OE1 3.28Å; S107-E501 WeakPolarHBondContact CB-OE1 3.44Å; S107-E501 PolarHBondContact OG-OE1 2.83Å
108	I	95.5	Very high	90.8	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.8	-33.8	-178.9	-70.5	172.6	0	0	0	110.9	V33 I60 P70 I86 Y94 L111 I112 P499 E501	V33-I108 HydrophobicContact CB-CD1 4.24Å; V33-I108 HydrophobicContact CG2-CD1 3.95Å; V33-I108 HydrophobicContact CG2-CG2 4.49Å; I60-I108 HydrophobicContact CD1-CG2 3.88Å; P70-I108 HydrophobicContact CB-CD1 3.85Å; P70-I108 HydrophobicContact CG-CD1 4.17Å; I86-I108 HydrophobicContact CD1-CD1 4.42Å; I86-I108 HydrophobicContact CD1-CG1 4.41Å; I86-I108 HydrophobicContact CD1-CG2 3.73Å; Y94-I108 HydrophobicContact CD1-CD1 4.41Å; Y94-I108 HydrophobicContact CD1-CG1 3.86Å; Y94-I108 HydrophobicContact CE1-CD1 4.13Å; Y94-I108 HydrophobicContact CE1-CG1 3.96Å; Y94-I108 HydrophobicContact CG-CG1 4.16Å; I108-L111 WeakPolarHBondContact O-CB 3.29Å; I108-L111 PolarHBondContact O-N 2.84Å; I108-I112 HydrophobicContact CG2-CG1 3.8Å; I108-I112 WeakPolarHBondContact O-CG1 3.5Å; I108-I112 PolarHBondContact O-N 3.21Å; I108-P499 HydrophobicContact CD1-CB 4.38Å; I108-P499 HydrophobicContact CD1-CG 3.65Å; I108-E501 PolarHBondContact N-OE1 3.34Å
109	E	92.5	Very high	90.5	Very high	15 Å²	15	46.2 Å²	46.2	7%	0.07	25%	0.253	C	S	.	.	H	α-helix	trans	-66.3	-47.1	-172.9	-177.1	-103.6	-172.9	0	0	114	C31 L36 S107 L111 I112 R113	C31-E109 HydrophobicContact CB-CB 4.31Å; C31-E109 HydrophobicContact CB-CG 4.02Å; C31-E109 PolarHBondContact N-OE2 2.8Å; C31-E109 WeakPolarHBondContact O-CB 3.44Å; L36-E109 HydrophobicContact CD1-CB 4.2Å; L36-E109 HydrophobicContact CD2-CB 3.61Å; L36-E109 HydrophobicContact CD2-CG 3.39Å; L36-E109 HydrophobicContact CG-CB 4.46Å; S107-E109 VanDerWaalsContact C-N 3.3Å; S107-E109 PolarHBondContact O-N 3.16Å; S107-E109 PolarHBondContact OG-N 2.58Å; E109-L111 VanDerWaalsContact C-N 3.31Å; E109-L111 PolarHBondContact O-N 3.08Å; E109-I112 PolarHBondContact O-N 2.94Å; E109-R113 VanDerWaalsContact CD-CZ 3.45Å; E109-R113 VanDerWaalsContact O-CB 3.29Å; E109-R113 WeakPolarHBondContact O-CB 3.4Å; E109-R113 PolarHBondContact O-N 3.32Å; E109-R113 IonicContact OE1-CZ 3.64Å; E109-R113 IonicContact OE1-NE 3.64Å; E109-R113 PolarHBondContact OE1-NE 3.21Å; E109-R113 IonicContact OE1-NH2 3.53Å; E109-R113 PolarHBondContact OE1-NH2 2.8Å; E109-R113 IonicContact OE2-CZ 3.74Å; E109-R113 VanDerWaalsContact OE2-CZ 3.31Å; E109-R113 IonicContact OE2-NH1 3.88Å; E109-R113 IonicContact OE2-NH2 2.85Å; E109-R113 PolarHBondContact OE2-NH2 3.23Å
110	P	90.1	Very high	90.3	Very high	29 Å²	29	43.5 Å²	43.5	19%	0.188	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-37.4	173.8	-27.2	36.7	0	0	0	114.1	P30 Y105 S107 S114	P30-P110 HydrophobicContact CB-CG 3.95Å; Y105-P110 HydrophobicContact CD1-CB 3.78Å; Y105-P110 HydrophobicContact CE1-CB 4.16Å; S107-P110 WeakPolarHBondContact O-CD 3.49Å; P110-S114 WeakPolarHBondContact O-CB 3.48Å; P110-S114 PolarHBondContact O-N 3.38Å
111	L	93	Very high	90	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-54.3	174.7	170.2	63.5	0	0	0	110.3	I86 I96 D100 Y105 I108 E109 R113 S114 Y115	I86-L111 HydrophobicContact CG2-CD2 3.84Å; I96-L111 HydrophobicContact CD1-CD2 4.24Å; I96-L111 HydrophobicContact CD1-CG 4.35Å; I96-L111 HydrophobicContact CG1-CD2 4.16Å; D100-L111 HydrophobicContact CB-CD1 4.08Å; Y105-L111 HydrophobicContact CD1-CB 4.45Å; Y105-L111 HydrophobicContact CD2-CB 3.9Å; Y105-L111 HydrophobicContact CD2-CD1 3.59Å; Y105-L111 HydrophobicContact CD2-CG 4.32Å; Y105-L111 HydrophobicContact CE2-CB 4.49Å; Y105-L111 HydrophobicContact CE2-CD1 3.86Å; Y105-L111 HydrophobicContact CG-CB 3.86Å; Y105-L111 HydrophobicContact CG-CD1 4.41Å; I108-L111 WeakPolarHBondContact O-CB 3.29Å; I108-L111 PolarHBondContact O-N 2.84Å; E109-L111 VanDerWaalsContact C-N 3.31Å; E109-L111 PolarHBondContact O-N 3.08Å; L111-R113 VanDerWaalsContact C-N 3.32Å; L111-R113 PolarHBondContact O-N 3.02Å; L111-S114 VanDerWaalsContact O-CB 3.29Å; L111-S114 WeakPolarHBondContact O-CB 3.34Å; L111-S114 PolarHBondContact O-N 3.19Å; L111-S114 VanDerWaalsContact O-N 3.16Å; L111-Y115 HydrophobicContact CD1-CD2 4.07Å; L111-Y115 HydrophobicContact CD1-CE2 3.72Å; L111-Y115 WeakPolarHBondContact O-CD2 3.24Å; L111-Y115 PolarHBondContact O-N 3.24Å
112	I	92.6	Very high	89.4	Confident	1 Å²	1	45.7 Å²	45.7	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-39.7	-177.5	-63.3	-73.3	0	0	0	111.2	Y38 F58 I60 V72 I86 I96 I108 E109 S114 Y115 A116 L132	Y38-I112 HydrophobicContact CE2-CG2 4.04Å; F58-I112 HydrophobicContact CE2-CG2 3.9Å; F58-I112 HydrophobicContact CZ-CG2 4.39Å; I60-I112 HydrophobicContact CD1-CB 4.38Å; I60-I112 HydrophobicContact CD1-CD1 3.87Å; I60-I112 HydrophobicContact CD1-CG1 3.61Å; I60-I112 HydrophobicContact CD1-CG2 4.24Å; V72-I112 HydrophobicContact CG2-CD1 3.41Å; V72-I112 VanDerWaalsContact CG2-CD1 3.41Å; I86-I112 HydrophobicContact CD1-CD1 4.15Å; I96-I112 HydrophobicContact CD1-CD1 4.07Å; I108-I112 HydrophobicContact CG2-CG1 3.8Å; I108-I112 WeakPolarHBondContact O-CG1 3.5Å; I108-I112 PolarHBondContact O-N 3.21Å; E109-I112 PolarHBondContact O-N 2.94Å; I112-S114 VanDerWaalsContact C-N 3.31Å; I112-S114 PolarHBondContact O-N 3.14Å; I112-Y115 PolarHBondContact O-N 3.32Å; I112-A116 PolarHBondContact O-N 3.28Å; I112-L132 HydrophobicContact CD1-CD1 4.12Å; I112-L132 HydrophobicContact CG2-CD1 4.08Å
113	R	87.6	Confident	88.6	Confident	45 Å²	45	45.7 Å²	45.7	17%	0.17	23%	0.234	C	C	.	.	H	α-helix	trans	-61.1	-41.2	175.6	-164.8	-166.5	-53.6	117.3	-16.1	111.4	Y19 E109 L111 Y115 A116 F117	Y19-R113 PolarHBondContact OH-NH2 2.99Å; E109-R113 VanDerWaalsContact CD-CZ 3.45Å; E109-R113 VanDerWaalsContact O-CB 3.29Å; E109-R113 WeakPolarHBondContact O-CB 3.4Å; E109-R113 PolarHBondContact O-N 3.32Å; E109-R113 IonicContact OE1-CZ 3.64Å; E109-R113 IonicContact OE1-NE 3.64Å; E109-R113 PolarHBondContact OE1-NE 3.21Å; E109-R113 IonicContact OE1-NH2 3.53Å; E109-R113 PolarHBondContact OE1-NH2 2.8Å; E109-R113 IonicContact OE2-CZ 3.74Å; E109-R113 VanDerWaalsContact OE2-CZ 3.31Å; E109-R113 IonicContact OE2-NH1 3.88Å; E109-R113 IonicContact OE2-NH2 2.85Å; E109-R113 PolarHBondContact OE2-NH2 3.23Å; L111-R113 VanDerWaalsContact C-N 3.32Å; L111-R113 PolarHBondContact O-N 3.02Å; R113-Y115 VanDerWaalsContact C-N 3.34Å; R113-Y115 PolarHBondContact O-N 3.2Å; R113-A116 PolarHBondContact O-N 3.28Å; R113-F117 VanDerWaalsContact O-CB 3.25Å; R113-F117 WeakPolarHBondContact O-CB 3.18Å; R113-F117 PolarHBondContact O-N 3.18Å
114	S	88.7	Confident	87.7	Confident	34 Å²	34	43.6 Å²	43.6	24%	0.238	22%	0.216	C	C	.	.	H	α-helix	trans	-57.4	-47.2	176.3	-172.8	0	0	0	0	111.3	Y105 P110 L111 I112 T118	Y105-S114 WeakPolarHBondContact OH-CB 3.06Å; Y105-S114 PolarHBondContact OH-OG 3.35Å; P110-S114 WeakPolarHBondContact O-CB 3.48Å; P110-S114 PolarHBondContact O-N 3.38Å; L111-S114 VanDerWaalsContact O-CB 3.29Å; L111-S114 WeakPolarHBondContact O-CB 3.34Å; L111-S114 PolarHBondContact O-N 3.19Å; L111-S114 VanDerWaalsContact O-N 3.16Å; I112-S114 VanDerWaalsContact C-N 3.31Å; I112-S114 PolarHBondContact O-N 3.14Å; S114-T118 WeakPolarHBondContact O-CB 3.17Å; S114-T118 VanDerWaalsContact O-CG2 3.32Å; S114-T118 WeakPolarHBondContact O-CG2 3.27Å; S114-T118 PolarHBondContact O-N 3.07Å; S114-T118 PolarHBondContact O-OG1 3.33Å
115	Y	90	Very high	86.5	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	-63.1	-47.7	176.2	-86.3	-90.6	0	0	0	113	I96 D97 D100 L111 I112 R113 F117 N119 K120 L122 L132	I96-Y115 HydrophobicContact CB-CE2 4.31Å; I96-Y115 HydrophobicContact CD1-CD2 4.42Å; I96-Y115 HydrophobicContact CD1-CE2 4.28Å; D97-Y115 VanDerWaalsContact CB-OH 3.3Å; D97-Y115 WeakPolarHBondContact CB-OH 3.33Å; D100-Y115 PolarHBondContact OD1-OH 3.35Å; D100-Y115 VanDerWaalsContact OD2-CE2 3.25Å; D100-Y115 WeakPolarHBondContact OD2-CE2 3.49Å; D100-Y115 PolarHBondContact OD2-OH 3.01Å; L111-Y115 HydrophobicContact CD1-CD2 4.07Å; L111-Y115 HydrophobicContact CD1-CE2 3.72Å; L111-Y115 WeakPolarHBondContact O-CD2 3.24Å; L111-Y115 PolarHBondContact O-N 3.24Å; I112-Y115 PolarHBondContact O-N 3.32Å; R113-Y115 VanDerWaalsContact C-N 3.34Å; R113-Y115 PolarHBondContact O-N 3.2Å; Y115-F117 PolarHBondContact O-N 3Å; Y115-N119 WeakPolarHBondContact O-CA 3.36Å; Y115-N119 PolarHBondContact O-N 3.28Å; Y115-N119 VanDerWaalsContact O-N 3.09Å; Y115-K120 HydrophobicContact CD1-CB 3.89Å; Y115-K120 HydrophobicContact CD1-CD 4.01Å; Y115-K120 HydrophobicContact CD1-CG 4.02Å; Y115-K120 HydrophobicContact CE1-CB 4.2Å; Y115-K120 HydrophobicContact CE1-CD 3.51Å; Y115-K120 HydrophobicContact CE1-CG 3.79Å; Y115-K120 PolarHBondContact O-N 3.33Å; Y115-K120 PolarHBondContact OH-NZ 2.72Å; Y115-L122 HydrophobicContact CD1-CD1 4.35Å; Y115-L122 HydrophobicContact CD1-CD2 3.55Å; Y115-L122 HydrophobicContact CD1-CG 3.78Å; Y115-L122 HydrophobicContact CE1-CD2 3.2Å; Y115-L122 HydrophobicContact CE1-CG 3.87Å; Y115-L122 HydrophobicContact CG-CD2 4.45Å; Y115-L132 HydrophobicContact CG-CD1 4.5Å
116	A	87.1	Confident	85.1	Confident	39 Å²	39	49.8 Å²	49.8	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-63.4	-43.3	-178.7	0	0	0	0	0	111.9	I112 R113 L132	I112-A116 PolarHBondContact O-N 3.28Å; R113-A116 PolarHBondContact O-N 3.28Å; A116-L132 WeakPolarHBondContact CA-O 3.22Å; A116-L132 HydrophobicContact CB-CB 4.18Å; A116-L132 VanDerWaalsContact CB-O 3.27Å; A116-L132 WeakPolarHBondContact CB-O 3.15Å
117	F	82.1	Confident	84	Confident	90 Å²	90	55.3 Å²	55.3	40%	0.395	28%	0.277	S	S	.	.	H	α-helix	trans	-71.5	-49.2	-179.2	176.1	-94.8	0	0	0	112.9	P23 Q24 R113 Y115 N119	P23-F117 HydrophobicContact CB-CD2 3.2Å; P23-F117 HydrophobicContact CB-CE2 3.29Å; P23-F117 HydrophobicContact CB-CG 4.19Å; P23-F117 HydrophobicContact CB-CZ 4.35Å; P23-F117 HydrophobicContact CG-CD2 4.06Å; P23-F117 HydrophobicContact CG-CE2 3.74Å; Q24-F117 HydrophobicContact CG-CD1 3.44Å; Q24-F117 VanDerWaalsContact CG-CD1 3.44Å; Q24-F117 HydrophobicContact CG-CE1 3.14Å; Q24-F117 HydrophobicContact CG-CE2 4.25Å; Q24-F117 HydrophobicContact CG-CG 4.14Å; Q24-F117 HydrophobicContact CG-CZ 3.55Å; R113-F117 VanDerWaalsContact O-CB 3.25Å; R113-F117 WeakPolarHBondContact O-CB 3.18Å; R113-F117 PolarHBondContact O-N 3.18Å; Y115-F117 PolarHBondContact O-N 3Å; F117-N119 PolarHBondContact O-N 2.6Å; F117-N119 VanDerWaalsContact O-N 3.17Å
118	T	84.1	Confident	83	Confident	70 Å²	70	56.6 Å²	56.6	43%	0.429	28%	0.283	S	S	.	.	H	α-helix	trans	-71.5	-8	-179	58.7	0	0	0	0	112.4	S114 K120	S114-T118 WeakPolarHBondContact O-CB 3.17Å; S114-T118 VanDerWaalsContact O-CG2 3.32Å; S114-T118 WeakPolarHBondContact O-CG2 3.27Å; S114-T118 PolarHBondContact O-N 3.07Å; S114-T118 PolarHBondContact O-OG1 3.33Å; T118-K120 PolarHBondContact O-N 3.22Å; T118-K120 VanDerWaalsContact O-N 3.14Å; T118-K120 WeakPolarHBondContact OG1-CB 3.39Å; T118-K120 PolarHBondContact OG1-N 3.04Å
119	N	83.4	Confident	82.2	Confident	67 Å²	67	60.8 Å²	60.8	36%	0.358	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	32.7	-172.5	-161.2	23.9	0	0	0	111.4	Y115 F117 K121 R131	Y115-N119 WeakPolarHBondContact O-CA 3.36Å; Y115-N119 PolarHBondContact O-N 3.28Å; Y115-N119 VanDerWaalsContact O-N 3.09Å; F117-N119 PolarHBondContact O-N 2.6Å; F117-N119 VanDerWaalsContact O-N 3.17Å; N119-K121 PolarHBondContact O-N 2.66Å; N119-R131 WeakPolarHBondContact OD1-CD 3.2Å; N119-R131 WeakPolarHBondContact OD1-CG 3.49Å
120	K	85	Confident	81.8	Confident	66 Å²	66	60.1 Å²	60.1	29%	0.287	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-62.8	131.7	-180	-178.5	177.3	175	-164.9	0	107.9	D100 Y115 T118	D100-K120 IonicContact OD1-NZ 2.72Å; D100-K120 PolarHBondContact OD1-NZ 2.66Å; Y115-K120 HydrophobicContact CD1-CB 3.89Å; Y115-K120 HydrophobicContact CD1-CD 4.01Å; Y115-K120 HydrophobicContact CD1-CG 4.02Å; Y115-K120 HydrophobicContact CE1-CB 4.2Å; Y115-K120 HydrophobicContact CE1-CD 3.51Å; Y115-K120 HydrophobicContact CE1-CG 3.79Å; Y115-K120 PolarHBondContact O-N 3.33Å; Y115-K120 PolarHBondContact OH-NZ 2.72Å; T118-K120 PolarHBondContact O-N 3.22Å; T118-K120 VanDerWaalsContact O-N 3.14Å; T118-K120 WeakPolarHBondContact OG1-CB 3.39Å; T118-K120 PolarHBondContact OG1-N 3.04Å
121	K	83.9	Confident	81.8	Confident	112 Å²	112	62.8 Å²	62.8	49%	0.487	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-73.5	132.6	177.5	-65	-175.5	-179.7	-176.9	0	109	N119 L129 C130 R131	N119-K121 PolarHBondContact O-N 2.66Å; K121-L129 HydrophobicContact CB-CD2 4.15Å; K121-L129 HydrophobicContact CD-CB 4.46Å; K121-L129 HydrophobicContact CD-CD1 4.24Å; K121-L129 HydrophobicContact CD-CD2 4.13Å; K121-C130 WeakPolarHBondContact CA-O 3.44Å; K121-R131 HydrophobicContact CG-CG 4.44Å
122	L	82.6	Confident	81.6	Confident	5 Å²	5	62.8 Å²	62.8	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	125.9	167.5	-71.4	166	0	0	0	107.6	V74 I96 Y115 L129 C130 L132	V74-L122 HydrophobicContact CG2-CD1 4.42Å; I96-L122 HydrophobicContact CG2-CD2 3.48Å; I96-L122 VanDerWaalsContact CG2-CD2 3.48Å; Y115-L122 HydrophobicContact CD1-CD1 4.35Å; Y115-L122 HydrophobicContact CD1-CD2 3.55Å; Y115-L122 HydrophobicContact CD1-CG 3.78Å; Y115-L122 HydrophobicContact CE1-CD2 3.2Å; Y115-L122 HydrophobicContact CE1-CG 3.87Å; Y115-L122 HydrophobicContact CG-CD2 4.45Å; L122-L129 WeakPolarHBondContact O-CA 3.24Å; L122-C130 HydrophobicContact CB-CB 4.37Å; L122-C130 PolarHBondContact N-O 3.2Å; L122-C130 PolarHBondContact O-N 3.03Å; L122-L132 HydrophobicContact CD1-CD1 4.06Å; L122-L132 HydrophobicContact CD1-CD2 3.5Å; L122-L132 VanDerWaalsContact CD1-CD2 3.5Å; L122-L132 HydrophobicContact CD1-CG 3.63Å
123	E	74.8	Confident	81.4	Confident	127 Å²	127	65.2 Å²	65.2	59%	0.593	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	116.7	167	-169.3	170.5	-178.7	0	0	107.4	L128 L129	E123-L128 WeakPolarHBondContact CA-O 3.46Å; E123-L129 HydrophobicContact CB-CD2 4.38Å
124	S	72.2	Confident	81.5	Confident	10 Å²	10	66.4 Å²	66.4	7%	0.07	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-75.2	168.5	173.7	72.6	0	0	0	0	111	Q126 K127 L128	S124-Q126 PolarHBondContact O-N 2.61Å; S124-Q126 PolarHBondContact OG-N 2.7Å; S124-K127 WeakPolarHBondContact O-CA 3.36Å; S124-K127 PolarHBondContact O-N 2.69Å; S124-L128 PolarHBondContact N-O 3.16Å; S124-L128 WeakPolarHBondContact OG-CB 3.26Å; S124-L128 PolarHBondContact OG-N 3.04Å
125	D	67.1	Low	81.5	Confident	152 Å²	152	66.2 Å²	66.2	81%	0.813	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-24.6	172.7	-65.4	-24.6	0	0	0	112.8	K127	D125-K127 PolarHBondContact O-N 3.2Å
126	Q	66.2	Low	81.6	Confident	134 Å²	134	67.4 Å²	67.4	63%	0.626	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	7.6	176	-62.7	176.9	-9.6	0	0	113.1	S124 L128	S124-Q126 PolarHBondContact O-N 2.61Å; S124-Q126 PolarHBondContact OG-N 2.7Å; Q126-L128 HydrophobicContact CB-CD1 4.14Å; Q126-L128 HydrophobicContact CB-CG 4.19Å; Q126-L128 PolarHBondContact O-N 3.2Å
127	K	70.7	Confident	81.6	Confident	161 Å²	161	67 Å²	67	70%	0.7	33%	0.331	S	S	*	.			trans	58.6	26.5	-175.7	-55.4	-173.3	176.8	-175.8	0	114.1	S124 D125	S124-K127 WeakPolarHBondContact O-CA 3.36Å; S124-K127 PolarHBondContact O-N 2.69Å; D125-K127 PolarHBondContact O-N 3.2Å
128	L	74	Confident	81.9	Confident	30 Å²	30	62.9 Å²	62.9	16%	0.157	31%	0.313	C	S	.	.			trans	-85.1	134.7	173.7	-64.1	169.6	0	0	0	108.8	A76 N78 E80 C82 E123 S124 Q126	A76-L128 HydrophobicContact CB-CB 4.47Å; N78-L128 WeakPolarHBondContact ND2-CD2 3.28Å; E80-L128 HydrophobicContact CB-CD1 4.12Å; E80-L128 WeakPolarHBondContact OE2-CD1 3.27Å; C82-L128 WeakPolarHBondContact SG-CB 3.4Å; C82-L128 WeakPolarHBondContact SG-CD1 3.37Å; E123-L128 WeakPolarHBondContact CA-O 3.46Å; S124-L128 PolarHBondContact N-O 3.16Å; S124-L128 WeakPolarHBondContact OG-CB 3.26Å; S124-L128 PolarHBondContact OG-N 3.04Å; Q126-L128 HydrophobicContact CB-CD1 4.14Å; Q126-L128 HydrophobicContact CB-CG 4.19Å; Q126-L128 PolarHBondContact O-N 3.2Å
129	L	77.8	Confident	81.8	Confident	88 Å²	88	62 Å²	62	46%	0.461	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	116.2	177.4	-68.3	170.3	0	0	0	109.6	K121 L122 E123	K121-L129 HydrophobicContact CB-CD2 4.15Å; K121-L129 HydrophobicContact CD-CB 4.46Å; K121-L129 HydrophobicContact CD-CD1 4.24Å; K121-L129 HydrophobicContact CD-CD2 4.13Å; L122-L129 WeakPolarHBondContact O-CA 3.24Å; E123-L129 HydrophobicContact CB-CD2 4.38Å
130	C	84.7	Confident	81.6	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	156.6	-177.7	-64.7	0	0	0	0	111.1	V74 A76 C82 K121 L122	V74-C130 HydrophobicContact CB-CB 4.09Å; V74-C130 HydrophobicContact CG1-CB 3.81Å; A76-C130 VanDerWaalsContact CB-SG 3.54Å; C82-C130 PolarHBondContact SG-SG 3.11Å; K121-C130 WeakPolarHBondContact CA-O 3.44Å; L122-C130 HydrophobicContact CB-CB 4.37Å; L122-C130 PolarHBondContact N-O 3.2Å; L122-C130 PolarHBondContact O-N 3.03Å
131	R	89.3	Confident	81.4	Confident	85 Å²	85	61.9 Å²	61.9	32%	0.321	31%	0.31	S	S	.	.			trans	-129.8	144.5	172.6	-70.5	161	163.1	169.9	-1.3	110.2	N56 V74 N119 K121 S133	N56-R131 WeakPolarHBondContact CB-O 3.42Å; N56-R131 WeakPolarHBondContact OD1-CB 3.4Å; N56-R131 PolarHBondContact OD1-N 3.18Å; N56-R131 PolarHBondContact OD1-O 3.25Å; V74-R131 WeakPolarHBondContact CG1-O 3.27Å; N119-R131 WeakPolarHBondContact OD1-CD 3.2Å; N119-R131 WeakPolarHBondContact OD1-CG 3.49Å; K121-R131 HydrophobicContact CG-CG 4.44Å; R131-S133 PolarHBondContact O-N 3Å
132	L	90.4	Very high	81	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.302	C	S	.	.			trans	-87.1	80.5	174.8	-54.6	-169.3	0	0	0	109.1	F58 V72 V74 I112 Y115 A116 L122	F58-L132 HydrophobicContact CB-CD2 3.77Å; F58-L132 HydrophobicContact CD1-CB 3.79Å; F58-L132 HydrophobicContact CD1-CD2 4.25Å; F58-L132 HydrophobicContact CD2-CB 4.48Å; F58-L132 HydrophobicContact CD2-CD2 4.17Å; F58-L132 HydrophobicContact CE1-CB 3.79Å; F58-L132 HydrophobicContact CG-CB 4.13Å; F58-L132 HydrophobicContact CG-CD2 3.82Å; F58-L132 HydrophobicContact CG-CG 4.47Å; F58-L132 HydrophobicContact CZ-CB 4.16Å; V72-L132 HydrophobicContact CG1-CD1 4.34Å; V72-L132 HydrophobicContact CG1-CD2 3.73Å; V74-L132 HydrophobicContact CB-CD2 4.4Å; V74-L132 HydrophobicContact CG1-CD2 4.21Å; V74-L132 HydrophobicContact CG2-CD2 3.28Å; I112-L132 HydrophobicContact CD1-CD1 4.12Å; I112-L132 HydrophobicContact CG2-CD1 4.08Å; Y115-L132 HydrophobicContact CG-CD1 4.5Å; A116-L132 WeakPolarHBondContact CA-O 3.22Å; A116-L132 HydrophobicContact CB-CB 4.18Å; A116-L132 VanDerWaalsContact CB-O 3.27Å; A116-L132 WeakPolarHBondContact CB-O 3.15Å; L122-L132 HydrophobicContact CD1-CD1 4.06Å; L122-L132 HydrophobicContact CD1-CD2 3.5Å; L122-L132 VanDerWaalsContact CD1-CD2 3.5Å; L122-L132 HydrophobicContact CD1-CG 3.63Å
133	S	87.5	Confident	81	Confident	53 Å²	53	62.6 Å²	62.6	37%	0.371	32%	0.318	S	S	.	.			trans	-102	-42.7	-175.3	-56	0	0	0	0	113	N56 R131 P135	N56-S133 PolarHBondContact O-N 3.07Å; R131-S133 PolarHBondContact O-N 3Å; S133-P135 WeakPolarHBondContact O-CD 3.4Å
134	N	89.1	Confident	81.4	Confident	69 Å²	69	57.3 Å²	57.3	37%	0.369	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	95.6	-171.3	-49.5	-51.3	0	0	0	109.9	P55 N56 D57 F58 V136	P55-N134 PolarHBondContact O-ND2 2.66Å; N56-N134 PolarHBondContact O-N 3.43Å; D57-N134 CarbonylContact C-O 3.58Å; D57-N134 VanDerWaalsContact CA-O 3.29Å; D57-N134 WeakPolarHBondContact CA-O 3.3Å; D57-N134 VanDerWaalsContact OD1-CB 3.25Å; D57-N134 WeakPolarHBondContact OD1-CB 3.18Å; D57-N134 PolarHBondContact OD1-ND2 3.45Å; F58-N134 WeakPolarHBondContact CD1-O 3.3Å; F58-N134 PolarHBondContact N-O 2.67Å; N134-V136 PolarHBondContact O-N 3.25Å
135	P	90.1	Very high	81.8	Confident	30 Å²	30	57.4 Å²	57.4	20%	0.195	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	121.6	175.9	24.4	-31.3	0	0	0	110	P4 Y38 F58 S133 Y137	P4-P135 HydrophobicContact CB-CG 4.39Å; Y38-P135 HydrophobicContact CD1-CB 3.7Å; Y38-P135 HydrophobicContact CE1-CB 4.43Å; Y38-P135 HydrophobicContact CG-CB 3.97Å; F58-P135 HydrophobicContact CE1-CB 3.85Å; F58-P135 HydrophobicContact CE1-CG 4.31Å; F58-P135 VanDerWaalsContact CE1-N 3.3Å; F58-P135 HydrophobicContact CE2-CB 4.17Å; F58-P135 HydrophobicContact CZ-CB 3.6Å; F58-P135 HydrophobicContact CZ-CG 4.29Å; S133-P135 WeakPolarHBondContact O-CD 3.4Å; P135-Y137 HydrophobicContact CB-CE1 3.96Å; P135-Y137 HydrophobicContact CG-CE1 4.12Å
136	V	91.6	Very high	82.6	Confident	27 Å²	27	54.8 Å²	54.8	16%	0.164	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-84.9	123.6	171	178.7	0	0	0	0	107.7	Y38 H40 L52 D57 F58 L59 N134	Y38-V136 VanDerWaalsContact CA-O 3.31Å; Y38-V136 WeakPolarHBondContact CA-O 3.41Å; Y38-V136 WeakPolarHBondContact CB-O 3.34Å; H40-V136 PolarHBondContact NE2-O 3.09Å; L52-V136 HydrophobicContact CD2-CB 4.31Å; L52-V136 HydrophobicContact CD2-CG2 3.77Å; D57-V136 HydrophobicContact CB-CG2 3.68Å; F58-V136 PolarHBondContact O-N 2.86Å; L59-V136 HydrophobicContact CB-CB 4.44Å; N134-V136 PolarHBondContact O-N 3.25Å
137	Y	87.8	Confident	83.6	Confident	32 Å²	32	48.5 Å²	48.5	13%	0.125	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-86.4	147.6	-178.7	-56.1	-50	0	0	0	113	P4 L5 A7 P37 Y38 H40 P135	P4-Y137 VanDerWaalsContact C-CZ 3.47Å; P4-Y137 WeakPolarHBondContact CA-OH 3.5Å; P4-Y137 HydrophobicContact CB-CE2 3.73Å; P4-Y137 WeakPolarHBondContact CB-OH 3.37Å; P4-Y137 WeakPolarHBondContact O-CE2 3.28Å; P4-Y137 PolarHBondContact O-OH 3.05Å; L5-Y137 PolarHBondContact N-OH 2.85Å; A7-Y137 HydrophobicContact CB-CD2 3.86Å; A7-Y137 HydrophobicContact CB-CE2 4.31Å; A7-Y137 HydrophobicContact CB-CG 4.38Å; P37-Y137 HydrophobicContact CB-CD1 3.44Å; P37-Y137 VanDerWaalsContact CB-CD1 3.44Å; P37-Y137 HydrophobicContact CB-CE1 3.7Å; P37-Y137 HydrophobicContact CB-CG 4.23Å; P37-Y137 CarbonylContact O-C 3.25Å; P37-Y137 VanDerWaalsContact O-CA 3.28Å; P37-Y137 WeakPolarHBondContact O-CA 3.43Å; P37-Y137 WeakPolarHBondContact O-CB 3.34Å; Y38-Y137 HydrophobicContact CD1-CD1 4.39Å; Y38-Y137 HydrophobicContact CD1-CE1 4.02Å; H40-Y137 PolarHBondContact CE1-O 3.08Å; P135-Y137 HydrophobicContact CB-CE1 3.96Å; P135-Y137 HydrophobicContact CG-CE1 4.12Å
138	A	86.7	Confident	84.2	Confident	3 Å²	3	42.4 Å²	42.4	3%	0.025	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-57.8	126.7	171.6	0	0	0	0	0	109.7	P37 F39 H40 E140 V141 I142	P37-A138 PolarHBondContact O-N 2.77Å; F39-A138 WeakPolarHBondContact O-CB 3.48Å; H40-A138 VanDerWaalsContact CE1-CA 3.45Å; H40-A138 WeakPolarHBondContact CE1-CA 2.96Å; H40-A138 PolarHBondContact CE1-N 2.98Å; H40-A138 PolarHBondContact NE2-N 2.84Å; A138-E140 PolarHBondContact O-N 3.03Å; A138-E140 VanDerWaalsContact O-N 3.13Å; A138-V141 HydrophobicContact CB-CG2 4.06Å; A138-V141 WeakPolarHBondContact O-CB 3.34Å; A138-V141 PolarHBondContact O-N 3.25Å; A138-I142 PolarHBondContact O-N 3.1Å
139	P	83.1	Confident	84.2	Confident	51 Å²	51	47 Å²	47	33%	0.331	24%	0.242	S	C	.	.	H	α-helix	trans	-52.5	-36.6	176.9	-27.6	34.8	0	0	0	112.1	V141 I142 D143	P139-V141 VanDerWaalsContact C-N 3.26Å; P139-V141 PolarHBondContact O-N 3.29Å; P139-I142 PolarHBondContact O-N 3.43Å; P139-D143 VanDerWaalsContact O-CB 3.25Å; P139-D143 WeakPolarHBondContact O-CB 3.49Å; P139-D143 PolarHBondContact O-N 3.32Å
140	E	79.5	Confident	83.8	Confident	86 Å²	86	45.9 Å²	45.9	40%	0.402	24%	0.242	S	C	.	.	H	α-helix	trans	-56.6	-38.9	176.5	-63.4	77.5	-170	0	0	112.2	A138 C144	A138-E140 PolarHBondContact O-N 3.03Å; A138-E140 VanDerWaalsContact O-N 3.13Å; E140-C144 PolarHBondContact O-N 2.95Å; E140-C144 PolarHBondContact O-SG 3.11Å
141	V	79.5	Confident	82.9	Confident	44 Å²	44	53.5 Å²	53.5	27%	0.267	28%	0.277	S	S	.	.	H	α-helix	trans	-71.7	-44	178.8	176.3	0	0	0	0	110.8	P37 A138 P139	P37-V141 HydrophobicContact CB-CG1 4.41Å; A138-V141 HydrophobicContact CB-CG2 4.06Å; A138-V141 WeakPolarHBondContact O-CB 3.34Å; A138-V141 PolarHBondContact O-N 3.25Å; P139-V141 VanDerWaalsContact C-N 3.26Å; P139-V141 PolarHBondContact O-N 3.29Å
142	I	77	Confident	82.1	Confident	63 Å²	63	53 Å²	53	32%	0.323	28%	0.284	S	S	.	.	H	α-helix	trans	-64.9	-46.4	179.6	-59.3	173.4	0	0	0	110.7	A7 A138 P139 C144 V145 K146	A7-I142 HydrophobicContact CB-CG1 4.24Å; A138-I142 PolarHBondContact O-N 3.1Å; P139-I142 PolarHBondContact O-N 3.43Å; I142-C144 PolarHBondContact O-N 3.38Å; I142-V145 WeakPolarHBondContact O-CG2 3.31Å; I142-V145 PolarHBondContact O-N 2.75Å; I142-K146 WeakPolarHBondContact O-CB 3.22Å; I142-K146 PolarHBondContact O-N 3.33Å; I142-K146 VanDerWaalsContact O-N 3.16Å
143	D	81.8	Confident	81.7	Confident	70 Å²	70	53.2 Å²	53.2	37%	0.374	29%	0.285	S	S	.	.	H	α-helix	trans	-66.3	-26.5	-174.4	-70.2	-19.8	0	0	0	112.2	P139 V145	P139-D143 VanDerWaalsContact O-CB 3.25Å; P139-D143 WeakPolarHBondContact O-CB 3.49Å; P139-D143 PolarHBondContact O-N 3.32Å; D143-V145 VanDerWaalsContact C-N 3.26Å; D143-V145 PolarHBondContact O-N 2.84Å
144	C	84.3	Confident	81.6	Confident	16 Å²	16	53 Å²	53	11%	0.108	28%	0.283	C	S	.	.	H	α-helix	trans	-60.9	-33.5	177.2	-74.4	0	0	0	0	113.2	E140 I142 V236 R248	E140-C144 PolarHBondContact O-N 2.95Å; E140-C144 PolarHBondContact O-SG 3.11Å; I142-C144 PolarHBondContact O-N 3.38Å; C144-V236 HydrophobicContact CB-CG1 4.14Å; C144-R248 WeakPolarHBondContact CB-O 3.46Å; C144-R248 PolarHBondContact SG-O 3.31Å
145	V	79.8	Confident	81.6	Confident	11 Å²	11	49.7 Å²	49.7	7%	0.067	27%	0.265	C	S	.	.	H	α-helix	trans	-107.4	-15.6	-175.5	-63.7	0	0	0	0	113.5	I142 D143 V236 R237	I142-V145 WeakPolarHBondContact O-CG2 3.31Å; I142-V145 PolarHBondContact O-N 2.75Å; D143-V145 VanDerWaalsContact C-N 3.26Å; D143-V145 PolarHBondContact O-N 2.84Å; V145-V236 HydrophobicContact CG1-CG1 4.15Å; V145-R237 HydrophobicContact CG1-CB 4.1Å; V145-R237 HydrophobicContact CG1-CG 4.47Å
146	K	84.7	Confident	81.4	Confident	97 Å²	97	49.9 Å²	49.9	42%	0.422	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-77	127.4	-179.1	-173.6	179.1	179.1	-176.6	0	110.9	I142 K233 W294	I142-K146 WeakPolarHBondContact O-CB 3.22Å; I142-K146 PolarHBondContact O-N 3.33Å; I142-K146 VanDerWaalsContact O-N 3.16Å; K146-K233 VanDerWaalsContact O-CD 3.32Å; K146-K233 WeakPolarHBondContact O-CD 3.08Å; K146-K233 WeakPolarHBondContact O-CE 3.4Å; K146-K233 PolarHBondContact O-NZ 3.05Å; K146-W294 CarbonylContact C-O 3.46Å
147	L	86.2	Confident	81	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-64.3	137.4	175.4	-60.2	176.1	0	0	0	110.7	D229 E230 K233 W294 A296	L147-D229 WeakPolarHBondContact CA-OD2 3.42Å; L147-E230 HydrophobicContact CD1-CG 3.75Å; L147-E230 HydrophobicContact CD2-CB 4.42Å; L147-E230 HydrophobicContact CD2-CG 3.65Å; L147-E230 HydrophobicContact CG-CG 4.37Å; L147-K233 HydrophobicContact CD2-CB 4.36Å; L147-K233 HydrophobicContact CD2-CD 4.08Å; L147-W294 WeakPolarHBondContact CB-O 3.42Å; L147-W294 WeakPolarHBondContact CG-O 3.49Å; L147-W294 PolarHBondContact N-O 2.96Å; L147-A296 HydrophobicContact CD2-CB 3.97Å
148	E	83.3	Confident	80.5	Confident	33 Å²	33	49.3 Å²	49.3	15%	0.154	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-85	129.1	-177.3	-81.7	-171.1	-139.2	0	0	111.9	S150 L153 S154 Y155 D229 R284	E148-S150 PolarHBondContact O-N 3.33Å; E148-L153 HydrophobicContact CB-CD2 4.15Å; E148-L153 WeakPolarHBondContact OE2-CA 3.32Å; E148-S154 VanDerWaalsContact CD-N 3.34Å; E148-S154 WeakPolarHBondContact OE1-CB 3.39Å; E148-S154 PolarHBondContact OE1-N 3.04Å; E148-S154 PolarHBondContact OE1-OG 3.48Å; E148-S154 VanDerWaalsContact OE2-CB 3.27Å; E148-S154 WeakPolarHBondContact OE2-CB 3.49Å; E148-S154 PolarHBondContact OE2-N 3.14Å; E148-S154 PolarHBondContact OE2-OG 3.37Å; E148-Y155 WeakPolarHBondContact OE1-CD1 3.24Å; E148-Y155 WeakPolarHBondContact OE1-CE1 3.24Å; E148-D229 PolarHBondContact N-OD2 3.24Å; E148-R284 PolarHBondContact O-NH1 3.09Å; E148-R284 PolarHBondContact O-NH2 3.42Å
149	Q	74.3	Confident	80.2	Confident	127 Å²	127	53.9 Å²	53.9	59%	0.593	29%	0.286	S	S	*	.			trans	-87.1	-2.9	-174.7	-61.8	179.2	17.2	0	0	114.6	W294	Q149-W294 HydrophobicContact CG-CE3 4.3Å; Q149-W294 HydrophobicContact CG-CZ3 4.37Å
150	S	69.8	Low	80.2	Confident	65 Å²	65	52.2 Å²	52.2	46%	0.455	27%	0.274	S	S	.	.	S	Bend	trans	-76	159.5	-176.1	178.5	0	0	0	0	113.6	E148 T152 K282	E148-S150 PolarHBondContact O-N 3.33Å; S150-T152 VanDerWaalsContact CB-O 3.25Å; S150-T152 WeakPolarHBondContact CB-O 3.16Å; S150-T152 PolarHBondContact O-N 3.02Å; S150-T152 PolarHBondContact OG-N 3.28Å; S150-T152 PolarHBondContact OG-O 3.38Å; S150-K282 PolarHBondContact O-NZ 3.35Å
151	E	64.4	Low	80.4	Confident	159 Å²	159	53.9 Å²	53.9	74%	0.743	28%	0.282	S	S	*	.	S	Bend	trans	-69.5	-12	170.5	-72.2	-172.1	176.7	0	0	114.1	K282	E151-K282 WeakPolarHBondContact O-CD 3.19Å; E151-K282 WeakPolarHBondContact O-CE 3.23Å; E151-K282 PolarHBondContact O-NZ 2.87Å
152	T	72.5	Confident	80.6	Confident	76 Å²	76	56.4 Å²	56.4	47%	0.466	29%	0.291	S	S	.	.	S	Bend	trans	-129.3	148.7	167.5	52.6	0	0	0	0	109.8	S150 K282	S150-T152 VanDerWaalsContact CB-O 3.25Å; S150-T152 WeakPolarHBondContact CB-O 3.16Å; S150-T152 PolarHBondContact O-N 3.02Å; S150-T152 PolarHBondContact OG-N 3.28Å; S150-T152 PolarHBondContact OG-O 3.38Å; T152-K282 PolarHBondContact O-NZ 3.28Å
153	L	82.6	Confident	80.9	Confident	4 Å²	4	61 Å²	61	2%	0.021	31%	0.31	C	S	.	.			trans	-79.8	135.5	174.2	-63.7	175.9	0	0	0	108.5	E148 Y155 Q156 L177 D229 V281	E148-L153 HydrophobicContact CB-CD2 4.15Å; E148-L153 WeakPolarHBondContact OE2-CA 3.32Å; L153-Y155 HydrophobicContact CB-CD1 4.35Å; L153-Y155 HydrophobicContact CB-CE1 4.1Å; L153-Y155 HydrophobicContact CD1-CE1 4.32Å; L153-Y155 HydrophobicContact CD1-CE2 4.26Å; L153-Y155 HydrophobicContact CD2-CE1 4.37Å; L153-Y155 HydrophobicContact CG-CE1 4.5Å; L153-Y155 PolarHBondContact O-N 3.08Å; L153-Q156 HydrophobicContact CB-CB 4.25Å; L153-Q156 WeakPolarHBondContact O-CB 3.26Å; L153-Q156 PolarHBondContact O-N 3.13Å; L153-L177 HydrophobicContact CD1-CD1 3.91Å; L153-D229 HydrophobicContact CD1-CB 4.3Å; L153-D229 HydrophobicContact CD2-CB 3.78Å; L153-V281 HydrophobicContact CD1-CG1 3.41Å; L153-V281 VanDerWaalsContact CD1-CG1 3.41Å; L153-V281 HydrophobicContact CG-CG1 4.03Å
154	S	86.1	Confident	81.1	Confident	47 Å²	47	60.6 Å²	60.6	33%	0.329	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-27.7	-175	74.2	0	0	0	0	112.3	E148 Q156 A252 F253	E148-S154 VanDerWaalsContact CD-N 3.34Å; E148-S154 WeakPolarHBondContact OE1-CB 3.39Å; E148-S154 PolarHBondContact OE1-N 3.04Å; E148-S154 PolarHBondContact OE1-OG 3.48Å; E148-S154 VanDerWaalsContact OE2-CB 3.27Å; E148-S154 WeakPolarHBondContact OE2-CB 3.49Å; E148-S154 PolarHBondContact OE2-N 3.14Å; E148-S154 PolarHBondContact OE2-OG 3.37Å; S154-Q156 VanDerWaalsContact C-N 3.27Å; S154-A252 CarbonylContact O-C 3.53Å; S154-A252 WeakPolarHBondContact O-CA 3.45Å; S154-A252 WeakPolarHBondContact OG-CB 3.33Å; S154-F253 PolarHBondContact O-N 3.23Å
155	Y	89.1	Confident	81.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	20.2	176.2	61.6	-87.3	0	0	0	113.2	E148 L153 F175 L176 L177 D229 V232 P250 I251	E148-Y155 WeakPolarHBondContact OE1-CD1 3.24Å; E148-Y155 WeakPolarHBondContact OE1-CE1 3.24Å; L153-Y155 HydrophobicContact CB-CD1 4.35Å; L153-Y155 HydrophobicContact CB-CE1 4.1Å; L153-Y155 HydrophobicContact CD1-CE1 4.32Å; L153-Y155 HydrophobicContact CD1-CE2 4.26Å; L153-Y155 HydrophobicContact CD2-CE1 4.37Å; L153-Y155 HydrophobicContact CG-CE1 4.5Å; L153-Y155 PolarHBondContact O-N 3.08Å; Y155-F175 HydrophobicContact CD2-CD2 4.31Å; Y155-F175 AromaticContact CD2-CE2 3.95Å; Y155-F175 HydrophobicContact CD2-CE2 3.95Å; Y155-F175 HydrophobicContact CE2-CD2 4.47Å; Y155-F175 AromaticContact CE2-CE2 3.85Å; Y155-F175 HydrophobicContact CE2-CE2 3.85Å; Y155-L176 WeakPolarHBondContact O-CB 3.14Å; Y155-L177 HydrophobicContact CD2-CD1 4.14Å; Y155-L177 HydrophobicContact CD2-CG 4.06Å; Y155-L177 HydrophobicContact CE2-CD1 3.53Å; Y155-L177 HydrophobicContact CE2-CG 3.81Å; Y155-L177 PolarHBondContact O-N 2.74Å; Y155-D229 PolarHBondContact OH-OD1 2.84Å; Y155-V232 HydrophobicContact CE2-CG1 4.45Å; Y155-P250 HydrophobicContact CD1-CB 3.55Å; Y155-P250 HydrophobicContact CD2-CB 4.37Å; Y155-P250 HydrophobicContact CE1-CB 4.13Å; Y155-P250 HydrophobicContact CG-CB 3.69Å; Y155-I251 WeakPolarHBondContact CA-O 3.4Å; Y155-I251 WeakPolarHBondContact CB-O 3.42Å
156	Q	85	Confident	81.6	Confident	35 Å²	35	63.4 Å²	63.4	16%	0.164	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	119.5	172	-171.7	-172.1	-54.8	0	0	109.9	L153 S154 W278	L153-Q156 HydrophobicContact CB-CB 4.25Å; L153-Q156 WeakPolarHBondContact O-CB 3.26Å; L153-Q156 PolarHBondContact O-N 3.13Å; S154-Q156 VanDerWaalsContact C-N 3.27Å; Q156-W278 VanDerWaalsContact CD-CE3 3.48Å; Q156-W278 VanDerWaalsContact CD-CH2 3.47Å; Q156-W278 HydrophobicContact CG-CD2 4.32Å; Q156-W278 HydrophobicContact CG-CE3 4.19Å; Q156-W278 HydrophobicContact CG-CH2 3.33Å; Q156-W278 HydrophobicContact CG-CZ2 3.45Å; Q156-W278 VanDerWaalsContact CG-CZ2 3.45Å; Q156-W278 HydrophobicContact CG-CZ3 3.71Å; Q156-W278 VanDerWaalsContact NE2-CZ2 3.33Å
157	Y	84.6	Confident	81.6	Confident	5 Å²	5	62.7 Å²	62.7	2%	0.02	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	151.2	179.9	-75.4	-108.7	0	0	0	111.1	L160 V168 L176 L177 I251 A252 F253 I266	Y157-L160 HydrophobicContact CD1-CD1 3.71Å; Y157-L160 HydrophobicContact CD1-CD2 4.39Å; Y157-L160 HydrophobicContact CD1-CG 4.25Å; Y157-L160 HydrophobicContact CE1-CD1 4.26Å; Y157-L160 HydrophobicContact CG-CD1 4.25Å; Y157-V168 HydrophobicContact CE1-CG1 4.49Å; Y157-L176 HydrophobicContact CD1-CD2 4.48Å; Y157-L176 HydrophobicContact CD2-CB 3.74Å; Y157-L176 HydrophobicContact CD2-CD1 4.26Å; Y157-L176 HydrophobicContact CD2-CD2 3.78Å; Y157-L176 HydrophobicContact CD2-CG 4.15Å; Y157-L176 HydrophobicContact CE2-CB 3.93Å; Y157-L176 HydrophobicContact CE2-CD2 3.87Å; Y157-L176 HydrophobicContact CE2-CG 4.48Å; Y157-L176 HydrophobicContact CG-CD1 4.44Å; Y157-L176 HydrophobicContact CG-CD2 4.09Å; Y157-L177 PolarHBondContact N-O 3.26Å; Y157-I251 VanDerWaalsContact CE2-O 3.27Å; Y157-I251 WeakPolarHBondContact CE2-O 3.25Å; Y157-A252 PolarHBondContact OH-O 3.46Å; Y157-F253 AromaticContact CD1-CD2 3.95Å; Y157-F253 HydrophobicContact CD1-CD2 3.95Å; Y157-F253 AromaticContact CE1-CD2 3.88Å; Y157-F253 HydrophobicContact CE1-CD2 3.88Å; Y157-F253 VanDerWaalsContact OH-CA 3.29Å; Y157-F253 WeakPolarHBondContact OH-CA 3.18Å; Y157-F253 PolarHBondContact OH-N 3.28Å; Y157-I266 HydrophobicContact CD1-CG2 4.4Å
158	S	76.8	Confident	81.7	Confident	41 Å²	41	63 Å²	63	29%	0.287	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-61.9	169.6	155.3	53.4	0	0	0	0	110.1	L160 Q178	S158-L160 PolarHBondContact O-N 3.22Å; S158-L160 VanDerWaalsContact O-N 3.1Å; S158-Q178 PolarHBondContact O-NE2 3.31Å
159	Q	79.8	Confident	82.1	Confident	100 Å²	100	61.4 Å²	61.4	47%	0.467	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-59.4	119.3	176.7	-174.4	178.5	-14.4	0	0	110.3
160	L	83.1	Confident	82.6	Confident	16 Å²	16	61.6 Å²	61.6	8%	0.084	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-99.6	147.9	171.2	-60.2	171.1	0	0	0	109.6	Y157 S158 L165 V168 L176 Q178 I266	Y157-L160 HydrophobicContact CD1-CD1 3.71Å; Y157-L160 HydrophobicContact CD1-CD2 4.39Å; Y157-L160 HydrophobicContact CD1-CG 4.25Å; Y157-L160 HydrophobicContact CE1-CD1 4.26Å; Y157-L160 HydrophobicContact CG-CD1 4.25Å; S158-L160 PolarHBondContact O-N 3.22Å; S158-L160 VanDerWaalsContact O-N 3.1Å; L160-L165 HydrophobicContact CD1-CD1 4.43Å; L160-V168 HydrophobicContact CD1-CG2 4.22Å; L160-L176 HydrophobicContact CD1-CD2 4.17Å; L160-Q178 VanDerWaalsContact CG-NE2 3.3Å; L160-I266 HydrophobicContact CD2-CG2 3.78Å
161	E	83.7	Confident	83.4	Confident	121 Å²	121	63.4 Å²	63.4	57%	0.565	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-69.3	152.1	166.1	-67.4	165.8	157.7	0	0	110.2	E163 K164 L165	E161-E163 VanDerWaalsContact C-N 3.31Å; E161-E163 PolarHBondContact O-N 2.66Å; E161-K164 PolarHBondContact O-N 3.07Å; E161-K164 IonicContact OE2-NZ 3.79Å; E161-K164 PolarHBondContact OE2-NZ 3.04Å; E161-L165 PolarHBondContact O-N 2.92Å
162	E	83.8	Confident	84.7	Confident	97 Å²	97	58.1 Å²	58.1	45%	0.453	29%	0.285	S	S	.	.	H	α-helix	trans	-59.5	-39	-173.8	-163.8	70.1	-170.7	0	0	112.8	K164 L165 I166	E162-K164 PolarHBondContact O-N 3.39Å; E162-L165 VanDerWaalsContact O-CB 3.32Å; E162-L165 WeakPolarHBondContact O-CB 3.2Å; E162-L165 PolarHBondContact O-N 2.66Å; E162-L165 VanDerWaalsContact O-N 3.15Å; E162-I166 PolarHBondContact O-N 2.85Å
163	E	83.6	Confident	85.6	Confident	158 Å²	158	54.5 Å²	54.5	74%	0.738	26%	0.263	S	S	*	.	H	α-helix	trans	-60.8	-46.7	177.9	-64.8	176.4	-178.8	0	0	111.2	E161 L165 I166 D167	E161-E163 VanDerWaalsContact C-N 3.31Å; E161-E163 PolarHBondContact O-N 2.66Å; E163-L165 VanDerWaalsContact C-N 3.28Å; E163-L165 PolarHBondContact O-N 2.78Å; E163-I166 PolarHBondContact O-N 2.65Å; E163-D167 PolarHBondContact O-N 2.81Å
164	K	85.2	Confident	86.1	Confident	63 Å²	63	54.9 Å²	54.9	27%	0.274	27%	0.265	S	S	.	.	H	α-helix	trans	-66.9	-31.2	176.4	-67.4	174.4	-178.4	147.2	0	111.9	E161 E162 I166 D167 V168	E161-K164 PolarHBondContact O-N 3.07Å; E161-K164 IonicContact OE2-NZ 3.79Å; E161-K164 PolarHBondContact OE2-NZ 3.04Å; E162-K164 PolarHBondContact O-N 3.39Å; K164-I166 VanDerWaalsContact C-N 3.31Å; K164-I166 PolarHBondContact O-N 3.38Å; K164-D167 PolarHBondContact O-N 2.74Å; K164-V168 WeakPolarHBondContact O-CG2 3.38Å; K164-V168 PolarHBondContact O-N 2.89Å
165	L	87.7	Confident	86.5	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	25%	0.25	C	C	.	.	H	α-helix	trans	-63	-39.7	177.9	-172.9	63.6	0	0	0	111.3	L160 E161 E162 E163 V168 L169 L176 R190 A197	L160-L165 HydrophobicContact CD1-CD1 4.43Å; E161-L165 PolarHBondContact O-N 2.92Å; E162-L165 VanDerWaalsContact O-CB 3.32Å; E162-L165 WeakPolarHBondContact O-CB 3.2Å; E162-L165 PolarHBondContact O-N 2.66Å; E162-L165 VanDerWaalsContact O-N 3.15Å; E163-L165 VanDerWaalsContact C-N 3.28Å; E163-L165 PolarHBondContact O-N 2.78Å; L165-V168 PolarHBondContact O-N 3.43Å; L165-L169 HydrophobicContact CD1-CD1 3.61Å; L165-L169 HydrophobicContact CD1-CG 3.98Å; L165-L169 HydrophobicContact CG-CD1 3.94Å; L165-L169 HydrophobicContact CG-CG 4.42Å; L165-L169 WeakPolarHBondContact O-CB 3.47Å; L165-L169 WeakPolarHBondContact O-CG 3.47Å; L165-L169 PolarHBondContact O-N 3.21Å; L165-L176 HydrophobicContact CD1-CD1 4.14Å; L165-L176 HydrophobicContact CD1-CD2 3.94Å; L165-L176 HydrophobicContact CD1-CG 4.26Å; L165-R190 HydrophobicContact CD1-CB 3.97Å; L165-R190 HydrophobicContact CD1-CG 4.16Å; L165-R190 HydrophobicContact CD2-CB 4.17Å; L165-R190 HydrophobicContact CD2-CG 4.08Å; L165-A197 HydrophobicContact CD2-CB 3.66Å; L165-A197 HydrophobicContact CG-CB 4.07Å
166	I	86.6	Confident	86.7	Confident	85 Å²	85	52.7 Å²	52.7	44%	0.436	25%	0.25	S	C	.	.	H	α-helix	trans	-67.4	-37.5	175.8	-63.2	169.6	0	0	0	110.9	E162 E163 K164 V168 L169 M192	E162-I166 PolarHBondContact O-N 2.85Å; E163-I166 PolarHBondContact O-N 2.65Å; K164-I166 VanDerWaalsContact C-N 3.31Å; K164-I166 PolarHBondContact O-N 3.38Å; I166-V168 VanDerWaalsContact C-N 3.3Å; I166-V168 PolarHBondContact O-N 2.75Å; I166-L169 CarbonylContact O-C 3.56Å; I166-L169 VanDerWaalsContact O-O 3.14Å; I166-M192 HydrophobicContact CB-CE 4.32Å; I166-M192 HydrophobicContact CG1-CE 4.2Å; I166-M192 HydrophobicContact CG2-CE 4.1Å
167	D	85.1	Confident	87	Confident	81 Å²	81	51 Å²	51	43%	0.433	24%	0.242	S	C	.	.	H	α-helix	trans	-67.3	-31	176.4	-70.7	-25.4	0	0	0	113.2	E163 K164 R170	E163-D167 PolarHBondContact O-N 2.81Å; K164-D167 PolarHBondContact O-N 2.74Å; D167-R170 WeakPolarHBondContact O-CG 3.21Å; D167-R170 PolarHBondContact O-NE 3.34Å
168	V	87.9	Confident	87.2	Confident	9 Å²	9	50.8 Å²	50.8	6%	0.055	24%	0.241	C	C	.	.	H	α-helix	trans	-81.4	-48.8	178.6	174	0	0	0	0	111	Y157 L160 K164 L165 I166 R170 L176 I251 Y256	Y157-V168 HydrophobicContact CE1-CG1 4.49Å; L160-V168 HydrophobicContact CD1-CG2 4.22Å; K164-V168 WeakPolarHBondContact O-CG2 3.38Å; K164-V168 PolarHBondContact O-N 2.89Å; L165-V168 PolarHBondContact O-N 3.43Å; I166-V168 VanDerWaalsContact C-N 3.3Å; I166-V168 PolarHBondContact O-N 2.75Å; V168-R170 PolarHBondContact O-N 3.28Å; V168-L176 HydrophobicContact CG1-CD2 3.68Å; V168-I251 HydrophobicContact CG1-CB 4.44Å; V168-I251 HydrophobicContact CG1-CG2 3.77Å; V168-Y256 HydrophobicContact CB-CE2 4.44Å; V168-Y256 HydrophobicContact CG2-CD2 3.85Å; V168-Y256 HydrophobicContact CG2-CE2 3.43Å; V168-Y256 VanDerWaalsContact CG2-CE2 3.43Å
169	L	91.6	Very high	87.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.231	C	C	.	.			trans	-94.6	90.5	-178.1	-53.8	-178.4	0	0	0	109.5	L165 I166 D174 L176 R190 M192 I251	L165-L169 HydrophobicContact CD1-CD1 3.61Å; L165-L169 HydrophobicContact CD1-CG 3.98Å; L165-L169 HydrophobicContact CG-CD1 3.94Å; L165-L169 HydrophobicContact CG-CG 4.42Å; L165-L169 WeakPolarHBondContact O-CB 3.47Å; L165-L169 WeakPolarHBondContact O-CG 3.47Å; L165-L169 PolarHBondContact O-N 3.21Å; I166-L169 CarbonylContact O-C 3.56Å; I166-L169 VanDerWaalsContact O-O 3.14Å; L169-D174 HydrophobicContact CB-CB 4.22Å; L169-D174 HydrophobicContact CD2-CB 4.1Å; L169-L176 HydrophobicContact CD1-CG 4.47Å; L169-L176 HydrophobicContact CD2-CB 4.48Å; L169-L176 HydrophobicContact CD2-CD2 3.8Å; L169-L176 HydrophobicContact CD2-CG 3.98Å; L169-L176 HydrophobicContact CG-CD2 4.22Å; L169-R190 HydrophobicContact CD1-CB 4.02Å; L169-M192 HydrophobicContact CB-CB 3.59Å; L169-M192 HydrophobicContact CB-CE 4.44Å; L169-M192 WeakPolarHBondContact O-CB 3.49Å; L169-M192 WeakPolarHBondContact O-CE 3.45Å; L169-M192 WeakPolarHBondContact O-CG 3.41Å; L169-I251 HydrophobicContact CD2-CB 4.41Å; L169-I251 HydrophobicContact CD2-CG1 3.86Å
170	R	85.5	Confident	87.6	Confident	131 Å²	131	44.9 Å²	44.9	49%	0.494	21%	0.21	S	C	.	.			trans	-94.1	-28.8	-168	-63.2	-175.8	-176	179.1	-2.1	113.8	D167 V168 D174	D167-R170 WeakPolarHBondContact O-CG 3.21Å; D167-R170 PolarHBondContact O-NE 3.34Å; V168-R170 PolarHBondContact O-N 3.28Å; R170-D174 PolarHBondContact N-OD2 2.98Å; R170-D174 VanDerWaalsContact N-OD2 3.12Å
171	K	87.8	Confident	87.5	Confident	103 Å²	103	47 Å²	47	45%	0.448	23%	0.225	S	C	.	.	S	Bend	trans	-116.6	153	-174.8	-59.1	-169.5	177.3	-159.1	0	111.3	G173 D174 M192	K171-G173 PolarHBondContact O-N 3.21Å; K171-D174 PolarHBondContact N-OD2 2.84Å; K171-D174 VanDerWaalsContact O-CB 3.26Å; K171-D174 WeakPolarHBondContact O-CB 3.25Å; K171-D174 PolarHBondContact O-N 3.33Å; K171-M192 WeakPolarHBondContact O-CB 3.34Å
172	D	90.8	Very high	87.4	Confident	47 Å²	47	46.6 Å²	46.6	25%	0.251	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	123.5	174.5	-78.7	-8.8	0	0	0	110.9	M192 W193 N194 R248 P519	D172-M192 CarbonylContact C-O 3.57Å; D172-M192 WeakPolarHBondContact CA-O 3.36Å; D172-W193 HydrophobicContact CB-CE3 4.09Å; D172-W193 HydrophobicContact CB-CZ3 4.26Å; D172-W193 WeakPolarHBondContact OD1-CA 3.48Å; D172-N194 VanDerWaalsContact CG-N 3.35Å; D172-N194 PolarHBondContact OD1-N 2.91Å; D172-N194 PolarHBondContact OD2-N 3.04Å; D172-R248 WeakPolarHBondContact O-CD 3.22Å; D172-P519 HydrophobicContact CB-CG 4.22Å
173	G	91.4	Very high	87.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	2.5	-175.7	0	0	0	0	0	115.2	K171 F175 M192 L246 R248 T249	K171-G173 PolarHBondContact O-N 3.21Å; G173-F175 WeakPolarHBondContact O-CD1 3.26Å; G173-M192 PolarHBondContact N-O 3.37Å; G173-L246 WeakPolarHBondContact CA-O 3.25Å; G173-R248 WeakPolarHBondContact O-CA 3.23Å; G173-R248 PolarHBondContact O-N 2.86Å; G173-T249 PolarHBondContact O-N 2.85Å
174	D	92.9	Very high	86.6	Confident	13 Å²	13	44.6 Å²	44.6	7%	0.07	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	133.7	162.1	-71.7	-9.5	0	0	0	108.8	L169 R170 K171 I191 M192 T249 I251	L169-D174 HydrophobicContact CB-CB 4.22Å; L169-D174 HydrophobicContact CD2-CB 4.1Å; R170-D174 PolarHBondContact N-OD2 2.98Å; R170-D174 VanDerWaalsContact N-OD2 3.12Å; K171-D174 PolarHBondContact N-OD2 2.84Å; K171-D174 VanDerWaalsContact O-CB 3.26Å; K171-D174 WeakPolarHBondContact O-CB 3.25Å; K171-D174 PolarHBondContact O-N 3.33Å; D174-I191 CarbonylContact O-C 3.6Å; D174-I191 WeakPolarHBondContact O-CA 3.4Å; D174-M192 PolarHBondContact O-N 2.8Å; D174-T249 WeakPolarHBondContact CA-O 3.33Å; D174-T249 WeakPolarHBondContact OD1-CB 3.26Å; D174-T249 PolarHBondContact OD1-OG1 3.31Å; D174-I251 HydrophobicContact CB-CD1 3.96Å; D174-I251 HydrophobicContact CB-CG1 3.89Å
175	F	94.7	Very high	86	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	160	-177.7	70.7	-92	0	0	0	114.1	Y155 G173 L189 R190 I191 V232 V236 L247 T249 P250 I251	Y155-F175 HydrophobicContact CD2-CD2 4.31Å; Y155-F175 AromaticContact CD2-CE2 3.95Å; Y155-F175 HydrophobicContact CD2-CE2 3.95Å; Y155-F175 HydrophobicContact CE2-CD2 4.47Å; Y155-F175 AromaticContact CE2-CE2 3.85Å; Y155-F175 HydrophobicContact CE2-CE2 3.85Å; G173-F175 WeakPolarHBondContact O-CD1 3.26Å; F175-L189 HydrophobicContact CB-CD1 4.31Å; F175-L189 HydrophobicContact CD2-CD1 3.69Å; F175-L189 HydrophobicContact CE2-CD1 4.46Å; F175-L189 HydrophobicContact CG-CD1 4.31Å; F175-R190 CarbonylContact C-O 3.58Å; F175-R190 WeakPolarHBondContact CA-O 3.29Å; F175-R190 VanDerWaalsContact CB-O 3.26Å; F175-R190 WeakPolarHBondContact CB-O 3.37Å; F175-I191 HydrophobicContact CB-CB 4.38Å; F175-I191 HydrophobicContact CB-CG1 3.97Å; F175-I191 HydrophobicContact CB-CG2 4.37Å; F175-V232 HydrophobicContact CD2-CG1 4.22Å; F175-V232 HydrophobicContact CE2-CG1 3.36Å; F175-V232 HydrophobicContact CZ-CG1 3.63Å; F175-V236 HydrophobicContact CE1-CG2 3.5Å; F175-V236 HydrophobicContact CZ-CG2 3.71Å; F175-L247 HydrophobicContact CB-CD2 4.05Å; F175-L247 HydrophobicContact CD1-CB 3.92Å; F175-L247 HydrophobicContact CD1-CD2 4.01Å; F175-L247 HydrophobicContact CD1-CG 4.47Å; F175-L247 HydrophobicContact CE1-CB 3.92Å; F175-L247 HydrophobicContact CG-CD2 4.01Å; F175-T249 WeakPolarHBondContact CD1-O 3.25Å; F175-T249 PolarHBondContact N-O 2.89Å; F175-P250 HydrophobicContact CE1-CB 4.21Å; F175-P250 VanDerWaalsContact CE1-N 3.29Å; F175-P250 HydrophobicContact CE2-CB 3.75Å; F175-P250 HydrophobicContact CZ-CB 3.54Å; F175-P250 HydrophobicContact CZ-CG 4.04Å; F175-I251 PolarHBondContact O-N 3.34Å
176	L	94.1	Very high	85.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	165.5	173.1	60.6	80.4	0	0	0	111.7	Y155 Y157 L160 L165 V168 L169 Q178 R190	Y155-L176 WeakPolarHBondContact O-CB 3.14Å; Y157-L176 HydrophobicContact CD1-CD2 4.48Å; Y157-L176 HydrophobicContact CD2-CB 3.74Å; Y157-L176 HydrophobicContact CD2-CD1 4.26Å; Y157-L176 HydrophobicContact CD2-CD2 3.78Å; Y157-L176 HydrophobicContact CD2-CG 4.15Å; Y157-L176 HydrophobicContact CE2-CB 3.93Å; Y157-L176 HydrophobicContact CE2-CD2 3.87Å; Y157-L176 HydrophobicContact CE2-CG 4.48Å; Y157-L176 HydrophobicContact CG-CD1 4.44Å; Y157-L176 HydrophobicContact CG-CD2 4.09Å; L160-L176 HydrophobicContact CD1-CD2 4.17Å; L165-L176 HydrophobicContact CD1-CD1 4.14Å; L165-L176 HydrophobicContact CD1-CD2 3.94Å; L165-L176 HydrophobicContact CD1-CG 4.26Å; V168-L176 HydrophobicContact CG1-CD2 3.68Å; L169-L176 HydrophobicContact CD1-CG 4.47Å; L169-L176 HydrophobicContact CD2-CB 4.48Å; L169-L176 HydrophobicContact CD2-CD2 3.8Å; L169-L176 HydrophobicContact CD2-CG 3.98Å; L169-L176 HydrophobicContact CG-CD2 4.22Å; L176-Q178 HydrophobicContact CD1-CG 3.56Å; L176-R190 HydrophobicContact CD1-CB 3.81Å; L176-R190 HydrophobicContact CD1-CG 3.86Å; L176-R190 HydrophobicContact CG-CB 4.19Å; L176-R190 PolarHBondContact N-O 2.96Å; L176-R190 PolarHBondContact O-N 3.24Å
177	L	90.7	Very high	85.7	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	136.9	175.4	-72.5	172	0	0	0	111.1	L153 Y155 Y157 L188 L189 L228	L153-L177 HydrophobicContact CD1-CD1 3.91Å; Y155-L177 HydrophobicContact CD2-CD1 4.14Å; Y155-L177 HydrophobicContact CD2-CG 4.06Å; Y155-L177 HydrophobicContact CE2-CD1 3.53Å; Y155-L177 HydrophobicContact CE2-CG 3.81Å; Y155-L177 PolarHBondContact O-N 2.74Å; Y157-L177 PolarHBondContact N-O 3.26Å; L177-L188 WeakPolarHBondContact CA-O 3.3Å; L177-L189 HydrophobicContact CD2-CB 4.13Å; L177-L189 HydrophobicContact CD2-CD1 3.78Å; L177-L189 HydrophobicContact CG-CD1 4.32Å; L177-L228 HydrophobicContact CD1-CD2 3.9Å; L177-L228 HydrophobicContact CD2-CD2 4.29Å
178	Q	88	Confident	86	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	157.7	173.4	-76.6	177.7	-26.8	0	0	111.3	S158 L160 L176 L187 L188 R190	S158-Q178 PolarHBondContact O-NE2 3.31Å; L160-Q178 VanDerWaalsContact CG-NE2 3.3Å; L176-Q178 HydrophobicContact CD1-CG 3.56Å; Q178-L187 CarbonylContact O-C 3.59Å; Q178-L187 WeakPolarHBondContact O-CA 3.5Å; Q178-L188 PolarHBondContact N-O 3.5Å; Q178-L188 PolarHBondContact O-N 3.3Å; Q178-R190 HydrophobicContact CG-CG 4.43Å; Q178-R190 VanDerWaalsContact OE1-CG 3.31Å
179	V	82.1	Confident	86.2	Confident	12 Å²	12	41.8 Å²	41.8	7%	0.073	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	138.3	164.5	-177.7	0	0	0	0	108.7	L187 P273 W278	V179-L187 HydrophobicContact CG2-CD2 4.3Å; V179-P273 HydrophobicContact CG2-CB 4.12Å; V179-W278 HydrophobicContact CG2-CZ2 4.03Å
180	D	84.4	Confident	86.4	Confident	5 Å²	5	43 Å²	43	3%	0.027	22%	0.216	C	C	.	.			trans	-68.1	122.8	173.9	-169.1	-41.2	0	0	0	110.5	T182 V183 R186 L188	D180-T182 PolarHBondContact O-N 2.84Å; D180-T182 WeakPolarHBondContact OD1-CA 3.32Å; D180-T182 WeakPolarHBondContact OD1-CB 3.45Å; D180-T182 PolarHBondContact OD1-N 2.98Å; D180-T182 PolarHBondContact OD1-OG1 3.42Å; D180-V183 WeakPolarHBondContact CB-O 3.34Å; D180-V183 CarbonylContact O-C 3.58Å; D180-V183 PolarHBondContact O-N 3.25Å; D180-V183 PolarHBondContact OD1-N 2.68Å; D180-R186 HydrophobicContact CB-CB 3.99Å; D180-R186 HydrophobicContact CB-CG 4.41Å; D180-R186 WeakPolarHBondContact CB-O 3.29Å; D180-R186 PolarHBondContact N-O 3.44Å; D180-R186 IonicContact OD2-CZ 3.66Å; D180-R186 IonicContact OD2-NE 2.76Å; D180-R186 PolarHBondContact OD2-NE 3.18Å; D180-R186 IonicContact OD2-NH2 3.16Å; D180-R186 PolarHBondContact OD2-NH2 3.44Å; D180-L188 HydrophobicContact CB-CD1 3.87Å; D180-L188 HydrophobicContact CB-CD2 4.11Å; D180-L188 HydrophobicContact CB-CG 3.68Å; D180-L188 VanDerWaalsContact OD2-CD2 3.31Å; D180-L188 WeakPolarHBondContact OD2-CD2 3.47Å
181	P	79.3	Confident	86.9	Confident	62 Å²	62	36.8 Å²	36.8	40%	0.403	19%	0.193	S	C	.	.	S	Bend	trans	-66.1	-25.2	-178.9	27.2	-34.8	0	0	0	112.9
182	T	81.9	Confident	87.2	Confident	111 Å²	111	32.2 Å²	32.2	68%	0.681	17%	0.173	S	C	*	.	S	Bend	trans	-88	-33.1	-179	66.2	0	0	0	0	112.4	D180	D180-T182 PolarHBondContact O-N 2.84Å; D180-T182 WeakPolarHBondContact OD1-CA 3.32Å; D180-T182 WeakPolarHBondContact OD1-CB 3.45Å; D180-T182 PolarHBondContact OD1-N 2.98Å; D180-T182 PolarHBondContact OD1-OG1 3.42Å
183	V	79.5	Confident	87.3	Confident	56 Å²	56	30 Å²	30	34%	0.339	16%	0.161	S	C	.	.			trans	-132.3	90.4	-177.4	-176.3	0	0	0	0	109.1	D180 S185 R186	D180-V183 WeakPolarHBondContact CB-O 3.34Å; D180-V183 CarbonylContact O-C 3.58Å; D180-V183 PolarHBondContact O-N 3.25Å; D180-V183 PolarHBondContact OD1-N 2.68Å; V183-S185 PolarHBondContact O-N 2.82Å; V183-R186 HydrophobicContact CB-CB 4.02Å; V183-R186 HydrophobicContact CG1-CB 3.91Å; V183-R186 WeakPolarHBondContact O-CB 3.49Å; V183-R186 PolarHBondContact O-N 3.32Å
184	K	71.2	Confident	87.2	Confident	157 Å²	157	33.5 Å²	33.5	68%	0.683	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-21.8	-173.9	-67.6	-173.5	177.3	-177.8	0	115.1	R186 M277	K184-R186 VanDerWaalsContact C-N 3.31Å; K184-M277 VanDerWaalsContact O-CE 3.29Å; K184-M277 WeakPolarHBondContact O-CE 3.46Å
185	S	72.6	Confident	87	Confident	87 Å²	87	41.8 Å²	41.8	61%	0.608	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	7.4	176	57.8	0	0	0	0	114.6	V183	V183-S185 PolarHBondContact O-N 2.82Å
186	R	81.8	Confident	86.7	Confident	81 Å²	81	45.2 Å²	45.2	31%	0.306	24%	0.236	S	C	.	.			trans	-120.7	144.8	-177.3	-173.4	166.4	75	-176.2	-0.1	110.3	D180 V183 K184 P201	D180-R186 HydrophobicContact CB-CB 3.99Å; D180-R186 HydrophobicContact CB-CG 4.41Å; D180-R186 WeakPolarHBondContact CB-O 3.29Å; D180-R186 PolarHBondContact N-O 3.44Å; D180-R186 IonicContact OD2-CZ 3.66Å; D180-R186 IonicContact OD2-NE 2.76Å; D180-R186 PolarHBondContact OD2-NE 3.18Å; D180-R186 IonicContact OD2-NH2 3.16Å; D180-R186 PolarHBondContact OD2-NH2 3.44Å; V183-R186 HydrophobicContact CB-CB 4.02Å; V183-R186 HydrophobicContact CG1-CB 3.91Å; V183-R186 WeakPolarHBondContact O-CB 3.49Å; V183-R186 PolarHBondContact O-N 3.32Å; K184-R186 VanDerWaalsContact C-N 3.31Å; R186-P201 HydrophobicContact CG-CB 4.43Å
187	L	86.3	Confident	86.6	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	147.8	171.6	-62.5	-178	0	0	0	110.2	Q178 V179 V202 L204 L228 M277 W278 V281	Q178-L187 CarbonylContact O-C 3.59Å; Q178-L187 WeakPolarHBondContact O-CA 3.5Å; V179-L187 HydrophobicContact CG2-CD2 4.3Å; L187-V202 HydrophobicContact CB-CB 4.2Å; L187-V202 PolarHBondContact N-O 3.01Å; L187-V202 PolarHBondContact O-N 2.85Å; L187-L204 HydrophobicContact CD1-CD2 3.87Å; L187-L204 HydrophobicContact CD1-CG 4.49Å; L187-L204 HydrophobicContact CG-CD1 4.41Å; L187-L204 HydrophobicContact CG-CD2 4.37Å; L187-L204 HydrophobicContact CG-CG 4.47Å; L187-L228 HydrophobicContact CD1-CD2 3.76Å; L187-M277 HydrophobicContact CD2-CE 3.7Å; L187-M277 HydrophobicContact CG-CE 4.14Å; L187-W278 HydrophobicContact CD1-CE3 4.3Å; L187-W278 HydrophobicContact CD1-CH2 3.97Å; L187-W278 HydrophobicContact CD1-CZ3 3.51Å; L187-W278 HydrophobicContact CD2-CH2 3.3Å; L187-W278 HydrophobicContact CD2-CZ2 3.94Å; L187-W278 HydrophobicContact CD2-CZ3 3.75Å; L187-W278 HydrophobicContact CG-CH2 4.28Å; L187-W278 HydrophobicContact CG-CZ3 4.29Å; L187-V281 HydrophobicContact CD1-CG2 3.79Å
188	L	91	Very high	86.6	Confident	10 Å²	10	49.3 Å²	49.3	5%	0.052	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.6	171.4	-62.5	-178.7	0	0	0	108.4	L177 Q178 D180 R190 P201	L177-L188 WeakPolarHBondContact CA-O 3.3Å; Q178-L188 PolarHBondContact N-O 3.5Å; Q178-L188 PolarHBondContact O-N 3.3Å; D180-L188 HydrophobicContact CB-CD1 3.87Å; D180-L188 HydrophobicContact CB-CD2 4.11Å; D180-L188 HydrophobicContact CB-CG 3.68Å; D180-L188 VanDerWaalsContact OD2-CD2 3.31Å; D180-L188 WeakPolarHBondContact OD2-CD2 3.47Å; L188-R190 VanDerWaalsContact CD1-CZ 3.41Å; L188-R190 VanDerWaalsContact CD1-NH1 3.32Å; L188-P201 HydrophobicContact CD2-CB 4.08Å
189	L	93.4	Very high	86.8	Confident	3 Å²	3	52 Å²	52	2%	0.016	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	110	164.7	-177.2	66.3	0	0	0	107.5	F175 L177 I191 I200 V202 L242 L247	F175-L189 HydrophobicContact CB-CD1 4.31Å; F175-L189 HydrophobicContact CD2-CD1 3.69Å; F175-L189 HydrophobicContact CE2-CD1 4.46Å; F175-L189 HydrophobicContact CG-CD1 4.31Å; L177-L189 HydrophobicContact CD2-CB 4.13Å; L177-L189 HydrophobicContact CD2-CD1 3.78Å; L177-L189 HydrophobicContact CG-CD1 4.32Å; L189-I191 HydrophobicContact CD2-CD1 4.04Å; L189-I191 HydrophobicContact CD2-CG1 4.38Å; L189-I191 HydrophobicContact CG-CD1 4.08Å; L189-I191 HydrophobicContact CG-CG1 3.94Å; L189-I200 HydrophobicContact CB-CB 4.39Å; L189-I200 PolarHBondContact N-O 2.79Å; L189-I200 PolarHBondContact O-N 3.46Å; L189-V202 HydrophobicContact CB-CG2 3.83Å; L189-L242 HydrophobicContact CD2-CD2 3.64Å; L189-L247 HydrophobicContact CD2-CD1 3.77Å; L189-L247 HydrophobicContact CD2-CD2 3.94Å; L189-L247 HydrophobicContact CD2-CG 4.48Å; L189-L247 HydrophobicContact CG-CD2 4.46Å
190	R	94.7	Very high	87.3	Confident	25 Å²	25	51.9 Å²	51.9	9%	0.094	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	131.3	176.2	-57.7	-63.6	-165.6	-168	2.4	109	L165 L169 F175 L176 Q178 L188 R198 S199	L165-R190 HydrophobicContact CD1-CB 3.97Å; L165-R190 HydrophobicContact CD1-CG 4.16Å; L165-R190 HydrophobicContact CD2-CB 4.17Å; L165-R190 HydrophobicContact CD2-CG 4.08Å; L169-R190 HydrophobicContact CD1-CB 4.02Å; F175-R190 CarbonylContact C-O 3.58Å; F175-R190 WeakPolarHBondContact CA-O 3.29Å; F175-R190 VanDerWaalsContact CB-O 3.26Å; F175-R190 WeakPolarHBondContact CB-O 3.37Å; L176-R190 HydrophobicContact CD1-CB 3.81Å; L176-R190 HydrophobicContact CD1-CG 3.86Å; L176-R190 HydrophobicContact CG-CB 4.19Å; L176-R190 PolarHBondContact N-O 2.96Å; L176-R190 PolarHBondContact O-N 3.24Å; Q178-R190 HydrophobicContact CG-CG 4.43Å; Q178-R190 VanDerWaalsContact OE1-CG 3.31Å; L188-R190 VanDerWaalsContact CD1-CZ 3.41Å; L188-R190 VanDerWaalsContact CD1-NH1 3.32Å; R190-R198 WeakPolarHBondContact CA-O 3.36Å; R190-S199 WeakPolarHBondContact CD-OG 3.17Å; R190-S199 PolarHBondContact NH1-OG 3.21Å
191	I	95.3	Very high	87.5	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	129.8	-173.4	-48.8	160.2	0	0	0	108.6	D174 F175 L189 A197 R198 I200 A245 L247	D174-I191 CarbonylContact O-C 3.6Å; D174-I191 WeakPolarHBondContact O-CA 3.4Å; F175-I191 HydrophobicContact CB-CB 4.38Å; F175-I191 HydrophobicContact CB-CG1 3.97Å; F175-I191 HydrophobicContact CB-CG2 4.37Å; L189-I191 HydrophobicContact CD2-CD1 4.04Å; L189-I191 HydrophobicContact CD2-CG1 4.38Å; L189-I191 HydrophobicContact CG-CD1 4.08Å; L189-I191 HydrophobicContact CG-CG1 3.94Å; I191-A197 CarbonylContact O-C 3.6Å; I191-R198 PolarHBondContact N-O 2.72Å; I191-R198 PolarHBondContact O-N 2.76Å; I191-I200 HydrophobicContact CD1-CD1 3.49Å; I191-I200 VanDerWaalsContact CD1-CD1 3.49Å; I191-I200 HydrophobicContact CD1-CG1 4.09Å; I191-A245 HydrophobicContact CD1-CB 4.48Å; I191-A245 HydrophobicContact CG2-CB 4.41Å; I191-L247 HydrophobicContact CB-CD2 4.46Å; I191-L247 HydrophobicContact CD1-CD2 3.35Å; I191-L247 HydrophobicContact CG1-CD2 3.53Å; I191-L247 HydrophobicContact CG2-CD2 4.07Å
192	M	94.5	Very high	87.7	Confident	8 Å²	8	51.9 Å²	51.9	4%	0.039	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	126.4	167.5	177.4	59.4	71.4	0	0	109.3	I166 L169 K171 D172 G173 D174 K195 T196	I166-M192 HydrophobicContact CB-CE 4.32Å; I166-M192 HydrophobicContact CG1-CE 4.2Å; I166-M192 HydrophobicContact CG2-CE 4.1Å; L169-M192 HydrophobicContact CB-CB 3.59Å; L169-M192 HydrophobicContact CB-CE 4.44Å; L169-M192 WeakPolarHBondContact O-CB 3.49Å; L169-M192 WeakPolarHBondContact O-CE 3.45Å; L169-M192 WeakPolarHBondContact O-CG 3.41Å; K171-M192 WeakPolarHBondContact O-CB 3.34Å; D172-M192 CarbonylContact C-O 3.57Å; D172-M192 WeakPolarHBondContact CA-O 3.36Å; G173-M192 PolarHBondContact N-O 3.37Å; D174-M192 PolarHBondContact O-N 2.8Å; M192-K195 VanDerWaalsContact SD-C 3.51Å; M192-T196 PolarHBondContact SD-N 3.46Å; M192-T196 VanDerWaalsContact SD-N 3.4Å
193	W	93.6	Very high	87.3	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	127.3	176.5	-167	-97.6	0	0	0	111.3	D172 K195 T196 R198 G244 A245 L246 W471 P519 G522 V524	D172-W193 HydrophobicContact CB-CE3 4.09Å; D172-W193 HydrophobicContact CB-CZ3 4.26Å; D172-W193 WeakPolarHBondContact OD1-CA 3.48Å; W193-K195 VanDerWaalsContact C-N 3.26Å; W193-K195 PolarHBondContact O-N 3.04Å; W193-T196 PolarHBondContact N-O 3.47Å; W193-T196 PolarHBondContact O-N 3.34Å; W193-T196 VanDerWaalsContact O-O 3.12Å; W193-T196 PolarHBondContact O-OG1 3.39Å; W193-R198 HydrophobicContact CB-CG 4.42Å; W193-G244 PolarHBondContact NE1-O 2.95Å; W193-G244 VanDerWaalsContact NE1-O 3.13Å; W193-A245 HydrophobicContact CB-CB 4.04Å; W193-A245 HydrophobicContact CD2-CB 3.89Å; W193-A245 HydrophobicContact CE3-CB 4.16Å; W193-A245 HydrophobicContact CG-CB 3.83Å; W193-L246 HydrophobicContact CH2-CB 3.82Å; W193-L246 HydrophobicContact CH2-CD1 4.19Å; W193-L246 HydrophobicContact CH2-CG 3.84Å; W193-L246 HydrophobicContact CZ3-CB 3.67Å; W193-L246 HydrophobicContact CZ3-CG 4.23Å; W193-L246 VanDerWaalsContact CZ3-N 3.32Å; W193-W471 AromaticContact CZ2-CZ2 3.91Å; W193-W471 HydrophobicContact CZ2-CZ2 3.91Å; W193-P519 HydrophobicContact CH2-CB 4.2Å; W193-P519 HydrophobicContact CH2-CG 3.8Å; W193-P519 HydrophobicContact CZ2-CB 4.34Å; W193-P519 HydrophobicContact CZ2-CG 4.42Å; W193-P519 HydrophobicContact CZ3-CG 4.18Å; W193-G522 PolarHBondContact NE1-O 3.25Å; W193-V524 HydrophobicContact CH2-CG2 3.67Å; W193-V524 HydrophobicContact CZ2-CG2 3.8Å
194	N	90.1	Very high	86.8	Confident	73 Å²	73	56.2 Å²	56.2	39%	0.39	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.1	47.9	-178.2	-164.5	29	0	0	0	112	D172 T196	D172-N194 VanDerWaalsContact CG-N 3.35Å; D172-N194 PolarHBondContact OD1-N 2.91Å; D172-N194 PolarHBondContact OD2-N 3.04Å; N194-T196 PolarHBondContact O-N 3.48Å
195	K	87.3	Confident	86.4	Confident	187 Å²	187	51.5 Å²	51.5	81%	0.813	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	16.9	-177.8	-49.2	177.6	-179.1	179.3	0	115.1	M192 W193	M192-K195 VanDerWaalsContact SD-C 3.51Å; W193-K195 VanDerWaalsContact C-N 3.26Å; W193-K195 PolarHBondContact O-N 3.04Å
196	T	89.8	Confident	85.6	Confident	72 Å²	72	52.7 Å²	52.7	44%	0.442	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	136.2	177.2	63.4	0	0	0	0	111.2	M192 W193 N194 R198	M192-T196 PolarHBondContact SD-N 3.46Å; M192-T196 VanDerWaalsContact SD-N 3.4Å; W193-T196 PolarHBondContact N-O 3.47Å; W193-T196 PolarHBondContact O-N 3.34Å; W193-T196 VanDerWaalsContact O-O 3.12Å; W193-T196 PolarHBondContact O-OG1 3.39Å; N194-T196 PolarHBondContact O-N 3.48Å; T196-R198 PolarHBondContact O-N 2.71Å
197	A	90.4	Very high	84.4	Confident	16 Å²	16	52.6 Å²	52.6	13%	0.132	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	102.4	172.7	0	0	0	0	0	109.8	L165 I191	L165-A197 HydrophobicContact CD2-CB 3.66Å; L165-A197 HydrophobicContact CG-CB 4.07Å; I191-A197 CarbonylContact O-C 3.6Å
198	R	91.7	Very high	83	Confident	71 Å²	71	58 Å²	58	27%	0.268	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	152.9	177.4	-65.7	-171.8	177.5	-153.1	-2.5	111.1	R190 I191 W193 T196 K243 D472	R190-R198 WeakPolarHBondContact CA-O 3.36Å; I191-R198 PolarHBondContact N-O 2.72Å; I191-R198 PolarHBondContact O-N 2.76Å; W193-R198 HydrophobicContact CB-CG 4.42Å; T196-R198 PolarHBondContact O-N 2.71Å; R198-K243 PolarHBondContact NH1-O 3.31Å; R198-K243 VanDerWaalsContact NH1-O 3.14Å; R198-D472 IonicContact NH1-OD2 3.86Å; R198-D472 PolarHBondContact NH1-OD2 3.29Å; R198-D472 VanDerWaalsContact NH1-OD2 3.16Å
199	S	92	Very high	82	Confident	55 Å²	55	60.3 Å²	60.3	39%	0.385	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	110.6	-173.5	-61.2	0	0	0	0	111	R190	R190-S199 WeakPolarHBondContact CD-OG 3.17Å; R190-S199 PolarHBondContact NH1-OG 3.21Å
200	I	91.5	Very high	81.5	Confident	11 Å²	11	61.5 Å²	61.5	6%	0.056	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	116.1	-175.8	-55.9	-173.3	0	0	0	109.5	L189 I191 V202 L242 K243	L189-I200 HydrophobicContact CB-CB 4.39Å; L189-I200 PolarHBondContact N-O 2.79Å; L189-I200 PolarHBondContact O-N 3.46Å; I191-I200 HydrophobicContact CD1-CD1 3.49Å; I191-I200 VanDerWaalsContact CD1-CD1 3.49Å; I191-I200 HydrophobicContact CD1-CG1 4.09Å; I200-V202 PolarHBondContact O-N 3.41Å; I200-L242 HydrophobicContact CD1-CB 4.35Å; I200-L242 HydrophobicContact CD1-CD2 3.94Å; I200-L242 HydrophobicContact CD1-CG 3.78Å; I200-L242 VanDerWaalsContact CD1-O 3.28Å; I200-L242 WeakPolarHBondContact CD1-O 3.11Å; I200-L242 HydrophobicContact CG2-CD2 4.24Å; I200-L242 HydrophobicContact CG2-CG 4.37Å; I200-K243 HydrophobicContact CD1-CB 4.07Å; I200-K243 HydrophobicContact CD1-CD 4.49Å; I200-K243 HydrophobicContact CD1-CG 4.44Å; I200-K243 HydrophobicContact CG1-CD 4.47Å; I200-K243 HydrophobicContact CG2-CD 4.13Å
201	P	89.1	Confident	81.1	Confident	49 Å²	49	60.6 Å²	60.6	32%	0.318	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	125.8	176.7	26.6	-32.5	0	0	0	110.9	R186 L188	R186-P201 HydrophobicContact CG-CB 4.43Å; L188-P201 HydrophobicContact CD2-CB 4.08Å
202	V	83.9	Confident	80.8	Confident	17 Å²	17	63.9 Å²	63.9	10%	0.103	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	116.5	174	179.5	0	0	0	0	108	L187 L189 I200 L204 L228	L187-V202 HydrophobicContact CB-CB 4.2Å; L187-V202 PolarHBondContact N-O 3.01Å; L187-V202 PolarHBondContact O-N 2.85Å; L189-V202 HydrophobicContact CB-CG2 3.83Å; I200-V202 PolarHBondContact O-N 3.41Å; V202-L204 PolarHBondContact O-N 3.46Å; V202-L228 HydrophobicContact CG1-CD1 3.56Å; V202-L228 HydrophobicContact CG1-CD2 4.04Å; V202-L228 HydrophobicContact CG1-CG 4.47Å
203	R	74.1	Confident	80.7	Confident	222 Å²	222	63.7 Å²	63.7	84%	0.838	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-80.9	119	174.2	-68.4	-173.8	179.2	-178.5	0.1	108.9	N205	R203-N205 PolarHBondContact O-N 3.14Å
204	L	68.9	Low	80.4	Confident	36 Å²	36	65 Å²	65	19%	0.188	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-67.9	120.8	167.7	-65.3	173.6	0	0	0	108.1	L187 V202 S206 Y211 M277 V281	L187-L204 HydrophobicContact CD1-CD2 3.87Å; L187-L204 HydrophobicContact CD1-CG 4.49Å; L187-L204 HydrophobicContact CG-CD1 4.41Å; L187-L204 HydrophobicContact CG-CD2 4.37Å; L187-L204 HydrophobicContact CG-CG 4.47Å; V202-L204 PolarHBondContact O-N 3.46Å; L204-S206 PolarHBondContact O-N 3.18Å; L204-Y211 WeakPolarHBondContact CD2-OH 3.2Å; L204-M277 HydrophobicContact CD1-CB 4.17Å; L204-M277 HydrophobicContact CD1-CE 3.79Å; L204-M277 HydrophobicContact CD1-CG 4.02Å; L204-V281 HydrophobicContact CD2-CG2 4.07Å
205	N	63.5	Low	80.2	Confident	59 Å²	59	67.2 Å²	67.2	32%	0.316	36%	0.355	S	S	.	.			trans	-82.6	97.1	178.9	-170.3	-6.2	0	0	0	109.9	R203 A207 Q209 L210	R203-N205 PolarHBondContact O-N 3.14Å; N205-A207 PolarHBondContact OD1-N 2.78Å; N205-Q209 VanDerWaalsContact O-CA 3.31Å; N205-Q209 WeakPolarHBondContact O-CA 3.48Å; N205-Q209 PolarHBondContact O-N 2.91Å; N205-L210 PolarHBondContact ND2-O 2.94Å
206	S	54.4	Low	79.6	Confident	111 Å²	111	60.4 Å²	60.4	78%	0.776	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-28.5	-179	54.9	0	0	0	0	114	L204	L204-S206 PolarHBondContact O-N 3.18Å
207	A	56.2	Low	79	Confident	80 Å²	80	58.9 Å²	58.9	66%	0.661	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-44.6	-166.9	0	0	0	0	0	113.4	N205	N205-A207 PolarHBondContact OD1-N 2.78Å
208	N	58.6	Low	78.4	Confident	113 Å²	113	64.2 Å²	64.2	60%	0.604	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.1	-6.7	-178.1	-65.8	-14.5	0	0	0	113.2	L210	N208-L210 PolarHBondContact O-N 2.89Å
209	Q	69.4	Low	77.7	Confident	59 Å²	59	67.2 Å²	67.2	28%	0.276	38%	0.382	S	S	.	.			trans	51.9	27.2	-176.5	-58.4	-177	-12.8	0	0	114.2	N205 R283	N205-Q209 VanDerWaalsContact O-CA 3.31Å; N205-Q209 WeakPolarHBondContact O-CA 3.48Å; N205-Q209 PolarHBondContact O-N 2.91Å; Q209-R283 VanDerWaalsContact OE1-NE 3.08Å
210	L	82	Confident	77.4	Confident	27 Å²	27	65.5 Å²	65.5	14%	0.141	37%	0.369	C	S	.	.			trans	-116.4	128.9	175.7	-72	-178.4	0	0	0	108.7	N205 N208 H224 V225 D226 T376	N205-L210 PolarHBondContact ND2-O 2.94Å; N208-L210 PolarHBondContact O-N 2.89Å; L210-H224 HydrophobicContact CB-CB 4.02Å; L210-H224 HydrophobicContact CD1-CB 4.15Å; L210-H224 HydrophobicContact CD2-CB 4.41Å; L210-H224 HydrophobicContact CG-CB 4.43Å; L210-V225 CarbonylContact C-O 3.53Å; L210-V225 WeakPolarHBondContact CA-O 3.23Å; L210-D226 HydrophobicContact CD2-CB 4.07Å; L210-T376 HydrophobicContact CD2-CG2 4.46Å
211	Y	86.5	Confident	77.3	Confident	7 Å²	7	66.7 Å²	66.7	3%	0.027	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	124.5	173.6	-61.3	-88.1	0	0	0	108.9	L204 L213 H224 V225 L228 L231 A280	L204-Y211 WeakPolarHBondContact CD2-OH 3.2Å; Y211-L213 PolarHBondContact O-N 2.77Å; Y211-H224 CarbonylContact O-C 3.55Å; Y211-H224 VanDerWaalsContact O-CA 3.27Å; Y211-H224 WeakPolarHBondContact O-CA 3.26Å; Y211-V225 PolarHBondContact N-O 3.09Å; Y211-V225 PolarHBondContact O-N 3.48Å; Y211-L228 HydrophobicContact CE1-CB 4.47Å; Y211-L228 HydrophobicContact CE1-CD1 4.36Å; Y211-L228 HydrophobicContact CE2-CB 4.24Å; Y211-L231 HydrophobicContact CD1-CD2 4.06Å; Y211-L231 HydrophobicContact CG-CD2 4.27Å; Y211-A280 PolarHBondContact OH-O 2.8Å
212	P	89.7	Confident	77.3	Confident	69 Å²	69	67.6 Å²	67.6	45%	0.448	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	131.9	175.6	28.9	-33.3	0	0	0	109.5	I222 E223 L231	P212-I222 HydrophobicContact CB-CG2 3.99Å; P212-E223 WeakPolarHBondContact CA-O 3.36Å; P212-L231 WeakPolarHBondContact O-CD1 3.01Å
213	L	91.1	Very high	77.7	Confident	3 Å²	3	67 Å²	67	2%	0.016	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-72.9	152.4	168.1	-73.3	-179.7	0	0	0	109.9	Y211 E223 V225 L231 P297 P299 T377	Y211-L213 PolarHBondContact O-N 2.77Å; L213-E223 HydrophobicContact CB-CB 4.16Å; L213-E223 HydrophobicContact CD1-CB 3.93Å; L213-E223 HydrophobicContact CG-CB 4.45Å; L213-E223 PolarHBondContact N-O 3.14Å; L213-V225 HydrophobicContact CD1-CG1 3.93Å; L213-V225 HydrophobicContact CD2-CG1 3.74Å; L213-V225 HydrophobicContact CD2-CG2 4.12Å; L213-V225 HydrophobicContact CG-CG1 3.88Å; L213-L231 HydrophobicContact CD2-CD1 4.15Å; L213-P297 HydrophobicContact CD1-CB 4.5Å; L213-P297 HydrophobicContact CD1-CG 4.17Å; L213-P299 HydrophobicContact CB-CB 4.33Å; L213-P299 HydrophobicContact CB-CG 4.15Å; L213-P299 HydrophobicContact CD1-CB 4.49Å; L213-P299 HydrophobicContact CD1-CG 4.26Å; L213-T377 HydrophobicContact CD1-CG2 3.84Å
214	P	88.1	Confident	78.5	Confident	29 Å²	29	57.9 Å²	57.9	19%	0.188	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-61.1	147.6	170.7	26.9	-34.3	0	0	0	110.3	I240 P299 Q301	P214-I240 HydrophobicContact CB-CD1 4.19Å; P214-I240 HydrophobicContact CB-CG2 3.96Å; P214-I240 HydrophobicContact CG-CB 4.45Å; P214-I240 HydrophobicContact CG-CD1 3.32Å; P214-I240 HydrophobicContact CG-CG1 4.44Å; P214-I240 HydrophobicContact CG-CG2 3.96Å; P214-P299 HydrophobicContact CG-CG 3.89Å; P214-P299 WeakPolarHBondContact O-CB 2.73Å; P214-Q301 VanDerWaalsContact C-NE2 3.32Å; P214-Q301 PolarHBondContact O-NE2 3.44Å; P214-Q301 PolarHBondContact O-OE1 3.11Å
215	Y	85.5	Confident	79.4	Confident	118 Å²	118	56.1 Å²	56.1	46%	0.463	33%	0.332	S	S	.	.			trans	-131.9	151.9	-178.7	53.6	-90.9	0	0	0	110.3	S217 I222	Y215-S217 WeakPolarHBondContact CD2-O 3.38Å; Y215-I222 HydrophobicContact CD1-CG1 4.38Å; Y215-I222 HydrophobicContact CE1-CG1 4.41Å
216	G	75.1	Confident	80.3	Confident	44 Å²	44	54.5 Å²	54.5	45%	0.454	32%	0.323	S	S	.	.	S	Bend	trans	-84.1	-29.9	-173.8	0	0	0	0	0	114.1	E220	G216-E220 VanDerWaalsContact CA-OE2 3.28Å; G216-E220 WeakPolarHBondContact CA-OE2 2.74Å; G216-E220 PolarHBondContact N-OE2 3.28Å
217	S	78	Confident	81.7	Confident	41 Å²	41	49.2 Å²	49.2	29%	0.287	29%	0.286	S	S	.	.	S	Bend	trans	-143.9	159.4	176.5	84.3	0	0	0	0	112	Y215 D219 E220	Y215-S217 WeakPolarHBondContact CD2-O 3.38Å; S217-D219 PolarHBondContact O-N 2.68Å; S217-D219 PolarHBondContact OG-N 2.66Å; S217-E220 PolarHBondContact N-OE2 2.98Å; S217-E220 PolarHBondContact O-N 3.02Å; S217-E220 PolarHBondContact OG-N 3.15Å
218	V	76.3	Confident	83.1	Confident	128 Å²	128	45.4 Å²	45.4	78%	0.776	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-18	176	-67.6	0	0	0	0	113.5
219	D	78.6	Confident	84.5	Confident	133 Å²	133	40 Å²	40	71%	0.711	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-16.4	-179.9	-55	-48.2	0	0	0	112	S217	S217-D219 PolarHBondContact O-N 2.68Å; S217-D219 PolarHBondContact OG-N 2.66Å
220	E	84.9	Confident	85.4	Confident	20 Å²	20	37.3 Å²	37.3	9%	0.093	21%	0.214	C	C	.	.	S	Bend	trans	-73.6	143.1	177.2	-76.3	172.5	177.6	0	0	111.9	G216 S217 I222 L300 Y306	G216-E220 VanDerWaalsContact CA-OE2 3.28Å; G216-E220 WeakPolarHBondContact CA-OE2 2.74Å; G216-E220 PolarHBondContact N-OE2 3.28Å; S217-E220 PolarHBondContact N-OE2 2.98Å; S217-E220 PolarHBondContact O-N 3.02Å; S217-E220 PolarHBondContact OG-N 3.15Å; E220-I222 PolarHBondContact O-N 3.43Å; E220-L300 HydrophobicContact CG-CD2 4.29Å; E220-Y306 VanDerWaalsContact OE1-CE1 3.32Å; E220-Y306 WeakPolarHBondContact OE1-CE1 3.26Å; E220-Y306 PolarHBondContact OE1-OH 3.38Å
221	P	89.2	Confident	85.8	Confident	35 Å²	35	37.3 Å²	37.3	23%	0.227	21%	0.213	C	C	.	.			trans	-66.2	122.1	177.8	27.4	-34	0	0	0	110.6	E223 L300 L336 F364	P221-E223 PolarHBondContact O-N 3.47Å; P221-L300 HydrophobicContact CG-CD2 3.97Å; P221-L336 HydrophobicContact CG-CD2 4.04Å; P221-F364 HydrophobicContact CB-CE1 4.03Å; P221-F364 HydrophobicContact CB-CZ 4.06Å; P221-F364 HydrophobicContact CG-CE1 4.06Å; P221-F364 HydrophobicContact CG-CZ 4.38Å
222	I	89.5	Confident	86	Confident	69 Å²	69	37.1 Å²	37.1	35%	0.354	21%	0.213	S	C	.	.			trans	-61.4	111.4	178	-55.7	174.4	0	0	0	110.5	P212 Y215 E220 H224 K357	P212-I222 HydrophobicContact CB-CG2 3.99Å; Y215-I222 HydrophobicContact CD1-CG1 4.38Å; Y215-I222 HydrophobicContact CE1-CG1 4.41Å; E220-I222 PolarHBondContact O-N 3.43Å; I222-H224 PolarHBondContact O-CE1 3.45Å; I222-H224 VanDerWaalsContact O-CE1 3.25Å; I222-H224 PolarHBondContact O-ND1 3.3Å; I222-K357 PolarHBondContact O-NZ 3.36Å
223	E	93.1	Very high	86.1	Confident	5 Å²	5	33.9 Å²	33.9	2%	0.023	19%	0.192	C	C	.	.			trans	-83.8	158.9	175.1	-69.8	174.6	109.2	0	0	111.8	P212 L213 P221 P299 L300 F364 T377 A378	P212-E223 WeakPolarHBondContact CA-O 3.36Å; L213-E223 HydrophobicContact CB-CB 4.16Å; L213-E223 HydrophobicContact CD1-CB 3.93Å; L213-E223 HydrophobicContact CG-CB 4.45Å; L213-E223 PolarHBondContact N-O 3.14Å; P221-E223 PolarHBondContact O-N 3.47Å; E223-P299 VanDerWaalsContact OE2-CA 3.26Å; E223-P299 WeakPolarHBondContact OE2-CA 3.06Å; E223-L300 WeakPolarHBondContact OE2-CB 3.48Å; E223-L300 PolarHBondContact OE2-N 2.92Å; E223-F364 HydrophobicContact CG-CE1 4.5Å; E223-F364 HydrophobicContact CG-CE2 3.9Å; E223-F364 HydrophobicContact CG-CZ 3.61Å; E223-T377 HydrophobicContact CB-CG2 4.37Å; E223-T377 VanDerWaalsContact OE1-CA 3.22Å; E223-T377 WeakPolarHBondContact OE1-CA 3.49Å; E223-T377 WeakPolarHBondContact OE1-CB 3.43Å; E223-A378 PolarHBondContact OE1-N 3.02Å
224	H	90.3	Very high	86	Confident	29 Å²	29	33.8 Å²	33.8	13%	0.134	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	153.3	-176.5	-62.2	66.7	0	0	0	111.5	L210 Y211 I222 T376	L210-H224 HydrophobicContact CB-CB 4.02Å; L210-H224 HydrophobicContact CD1-CB 4.15Å; L210-H224 HydrophobicContact CD2-CB 4.41Å; L210-H224 HydrophobicContact CG-CB 4.43Å; Y211-H224 CarbonylContact O-C 3.55Å; Y211-H224 VanDerWaalsContact O-CA 3.27Å; Y211-H224 WeakPolarHBondContact O-CA 3.26Å; I222-H224 PolarHBondContact O-CE1 3.45Å; I222-H224 VanDerWaalsContact O-CE1 3.25Å; I222-H224 PolarHBondContact O-ND1 3.3Å; H224-T376 PolarHBondContact N-O 2.78Å; H224-T376 WeakPolarHBondContact O-CB 3.41Å; H224-T376 PolarHBondContact O-OG1 3.49Å
225	V	88.5	Confident	86.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	154.5	169.1	-66.1	0	0	0	0	109.8	L210 Y211 L213 E230 L231 P297	L210-V225 CarbonylContact C-O 3.53Å; L210-V225 WeakPolarHBondContact CA-O 3.23Å; Y211-V225 PolarHBondContact N-O 3.09Å; Y211-V225 PolarHBondContact O-N 3.48Å; L213-V225 HydrophobicContact CD1-CG1 3.93Å; L213-V225 HydrophobicContact CD2-CG1 3.74Å; L213-V225 HydrophobicContact CD2-CG2 4.12Å; L213-V225 HydrophobicContact CG-CG1 3.88Å; V225-E230 HydrophobicContact CB-CB 3.74Å; V225-E230 WeakPolarHBondContact CB-OE2 3.45Å; V225-E230 HydrophobicContact CG1-CB 3.96Å; V225-E230 HydrophobicContact CG2-CB 4.03Å; V225-L231 HydrophobicContact CG2-CB 3.87Å; V225-P297 HydrophobicContact CG1-CG 3.33Å
226	D	81.2	Confident	86.5	Confident	24 Å²	24	27.7 Å²	27.7	13%	0.128	17%	0.165	C	C	.	.	S	Bend	trans	-92.2	-14.4	-173	53.8	19.3	0	0	0	114.1	L210 R283 R284 N285	L210-D226 HydrophobicContact CD2-CB 4.07Å; D226-R283 CarbonylContact C-O 3.58Å; D226-R283 VanDerWaalsContact C-O 3.25Å; D226-R283 WeakPolarHBondContact CB-O 3.32Å; D226-R283 VanDerWaalsContact O-O 3.1Å; D226-R283 VanDerWaalsContact OD1-O 3.12Å; D226-R284 VanDerWaalsContact OD2-C 3.27Å; D226-R284 WeakPolarHBondContact OD2-CA 3.3Å; D226-N285 VanDerWaalsContact OD2-CB 3.29Å; D226-N285 WeakPolarHBondContact OD2-CB 3.18Å; D226-N285 PolarHBondContact OD2-N 3.33Å
227	C	83.1	Confident	87	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.146	C	C	.	.	S	Bend	trans	-132.9	153.4	-177.9	81.3	0	0	0	0	112.2	D229 E230 L231 V281 R283 R284	C227-D229 VanDerWaalsContact C-N 3.33Å; C227-D229 PolarHBondContact O-N 3.39Å; C227-E230 PolarHBondContact O-N 3.23Å; C227-E230 WeakPolarHBondContact SG-CG 3.36Å; C227-E230 PolarHBondContact SG-N 3.23Å; C227-E230 VanDerWaalsContact SG-N 3.39Å; C227-L231 PolarHBondContact O-N 3.17Å; C227-V281 VanDerWaalsContact CB-O 3.23Å; C227-V281 WeakPolarHBondContact CB-O 3.27Å; C227-R283 WeakPolarHBondContact CB-O 3.47Å; C227-R284 HydrophobicContact CB-CG 3.91Å
228	L	85.6	Confident	87.4	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-71.2	-30.6	-177.2	175	63.8	0	0	0	111.9	L177 L187 V202 Y211 E230 L231 V232 V281	L177-L228 HydrophobicContact CD1-CD2 3.9Å; L177-L228 HydrophobicContact CD2-CD2 4.29Å; L187-L228 HydrophobicContact CD1-CD2 3.76Å; V202-L228 HydrophobicContact CG1-CD1 3.56Å; V202-L228 HydrophobicContact CG1-CD2 4.04Å; V202-L228 HydrophobicContact CG1-CG 4.47Å; Y211-L228 HydrophobicContact CE1-CB 4.47Å; Y211-L228 HydrophobicContact CE1-CD1 4.36Å; Y211-L228 HydrophobicContact CE2-CB 4.24Å; L228-E230 VanDerWaalsContact C-N 3.3Å; L228-E230 PolarHBondContact O-N 3.47Å; L228-L231 HydrophobicContact CD1-CB 4.39Å; L228-L231 HydrophobicContact CD1-CD2 3.93Å; L228-L231 PolarHBondContact O-N 3.46Å; L228-V232 HydrophobicContact CD1-CG2 3.91Å; L228-V232 HydrophobicContact CG-CG2 4.17Å; L228-V232 WeakPolarHBondContact O-CB 3.32Å; L228-V232 WeakPolarHBondContact O-CG2 3.34Å; L228-V232 PolarHBondContact O-N 2.87Å; L228-V281 HydrophobicContact CB-CB 4.37Å; L228-V281 HydrophobicContact CB-CG1 4.1Å; L228-V281 HydrophobicContact CB-CG2 4.14Å; L228-V281 HydrophobicContact CD2-CG2 3.83Å; L228-V281 PolarHBondContact N-O 3.14Å; L228-V281 VanDerWaalsContact N-O 3.12Å
229	D	88.3	Confident	87.9	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-59.9	-41.9	174	-173.1	35.1	0	0	0	111	L147 E148 L153 Y155 C227 K233 R284	L147-D229 WeakPolarHBondContact CA-OD2 3.42Å; E148-D229 PolarHBondContact N-OD2 3.24Å; L153-D229 HydrophobicContact CD1-CB 4.3Å; L153-D229 HydrophobicContact CD2-CB 3.78Å; Y155-D229 PolarHBondContact OH-OD1 2.84Å; C227-D229 VanDerWaalsContact C-N 3.33Å; C227-D229 PolarHBondContact O-N 3.39Å; D229-K233 VanDerWaalsContact O-CB 3.26Å; D229-K233 WeakPolarHBondContact O-CB 3.25Å; D229-K233 PolarHBondContact O-N 2.88Å; D229-K233 VanDerWaalsContact OD1-CD 3.26Å; D229-K233 WeakPolarHBondContact OD1-CD 3.43Å; D229-K233 WeakPolarHBondContact OD1-CE 3.08Å; D229-K233 IonicContact OD1-NZ 2.66Å; D229-K233 PolarHBondContact OD1-NZ 3.43Å; D229-K233 IonicContact OD2-NZ 2.94Å; D229-R284 IonicContact OD2-NH2 3.87Å; D229-R284 PolarHBondContact OD2-NH2 2.87Å
230	E	89.4	Confident	88.4	Confident	3 Å²	3	12.9 Å²	12.9	1%	0.014	7%	0.066	C	C	.	.	H	α-helix	trans	-64.3	-42.1	174.1	-80.7	-175.7	169.6	0	0	112.1	L147 V225 C227 L228 S234 S289 R292 A296	L147-E230 HydrophobicContact CD1-CG 3.75Å; L147-E230 HydrophobicContact CD2-CB 4.42Å; L147-E230 HydrophobicContact CD2-CG 3.65Å; L147-E230 HydrophobicContact CG-CG 4.37Å; V225-E230 HydrophobicContact CB-CB 3.74Å; V225-E230 WeakPolarHBondContact CB-OE2 3.45Å; V225-E230 HydrophobicContact CG1-CB 3.96Å; V225-E230 HydrophobicContact CG2-CB 4.03Å; C227-E230 PolarHBondContact O-N 3.23Å; C227-E230 WeakPolarHBondContact SG-CG 3.36Å; C227-E230 PolarHBondContact SG-N 3.23Å; C227-E230 VanDerWaalsContact SG-N 3.39Å; L228-E230 VanDerWaalsContact C-N 3.3Å; L228-E230 PolarHBondContact O-N 3.47Å; E230-S234 WeakPolarHBondContact O-CB 3.36Å; E230-S234 PolarHBondContact O-N 3.18Å; E230-S289 PolarHBondContact OE1-OG 3.43Å; E230-R292 VanDerWaalsContact CD-NH2 3.33Å; E230-R292 IonicContact OE1-CZ 3.32Å; E230-R292 IonicContact OE1-NH2 2.66Å; E230-R292 PolarHBondContact OE1-NH2 3.46Å; E230-R292 IonicContact OE2-NH2 2.6Å; E230-A296 WeakPolarHBondContact O-CB 3.25Å
231	L	90.2	Very high	88.6	Confident	26 Å²	26	13.1 Å²	13.1	14%	0.136	7%	0.07	C	C	.	.	H	α-helix	trans	-61.6	-51.2	177.6	178.2	69.2	0	0	0	111.1	Y211 P212 L213 V225 C227 L228 S234 H235	Y211-L231 HydrophobicContact CD1-CD2 4.06Å; Y211-L231 HydrophobicContact CG-CD2 4.27Å; P212-L231 WeakPolarHBondContact O-CD1 3.01Å; L213-L231 HydrophobicContact CD2-CD1 4.15Å; V225-L231 HydrophobicContact CG2-CB 3.87Å; C227-L231 PolarHBondContact O-N 3.17Å; L228-L231 HydrophobicContact CD1-CB 4.39Å; L228-L231 HydrophobicContact CD1-CD2 3.93Å; L228-L231 PolarHBondContact O-N 3.46Å; L231-S234 WeakPolarHBondContact O-CB 3.45Å; L231-S234 PolarHBondContact O-N 2.65Å; L231-H235 PolarHBondContact O-N 3.39Å; L231-H235 PolarHBondContact O-ND1 3.34Å
232	V	91.1	Very high	88.6	Confident	4 Å²	4	13.4 Å²	13.4	2%	0.024	7%	0.069	C	C	.	.	H	α-helix	trans	-64.3	-47.7	-177	168.2	0	0	0	0	110.3	Y155 F175 L228 S234 H235 V236 L247	Y155-V232 HydrophobicContact CE2-CG1 4.45Å; F175-V232 HydrophobicContact CD2-CG1 4.22Å; F175-V232 HydrophobicContact CE2-CG1 3.36Å; F175-V232 HydrophobicContact CZ-CG1 3.63Å; L228-V232 HydrophobicContact CD1-CG2 3.91Å; L228-V232 HydrophobicContact CG-CG2 4.17Å; L228-V232 WeakPolarHBondContact O-CB 3.32Å; L228-V232 WeakPolarHBondContact O-CG2 3.34Å; L228-V232 PolarHBondContact O-N 2.87Å; V232-S234 VanDerWaalsContact C-N 3.28Å; V232-S234 PolarHBondContact O-N 2.96Å; V232-H235 WeakPolarHBondContact O-CB 3.18Å; V232-H235 PolarHBondContact O-N 3.12Å; V232-H235 VanDerWaalsContact O-N 3.14Å; V232-V236 WeakPolarHBondContact O-CG2 3.36Å; V232-V236 PolarHBondContact O-N 3.49Å; V232-L247 HydrophobicContact CG1-CD1 3.97Å
233	K	90.4	Very high	88.5	Confident	1 Å²	1	16.3 Å²	16.3	0%	0.004	8%	0.079	C	C	.	.	H	α-helix	trans	-73.1	-20.8	179	-72.8	-179.2	174.8	145.1	0	113.1	K146 L147 D229 V236 R237 A296	K146-K233 VanDerWaalsContact O-CD 3.32Å; K146-K233 WeakPolarHBondContact O-CD 3.08Å; K146-K233 WeakPolarHBondContact O-CE 3.4Å; K146-K233 PolarHBondContact O-NZ 3.05Å; L147-K233 HydrophobicContact CD2-CB 4.36Å; L147-K233 HydrophobicContact CD2-CD 4.08Å; D229-K233 VanDerWaalsContact O-CB 3.26Å; D229-K233 WeakPolarHBondContact O-CB 3.25Å; D229-K233 PolarHBondContact O-N 2.88Å; D229-K233 VanDerWaalsContact OD1-CD 3.26Å; D229-K233 WeakPolarHBondContact OD1-CD 3.43Å; D229-K233 WeakPolarHBondContact OD1-CE 3.08Å; D229-K233 IonicContact OD1-NZ 2.66Å; D229-K233 PolarHBondContact OD1-NZ 3.43Å; D229-K233 IonicContact OD2-NZ 2.94Å; K233-V236 PolarHBondContact O-N 3.27Å; K233-R237 WeakPolarHBondContact O-CB 3.5Å; K233-R237 PolarHBondContact O-N 3.45Å; K233-A296 VanDerWaalsContact C-CB 3.44Å; K233-A296 HydrophobicContact CB-CB 3.59Å
234	S	90.5	Very high	88.3	Confident	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-65.1	-43.3	168	-176.3	0	0	0	0	110.3	E230 L231 V232 V236 R237 C238 A296 P297 P299	E230-S234 WeakPolarHBondContact O-CB 3.36Å; E230-S234 PolarHBondContact O-N 3.18Å; L231-S234 WeakPolarHBondContact O-CB 3.45Å; L231-S234 PolarHBondContact O-N 2.65Å; V232-S234 VanDerWaalsContact C-N 3.28Å; V232-S234 PolarHBondContact O-N 2.96Å; S234-V236 VanDerWaalsContact C-N 3.35Å; S234-V236 PolarHBondContact O-N 2.86Å; S234-R237 PolarHBondContact O-N 2.79Å; S234-C238 WeakPolarHBondContact O-CB 3.19Å; S234-C238 PolarHBondContact O-N 3.32Å; S234-C238 PolarHBondContact O-SG 3.4Å; S234-A296 VanDerWaalsContact N-CB 3.32Å; S234-P297 VanDerWaalsContact CB-O 3.24Å; S234-P297 WeakPolarHBondContact CB-O 3.44Å; S234-P297 PolarHBondContact OG-O 3.25Å; S234-P299 WeakPolarHBondContact OG-CD 3.43Å
235	H	91.6	Very high	88.4	Confident	15 Å²	15	14.8 Å²	14.8	7%	0.069	7%	0.073	C	C	.	.	H	α-helix	trans	-63.2	-39.4	173.2	-72	75.6	0	0	0	112.2	L231 V232 Q239 I240 L247	L231-H235 PolarHBondContact O-N 3.39Å; L231-H235 PolarHBondContact O-ND1 3.34Å; V232-H235 WeakPolarHBondContact O-CB 3.18Å; V232-H235 PolarHBondContact O-N 3.12Å; V232-H235 VanDerWaalsContact O-N 3.14Å; H235-Q239 VanDerWaalsContact O-CA 3.25Å; H235-Q239 WeakPolarHBondContact O-CA 3.12Å; H235-Q239 PolarHBondContact O-N 2.91Å; H235-I240 PolarHBondContact O-N 3.34Å; H235-I240 VanDerWaalsContact O-N 3.11Å; H235-L247 HydrophobicContact CB-CD1 3.88Å; H235-L247 HydrophobicContact CB-CG 4.42Å
236	V	90.9	Very high	88.5	Confident	4 Å²	4	14.8 Å²	14.8	2%	0.024	7%	0.073	C	C	.	.	H	α-helix	trans	-63.7	-53.7	175.1	176.1	0	0	0	0	111.3	C144 V145 F175 V232 K233 S234 C238 Q239 L247 R248	C144-V236 HydrophobicContact CB-CG1 4.14Å; V145-V236 HydrophobicContact CG1-CG1 4.15Å; F175-V236 HydrophobicContact CE1-CG2 3.5Å; F175-V236 HydrophobicContact CZ-CG2 3.71Å; V232-V236 WeakPolarHBondContact O-CG2 3.36Å; V232-V236 PolarHBondContact O-N 3.49Å; K233-V236 PolarHBondContact O-N 3.27Å; S234-V236 VanDerWaalsContact C-N 3.35Å; S234-V236 PolarHBondContact O-N 2.86Å; V236-C238 VanDerWaalsContact C-N 3.27Å; V236-C238 PolarHBondContact O-N 2.82Å; V236-Q239 PolarHBondContact O-N 2.81Å; V236-Q239 PolarHBondContact O-NE2 3.17Å; V236-L247 WeakPolarHBondContact CA-O 3.18Å; V236-L247 HydrophobicContact CG2-CB 3.54Å; V236-R248 WeakPolarHBondContact CG1-O 3.42Å
237	R	86.9	Confident	89.1	Confident	14 Å²	14	13.7 Å²	13.7	5%	0.053	7%	0.067	C	C	.	.	H	α-helix	trans	-58.1	-43.9	-179.2	-175.2	177.9	-177.2	-159	-5.3	110.5	W10 E13 V145 K233 S234 A296 R298 E379	W10-R237 PolarHBondContact N-O 3.45Å; E13-R237 IonicContact OE1-CZ 3.09Å; E13-R237 IonicContact OE1-NE 3.68Å; E13-R237 IonicContact OE1-NH2 2.72Å; E13-R237 PolarHBondContact OE1-NH2 3.39Å; E13-R237 IonicContact OE2-NH2 2.66Å; V145-R237 HydrophobicContact CG1-CB 4.1Å; V145-R237 HydrophobicContact CG1-CG 4.47Å; K233-R237 WeakPolarHBondContact O-CB 3.5Å; K233-R237 PolarHBondContact O-N 3.45Å; S234-R237 PolarHBondContact O-N 2.79Å; R237-A296 VanDerWaalsContact CD-O 3.24Å; R237-A296 WeakPolarHBondContact CD-O 3.13Å; R237-A296 PolarHBondContact NH1-O 3.2Å; R237-R298 VanDerWaalsContact NH2-CZ 3.32Å; R237-R298 VanDerWaalsContact NH2-NE 3.17Å; R237-E379 IonicContact CZ-OE1 2.67Å; R237-E379 IonicContact NH1-OE1 2.82Å; R237-E379 PolarHBondContact NH1-OE1 3.34Å; R237-E379 IonicContact NH1-OE2 3.06Å; R237-E379 IonicContact NH2-OE1 3.17Å
238	C	86.1	Confident	89.4	Confident	0 Å²	0	14.6 Å²	14.6	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-89.3	-5.8	-173.9	-58.2	0	0	0	0	114.4	S234 V236 I240 P299 C302	S234-C238 WeakPolarHBondContact O-CB 3.19Å; S234-C238 PolarHBondContact O-N 3.32Å; S234-C238 PolarHBondContact O-SG 3.4Å; V236-C238 VanDerWaalsContact C-N 3.27Å; V236-C238 PolarHBondContact O-N 2.82Å; C238-I240 HydrophobicContact CB-CD1 3.44Å; C238-I240 VanDerWaalsContact CB-CD1 3.44Å; C238-I240 HydrophobicContact CB-CG1 3.49Å; C238-I240 VanDerWaalsContact CB-CG1 3.49Å; C238-I240 PolarHBondContact O-N 3.36Å; C238-P299 WeakPolarHBondContact SG-CD 3.29Å; C238-C302 HydrophobicContact CB-CB 4.19Å
239	Q	87.2	Confident	89.6	Confident	5 Å²	5	16.7 Å²	16.7	2%	0.023	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	45.8	49.2	-171.4	-63.6	-68.1	-55.7	0	0	111.5	R9 H235 V236 L246 L247 Q517 R526	R9-Q239 HydrophobicContact CB-CG 4.33Å; R9-Q239 HydrophobicContact CG-CG 4.48Å; H235-Q239 VanDerWaalsContact O-CA 3.25Å; H235-Q239 WeakPolarHBondContact O-CA 3.12Å; H235-Q239 PolarHBondContact O-N 2.91Å; V236-Q239 PolarHBondContact O-N 2.81Å; V236-Q239 PolarHBondContact O-NE2 3.17Å; Q239-L246 WeakPolarHBondContact O-CD2 3.19Å; Q239-L247 PolarHBondContact NE2-O 3.21Å; Q239-Q517 HydrophobicContact CB-CG 4.29Å; Q239-Q517 HydrophobicContact CG-CG 4.5Å; Q239-R526 PolarHBondContact O-NH2 3.41Å
240	I	88.5	Confident	89.7	Confident	17 Å²	17	17.4 Å²	17.4	9%	0.087	9%	0.088	C	C	.	.			trans	-87.2	125.2	-178.2	-63	172.1	0	0	0	108.8	P214 H235 C238 L242 P299	P214-I240 HydrophobicContact CB-CD1 4.19Å; P214-I240 HydrophobicContact CB-CG2 3.96Å; P214-I240 HydrophobicContact CG-CB 4.45Å; P214-I240 HydrophobicContact CG-CD1 3.32Å; P214-I240 HydrophobicContact CG-CG1 4.44Å; P214-I240 HydrophobicContact CG-CG2 3.96Å; H235-I240 PolarHBondContact O-N 3.34Å; H235-I240 VanDerWaalsContact O-N 3.11Å; C238-I240 HydrophobicContact CB-CD1 3.44Å; C238-I240 VanDerWaalsContact CB-CD1 3.44Å; C238-I240 HydrophobicContact CB-CG1 3.49Å; C238-I240 VanDerWaalsContact CB-CG1 3.49Å; C238-I240 PolarHBondContact O-N 3.36Å; I240-L242 PolarHBondContact O-N 3.49Å; I240-P299 HydrophobicContact CD1-CG 3.88Å
241	P	89.5	Confident	89.8	Confident	25 Å²	25	18.7 Å²	18.7	16%	0.162	10%	0.095	C	C	.	.			trans	-58.6	128.6	176.6	-22.8	32.9	0	0	0	111.9	L246 E452 W471 R526	P241-L246 HydrophobicContact CB-CD2 4.36Å; P241-L246 HydrophobicContact CG-CD2 4.03Å; P241-E452 HydrophobicContact CG-CB 4.27Å; P241-W471 HydrophobicContact CB-CH2 3.85Å; P241-W471 HydrophobicContact CB-CZ2 4.39Å; P241-W471 HydrophobicContact CB-CZ3 4.26Å; P241-W471 HydrophobicContact CG-CH2 3.61Å; P241-W471 HydrophobicContact CG-CZ3 3.75Å; P241-R526 VanDerWaalsContact CD-NH1 3.31Å
242	L	89.4	Confident	89.7	Confident	41 Å²	41	18.2 Å²	18.2	22%	0.215	9%	0.094	C	C	.	.	B	Isolated β-bridge	trans	-117.6	99.7	172.8	-172.7	66.5	0	0	0	108.2	L189 I200 I240 G244 A245 L247	L189-L242 HydrophobicContact CD2-CD2 3.64Å; I200-L242 HydrophobicContact CD1-CB 4.35Å; I200-L242 HydrophobicContact CD1-CD2 3.94Å; I200-L242 HydrophobicContact CD1-CG 3.78Å; I200-L242 VanDerWaalsContact CD1-O 3.28Å; I200-L242 WeakPolarHBondContact CD1-O 3.11Å; I200-L242 HydrophobicContact CG2-CD2 4.24Å; I200-L242 HydrophobicContact CG2-CG 4.37Å; I240-L242 PolarHBondContact O-N 3.49Å; L242-G244 PolarHBondContact O-N 3.35Å; L242-A245 PolarHBondContact N-O 2.62Å; L242-A245 PolarHBondContact O-N 2.72Å; L242-L247 HydrophobicContact CD2-CD1 4.47Å
243	K	86.8	Confident	88.7	Confident	129 Å²	129	21.3 Å²	21.3	56%	0.561	11%	0.108	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.2	55.3	-176.6	-56.9	-171.7	177.4	-175.2	0	113.1	R198 I200 A245	R198-K243 PolarHBondContact NH1-O 3.31Å; R198-K243 VanDerWaalsContact NH1-O 3.14Å; I200-K243 HydrophobicContact CD1-CB 4.07Å; I200-K243 HydrophobicContact CD1-CD 4.49Å; I200-K243 HydrophobicContact CD1-CG 4.44Å; I200-K243 HydrophobicContact CG1-CD 4.47Å; I200-K243 HydrophobicContact CG2-CD 4.13Å; K243-A245 VanDerWaalsContact C-N 3.28Å; K243-A245 PolarHBondContact O-N 3.27Å
244	G	88.3	Confident	87.3	Confident	3 Å²	3	23.2 Å²	23.2	3%	0.031	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	14.9	177.3	0	0	0	0	0	115.5	W193 L242 W471	W193-G244 PolarHBondContact NE1-O 2.95Å; W193-G244 VanDerWaalsContact NE1-O 3.13Å; L242-G244 PolarHBondContact O-N 3.35Å; G244-W471 PolarHBondContact O-NE1 2.8Å
245	A	92.3	Very high	85.8	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	-130.3	151	174.6	0	0	0	0	0	111.4	I191 W193 L242 K243	I191-A245 HydrophobicContact CD1-CB 4.48Å; I191-A245 HydrophobicContact CG2-CB 4.41Å; W193-A245 HydrophobicContact CB-CB 4.04Å; W193-A245 HydrophobicContact CD2-CB 3.89Å; W193-A245 HydrophobicContact CE3-CB 4.16Å; W193-A245 HydrophobicContact CG-CB 3.83Å; L242-A245 PolarHBondContact N-O 2.62Å; L242-A245 PolarHBondContact O-N 2.72Å; K243-A245 VanDerWaalsContact C-N 3.28Å; K243-A245 PolarHBondContact O-N 3.27Å
246	L	92.1	Very high	83.6	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.146	C	C	.	.			trans	-102.6	141.3	170.7	-64.2	-177.6	0	0	0	110.8	G173 W193 Q239 P241 W471 Q517 V524	G173-L246 WeakPolarHBondContact CA-O 3.25Å; W193-L246 HydrophobicContact CH2-CB 3.82Å; W193-L246 HydrophobicContact CH2-CD1 4.19Å; W193-L246 HydrophobicContact CH2-CG 3.84Å; W193-L246 HydrophobicContact CZ3-CB 3.67Å; W193-L246 HydrophobicContact CZ3-CG 4.23Å; W193-L246 VanDerWaalsContact CZ3-N 3.32Å; Q239-L246 WeakPolarHBondContact O-CD2 3.19Å; P241-L246 HydrophobicContact CB-CD2 4.36Å; P241-L246 HydrophobicContact CG-CD2 4.03Å; L246-W471 HydrophobicContact CD2-CH2 4.15Å; L246-W471 HydrophobicContact CG-CH2 4.16Å; L246-W471 HydrophobicContact CG-CZ2 4.49Å; L246-Q517 HydrophobicContact CD1-CB 4.2Å; L246-V524 HydrophobicContact CD1-CB 4.29Å; L246-V524 HydrophobicContact CD1-CG1 4.08Å; L246-V524 HydrophobicContact CD1-CG2 3.72Å; L246-V524 HydrophobicContact CG-CG2 4.3Å
247	L	92.3	Very high	81.4	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.166	C	C	.	.			trans	-87.9	132.2	168.5	-55.7	-176.3	0	0	0	109.3	F175 L189 I191 V232 H235 V236 Q239 L242	F175-L247 HydrophobicContact CB-CD2 4.05Å; F175-L247 HydrophobicContact CD1-CB 3.92Å; F175-L247 HydrophobicContact CD1-CD2 4.01Å; F175-L247 HydrophobicContact CD1-CG 4.47Å; F175-L247 HydrophobicContact CE1-CB 3.92Å; F175-L247 HydrophobicContact CG-CD2 4.01Å; L189-L247 HydrophobicContact CD2-CD1 3.77Å; L189-L247 HydrophobicContact CD2-CD2 3.94Å; L189-L247 HydrophobicContact CD2-CG 4.48Å; L189-L247 HydrophobicContact CG-CD2 4.46Å; I191-L247 HydrophobicContact CB-CD2 4.46Å; I191-L247 HydrophobicContact CD1-CD2 3.35Å; I191-L247 HydrophobicContact CG1-CD2 3.53Å; I191-L247 HydrophobicContact CG2-CD2 4.07Å; V232-L247 HydrophobicContact CG1-CD1 3.97Å; H235-L247 HydrophobicContact CB-CD1 3.88Å; H235-L247 HydrophobicContact CB-CG 4.42Å; V236-L247 WeakPolarHBondContact CA-O 3.18Å; V236-L247 HydrophobicContact CG2-CB 3.54Å; Q239-L247 PolarHBondContact NE2-O 3.21Å; L242-L247 HydrophobicContact CD2-CD1 4.47Å
248	R	89.3	Confident	79.3	Confident	18 Å²	18	39 Å²	39	7%	0.068	20%	0.203	C	C	.	.			trans	-126.9	-59.8	177.8	-64.2	-172.7	-172	-90.6	-7	111.8	C144 D172 G173 V236 Q517	C144-R248 WeakPolarHBondContact CB-O 3.46Å; C144-R248 PolarHBondContact SG-O 3.31Å; D172-R248 WeakPolarHBondContact O-CD 3.22Å; G173-R248 WeakPolarHBondContact O-CA 3.23Å; G173-R248 PolarHBondContact O-N 2.86Å; V236-R248 WeakPolarHBondContact CG1-O 3.42Å; R248-Q517 PolarHBondContact NH2-O 2.86Å
249	T	90.3	Very high	77.4	Confident	44 Å²	44	46.9 Å²	46.9	27%	0.27	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	111.9	-166.9	-43.4	0	0	0	0	110.7	G173 D174 F175 I251	G173-T249 PolarHBondContact O-N 2.85Å; D174-T249 WeakPolarHBondContact CA-O 3.33Å; D174-T249 WeakPolarHBondContact OD1-CB 3.26Å; D174-T249 PolarHBondContact OD1-OG1 3.31Å; F175-T249 WeakPolarHBondContact CD1-O 3.25Å; F175-T249 PolarHBondContact N-O 2.89Å; T249-I251 HydrophobicContact CG2-CD1 3.91Å; T249-I251 PolarHBondContact O-N 3.11Å
250	P	91.8	Very high	75	Confident	16 Å²	16	50.2 Å²	50.2	10%	0.104	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	121.7	166.2	25.9	-28.3	0	0	0	108.6	Y155 F175 A252	Y155-P250 HydrophobicContact CD1-CB 3.55Å; Y155-P250 HydrophobicContact CD2-CB 4.37Å; Y155-P250 HydrophobicContact CE1-CB 4.13Å; Y155-P250 HydrophobicContact CG-CB 3.69Å; F175-P250 HydrophobicContact CE1-CB 4.21Å; F175-P250 VanDerWaalsContact CE1-N 3.29Å; F175-P250 HydrophobicContact CE2-CB 3.75Å; F175-P250 HydrophobicContact CZ-CB 3.54Å; F175-P250 HydrophobicContact CZ-CG 4.04Å; P250-A252 PolarHBondContact O-N 2.86Å
251	I	91.1	Very high	72.8	Confident	29 Å²	29	52.1 Å²	52.1	15%	0.149	28%	0.278	C	S	.	.			trans	-87.3	112.7	177	-55.6	-54.1	0	0	0	108.2	Y155 Y157 V168 L169 D174 F175 T249	Y155-I251 WeakPolarHBondContact CA-O 3.4Å; Y155-I251 WeakPolarHBondContact CB-O 3.42Å; Y157-I251 VanDerWaalsContact CE2-O 3.27Å; Y157-I251 WeakPolarHBondContact CE2-O 3.25Å; V168-I251 HydrophobicContact CG1-CB 4.44Å; V168-I251 HydrophobicContact CG1-CG2 3.77Å; L169-I251 HydrophobicContact CD2-CB 4.41Å; L169-I251 HydrophobicContact CD2-CG1 3.86Å; D174-I251 HydrophobicContact CB-CD1 3.96Å; D174-I251 HydrophobicContact CB-CG1 3.89Å; F175-I251 PolarHBondContact O-N 3.34Å; T249-I251 HydrophobicContact CG2-CD1 3.91Å; T249-I251 PolarHBondContact O-N 3.11Å
252	A	86.5	Confident	70.2	Confident	16 Å²	16	53.6 Å²	53.6	13%	0.132	30%	0.298	C	S	.	.			trans	-80.3	139.8	179.1	0	0	0	0	0	111.7	S154 Y157 P250 G254 K255	S154-A252 CarbonylContact O-C 3.53Å; S154-A252 WeakPolarHBondContact O-CA 3.45Å; S154-A252 WeakPolarHBondContact OG-CB 3.33Å; Y157-A252 PolarHBondContact OH-O 3.46Å; P250-A252 PolarHBondContact O-N 2.86Å; A252-G254 VanDerWaalsContact C-N 3.34Å; A252-G254 PolarHBondContact O-N 2.82Å; A252-K255 HydrophobicContact CB-CG 4.39Å; A252-K255 PolarHBondContact O-N 2.87Å
253	F	70.2	Confident	67.8	Low	69 Å²	69	58.4 Å²	58.4	30%	0.303	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-50.9	179.2	-175.3	-87.1	0	0	0	112.9	S154 Y157 K255 Y256 I266	S154-F253 PolarHBondContact O-N 3.23Å; Y157-F253 AromaticContact CD1-CD2 3.95Å; Y157-F253 HydrophobicContact CD1-CD2 3.95Å; Y157-F253 AromaticContact CE1-CD2 3.88Å; Y157-F253 HydrophobicContact CE1-CD2 3.88Å; Y157-F253 VanDerWaalsContact OH-CA 3.29Å; Y157-F253 WeakPolarHBondContact OH-CA 3.18Å; Y157-F253 PolarHBondContact OH-N 3.28Å; F253-K255 VanDerWaalsContact C-N 3.31Å; F253-K255 PolarHBondContact O-N 3.4Å; F253-Y256 VanDerWaalsContact O-CB 3.3Å; F253-Y256 WeakPolarHBondContact O-CB 3.31Å; F253-Y256 PolarHBondContact O-N 2.8Å; F253-I266 HydrophobicContact CD2-CG2 4.24Å; F253-I266 HydrophobicContact CE2-CB 3.78Å; F253-I266 HydrophobicContact CE2-CG2 3.37Å; F253-I266 HydrophobicContact CZ-CB 3.95Å; F253-I266 HydrophobicContact CZ-CG2 4.06Å
254	G	62.9	Low	65.4	Low	42 Å²	42	59.2 Å²	59.2	43%	0.433	33%	0.329	S	S	.	.	H	α-helix	trans	-72.7	-13.3	-176.8	0	0	0	0	0	115.7	A252 Y256	A252-G254 VanDerWaalsContact C-N 3.34Å; A252-G254 PolarHBondContact O-N 2.82Å; G254-Y256 PolarHBondContact O-N 2.8Å
255	K	57.3	Low	63.1	Low	89 Å²	89	60.7 Å²	60.7	39%	0.387	34%	0.342	S	S	.	.	H	α-helix	trans	-72.8	-13.2	172.7	-76.2	-172.2	178.2	-179.5	0	111.9	A252 F253	A252-K255 HydrophobicContact CB-CG 4.39Å; A252-K255 PolarHBondContact O-N 2.87Å; F253-K255 VanDerWaalsContact C-N 3.31Å; F253-K255 PolarHBondContact O-N 3.4Å
256	Y	47.1	Very low	60.9	Low	14 Å²	14	61.5 Å²	61.5	6%	0.055	35%	0.346	C	S	.	.	H	α-helix	trans	-78	-39.8	177.5	-162.3	-101.6	0	0	0	112.6	V168 F253 G254 Q258 R259 I261 I266	V168-Y256 HydrophobicContact CB-CE2 4.44Å; V168-Y256 HydrophobicContact CG2-CD2 3.85Å; V168-Y256 HydrophobicContact CG2-CE2 3.43Å; V168-Y256 VanDerWaalsContact CG2-CE2 3.43Å; F253-Y256 VanDerWaalsContact O-CB 3.3Å; F253-Y256 WeakPolarHBondContact O-CB 3.31Å; F253-Y256 PolarHBondContact O-N 2.8Å; G254-Y256 PolarHBondContact O-N 2.8Å; Y256-Q258 PolarHBondContact O-N 2.8Å; Y256-R259 PolarHBondContact O-N 2.91Å; Y256-I261 HydrophobicContact CD1-CB 4.23Å; Y256-I261 HydrophobicContact CE1-CB 3.42Å; Y256-I261 VanDerWaalsContact CE1-CB 3.42Å; Y256-I261 HydrophobicContact CE1-CD1 4.23Å; Y256-I261 HydrophobicContact CE1-CG1 4.37Å; Y256-I261 HydrophobicContact CE1-CG2 3.55Å; Y256-I261 HydrophobicContact CE2-CD1 3.83Å; Y256-I261 VanDerWaalsContact OH-CD1 3.24Å; Y256-I261 WeakPolarHBondContact OH-CD1 3.18Å; Y256-I261 VanDerWaalsContact OH-CG2 3.26Å; Y256-I261 WeakPolarHBondContact OH-CG2 3.12Å; Y256-I266 HydrophobicContact CD1-CD1 3.6Å; Y256-I266 HydrophobicContact CE1-CD1 3.69Å; Y256-I266 HydrophobicContact CG-CD1 4.24Å
257	D	42.8	Very low	58.4	Low	84 Å²	84	69.3 Å²	69.3	45%	0.449	38%	0.38	S	S	.	.	H	α-helix	trans	-58.6	-33.3	-179.9	-68.2	-25.4	0	0	0	112.1	R259	D257-R259 VanDerWaalsContact C-N 3.3Å; D257-R259 PolarHBondContact O-N 3.41Å
258	Q	44.4	Very low	55.7	Low	176 Å²	176	74.9 Å²	74.9	82%	0.822	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-10.9	177.6	-66.6	-175.8	0.8	0	0	114.2	Y256	Y256-Q258 PolarHBondContact O-N 2.8Å
259	R	45.2	Very low	53.1	Low	166 Å²	166	83 Å²	83	63%	0.626	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	14.6	-175.3	-70.6	-174.1	179.6	-174.2	1	114.3	Y256 D257	Y256-R259 PolarHBondContact O-N 2.91Å; D257-R259 VanDerWaalsContact C-N 3.3Å; D257-R259 PolarHBondContact O-N 3.41Å
260	G	36.7	Very low	50.7	Low	75 Å²	75	87.4 Å²	87.4	77%	0.773	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	20.5	163.5	0	0	0	0	0	116.4
261	I	41.6	Very low	48.4	Very low	58 Å²	58	89.2 Å²	89.2	30%	0.297	48%	0.481	S	S	.	.			trans	-114.2	122.3	176.4	-53.5	170.4	0	0	0	108.3	Y256	Y256-I261 HydrophobicContact CD1-CB 4.23Å; Y256-I261 HydrophobicContact CE1-CB 3.42Å; Y256-I261 VanDerWaalsContact CE1-CB 3.42Å; Y256-I261 HydrophobicContact CE1-CD1 4.23Å; Y256-I261 HydrophobicContact CE1-CG1 4.37Å; Y256-I261 HydrophobicContact CE1-CG2 3.55Å; Y256-I261 HydrophobicContact CE2-CD1 3.83Å; Y256-I261 VanDerWaalsContact OH-CD1 3.24Å; Y256-I261 WeakPolarHBondContact OH-CD1 3.18Å; Y256-I261 VanDerWaalsContact OH-CG2 3.26Å; Y256-I261 WeakPolarHBondContact OH-CG2 3.12Å
262	G	35.5	Very low	46.2	Very low	55 Å²	55	94.2 Å²	94.2	57%	0.567	51%	0.512	S	S	*	.			trans	-62.2	145.5	-157.2	0	0	0	0	0	117.3	N264 A265	G262-N264 PolarHBondContact O-N 3.01Å; G262-A265 PolarHBondContact O-N 3.43Å
263	E	39.3	Very low	44.6	Very low	142 Å²	142	95.1 Å²	95.1	66%	0.664	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-50.2	-29.3	-177	-65.7	-177.6	146.9	0	0	115.1	A265	E263-A265 VanDerWaalsContact C-N 3.27Å; E263-A265 PolarHBondContact O-N 3.07Å
264	N	36.8	Very low	44	Very low	146 Å²	146	95.2 Å²	95.2	78%	0.781	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-75.4	-12.4	-174	-74.1	-15.3	0	0	0	113.8	G262	G262-N264 PolarHBondContact O-N 3.01Å
265	A	40.4	Very low	43.8	Very low	35 Å²	35	99 Å²	99	29%	0.289	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-82	-20.1	-171.9	0	0	0	0	0	114.7	G262 E263	G262-A265 PolarHBondContact O-N 3.43Å; E263-A265 VanDerWaalsContact C-N 3.27Å; E263-A265 PolarHBondContact O-N 3.07Å
266	I	45.7	Very low	43.8	Very low	16 Å²	16	101.8 Å²	101.8	8%	0.082	54%	0.544	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.2	-9.2	-170.8	-33.4	-177.3	0	0	0	113.9	Y157 L160 F253 Y256 N268	Y157-I266 HydrophobicContact CD1-CG2 4.4Å; L160-I266 HydrophobicContact CD2-CG2 3.78Å; F253-I266 HydrophobicContact CD2-CG2 4.24Å; F253-I266 HydrophobicContact CE2-CB 3.78Å; F253-I266 HydrophobicContact CE2-CG2 3.37Å; F253-I266 HydrophobicContact CZ-CB 3.95Å; F253-I266 HydrophobicContact CZ-CG2 4.06Å; Y256-I266 HydrophobicContact CD1-CD1 3.6Å; Y256-I266 HydrophobicContact CE1-CD1 3.69Å; Y256-I266 HydrophobicContact CG-CD1 4.24Å; I266-N268 PolarHBondContact O-N 2.77Å; I266-N268 VanDerWaalsContact O-N 3.13Å
267	K	38.7	Very low	44.6	Very low	164 Å²	164	101.9 Å²	101.9	71%	0.713	55%	0.545	S	S	*	.			trans	-73.9	10.6	168.9	-84.5	-174.9	178.6	171.6	0	114.3	E269	K267-E269 PolarHBondContact O-N 3.03Å; K267-E269 VanDerWaalsContact O-N 3.11Å
268	N	35.7	Very low	45.6	Very low	118 Å²	118	98.5 Å²	98.5	63%	0.631	53%	0.526	S	S	*	.			trans	-62.5	118.6	-175.8	-100.9	-9.4	0	0	0	112.1	I266 N270	I266-N268 PolarHBondContact O-N 2.77Å; I266-N268 VanDerWaalsContact O-N 3.13Å; N268-N270 PolarHBondContact O-N 3.32Å
269	E	34.8	Very low	46.4	Very low	188 Å²	188	94.4 Å²	94.4	88%	0.879	51%	0.507	S	S	*	.			trans	-63.6	16.4	-170.9	-63.3	178.3	136.1	0	0	116.1	K267	K267-E269 PolarHBondContact O-N 3.03Å; K267-E269 VanDerWaalsContact O-N 3.11Å
270	N	40.2	Very low	47.1	Very low	137 Å²	137	88 Å²	88	73%	0.733	49%	0.489	S	S	*	.			trans	-118.7	77.8	-171.5	-76.4	-28.3	0	0	0	111.8	N268	N268-N270 PolarHBondContact O-N 3.32Å
271	T	43.2	Very low	48.3	Very low	54 Å²	54	84.4 Å²	84.4	33%	0.331	45%	0.453	S	S	.	.			trans	172.6	119.5	130.1	28.1	0	0	0	0	106.7	P273	T271-P273 VanDerWaalsContact C-CD 3.48Å; T271-P273 WeakPolarHBondContact O-CD 3.31Å
272	V	45.6	Very low	49.1	Very low	134 Å²	134	82.9 Å²	82.9	81%	0.812	44%	0.444	S	S	*	.			trans	-75.3	101.1	165.8	177.6	0	0	0	0	106.1	T274	V272-T274 PolarHBondContact O-N 3.22Å
273	P	53.1	Low	50.3	Low	36 Å²	36	87.8 Å²	87.8	23%	0.234	45%	0.445	C	S	.	.			trans	-57.8	131.2	148.7	24.8	-29.4	0	0	0	106.2	V179 T271 E275 W278	V179-P273 HydrophobicContact CG2-CB 4.12Å; T271-P273 VanDerWaalsContact C-CD 3.48Å; T271-P273 WeakPolarHBondContact O-CD 3.31Å; P273-E275 PolarHBondContact O-N 3.16Å; P273-E275 VanDerWaalsContact O-N 3.16Å; P273-W278 HydrophobicContact CB-CZ2 4.2Å; P273-W278 HydrophobicContact CG-CZ2 4.47Å
274	T	56	Low	51.4	Low	71 Å²	71	83.9 Å²	83.9	44%	0.436	42%	0.424	S	S	.	.			trans	-58.6	128.9	169.4	24.7	0	0	0	0	106.5	V272 E276 M277	V272-T274 PolarHBondContact O-N 3.22Å; T274-E276 CarbonylContact O-C 3.58Å; T274-E276 PolarHBondContact O-N 3.42Å; T274-M277 WeakPolarHBondContact O-CB 3.39Å; T274-M277 PolarHBondContact O-N 2.78Å
275	E	59.7	Low	52.7	Low	120 Å²	120	79 Å²	79	56%	0.561	40%	0.398	S	S	*	.	H	α-helix	trans	-37	-39.9	171.5	-179.7	56.2	-147.2	0	0	111.3	P273 M277 W278 Q279	P273-E275 PolarHBondContact O-N 3.16Å; P273-E275 VanDerWaalsContact O-N 3.16Å; E275-M277 PolarHBondContact O-N 3.39Å; E275-W278 PolarHBondContact O-N 2.86Å; E275-W278 VanDerWaalsContact O-N 3.12Å; E275-Q279 HydrophobicContact CG-CG 4.21Å; E275-Q279 VanDerWaalsContact O-CG 3.26Å; E275-Q279 WeakPolarHBondContact O-CG 3.29Å; E275-Q279 PolarHBondContact O-N 2.95Å; E275-Q279 PolarHBondContact OE1-NE2 3.3Å
276	E	58.3	Low	53.9	Low	149 Å²	149	82.5 Å²	82.5	70%	0.696	41%	0.409	S	S	*	.	H	α-helix	trans	-50.6	-42.2	173.1	-57.7	-177.8	164.4	0	0	115.8	T274 W278 Q279 A280	T274-E276 CarbonylContact O-C 3.58Å; T274-E276 PolarHBondContact O-N 3.42Å; E276-W278 VanDerWaalsContact C-N 3.34Å; E276-Q279 PolarHBondContact O-N 2.82Å; E276-A280 WeakPolarHBondContact O-CB 3.21Å; E276-A280 PolarHBondContact O-N 3Å
277	M	62.3	Low	54.8	Low	16 Å²	16	84 Å²	84	8%	0.079	42%	0.423	C	S	.	.	H	α-helix	trans	-64.8	-39.4	178.3	-76.1	-178.6	65.9	0	0	111.7	K184 L187 L204 T274 E275 A280 V281	K184-M277 VanDerWaalsContact O-CE 3.29Å; K184-M277 WeakPolarHBondContact O-CE 3.46Å; L187-M277 HydrophobicContact CD2-CE 3.7Å; L187-M277 HydrophobicContact CG-CE 4.14Å; L204-M277 HydrophobicContact CD1-CB 4.17Å; L204-M277 HydrophobicContact CD1-CE 3.79Å; L204-M277 HydrophobicContact CD1-CG 4.02Å; T274-M277 WeakPolarHBondContact O-CB 3.39Å; T274-M277 PolarHBondContact O-N 2.78Å; E275-M277 PolarHBondContact O-N 3.39Å; M277-A280 PolarHBondContact O-N 2.89Å; M277-V281 PolarHBondContact O-N 3.05Å
278	W	64.5	Low	56	Low	12 Å²	12	76.1 Å²	76.1	5%	0.045	39%	0.389	C	S	.	.	H	α-helix	trans	-80.5	-29	178.6	-62.8	129.6	0	0	0	112.7	Q156 V179 L187 P273 E275 E276 A280 V281 K282	Q156-W278 VanDerWaalsContact CD-CE3 3.48Å; Q156-W278 VanDerWaalsContact CD-CH2 3.47Å; Q156-W278 HydrophobicContact CG-CD2 4.32Å; Q156-W278 HydrophobicContact CG-CE3 4.19Å; Q156-W278 HydrophobicContact CG-CH2 3.33Å; Q156-W278 HydrophobicContact CG-CZ2 3.45Å; Q156-W278 VanDerWaalsContact CG-CZ2 3.45Å; Q156-W278 HydrophobicContact CG-CZ3 3.71Å; Q156-W278 VanDerWaalsContact NE2-CZ2 3.33Å; V179-W278 HydrophobicContact CG2-CZ2 4.03Å; L187-W278 HydrophobicContact CD1-CE3 4.3Å; L187-W278 HydrophobicContact CD1-CH2 3.97Å; L187-W278 HydrophobicContact CD1-CZ3 3.51Å; L187-W278 HydrophobicContact CD2-CH2 3.3Å; L187-W278 HydrophobicContact CD2-CZ2 3.94Å; L187-W278 HydrophobicContact CD2-CZ3 3.75Å; L187-W278 HydrophobicContact CG-CH2 4.28Å; L187-W278 HydrophobicContact CG-CZ3 4.29Å; P273-W278 HydrophobicContact CB-CZ2 4.2Å; P273-W278 HydrophobicContact CG-CZ2 4.47Å; E275-W278 PolarHBondContact O-N 2.86Å; E275-W278 VanDerWaalsContact O-N 3.12Å; E276-W278 VanDerWaalsContact C-N 3.34Å; W278-A280 VanDerWaalsContact C-N 3.28Å; W278-A280 PolarHBondContact O-N 2.86Å; W278-V281 HydrophobicContact CE3-CB 4.26Å; W278-V281 HydrophobicContact CE3-CG1 4.49Å; W278-V281 HydrophobicContact CE3-CG2 3.81Å; W278-V281 HydrophobicContact CZ3-CG2 4.13Å; W278-V281 WeakPolarHBondContact O-CB 3.37Å; W278-V281 PolarHBondContact O-N 2.86Å; W278-V281 VanDerWaalsContact O-N 3.11Å; W278-K282 WeakPolarHBondContact O-CD 3.32Å
279	Q	61.7	Low	57.6	Low	90 Å²	90	70.5 Å²	70.5	42%	0.421	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-37.3	167.6	-68.7	-64.1	-23.9	0	0	111.4	E275 E276 V281 K282	E275-Q279 HydrophobicContact CG-CG 4.21Å; E275-Q279 VanDerWaalsContact O-CG 3.26Å; E275-Q279 WeakPolarHBondContact O-CG 3.29Å; E275-Q279 PolarHBondContact O-N 2.95Å; E275-Q279 PolarHBondContact OE1-NE2 3.3Å; E276-Q279 PolarHBondContact O-N 2.82Å; Q279-V281 PolarHBondContact O-N 3.16Å; Q279-K282 PolarHBondContact O-N 3.11Å; Q279-K282 VanDerWaalsContact O-N 3.15Å
280	A	58.5	Low	59.4	Low	31 Å²	31	68.8 Å²	68.8	26%	0.256	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-17	174.6	0	0	0	0	0	113.9	Y211 E276 M277 W278 K282	Y211-A280 PolarHBondContact OH-O 2.8Å; E276-A280 WeakPolarHBondContact O-CB 3.21Å; E276-A280 PolarHBondContact O-N 3Å; M277-A280 PolarHBondContact O-N 2.89Å; W278-A280 VanDerWaalsContact C-N 3.28Å; W278-A280 PolarHBondContact O-N 2.86Å; A280-K282 VanDerWaalsContact C-N 3.32Å
281	V	62	Low	61.1	Low	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-13.8	175.2	160.4	0	0	0	0	112	L153 L187 L204 C227 L228 M277 W278 Q279	L153-V281 HydrophobicContact CD1-CG1 3.41Å; L153-V281 VanDerWaalsContact CD1-CG1 3.41Å; L153-V281 HydrophobicContact CG-CG1 4.03Å; L187-V281 HydrophobicContact CD1-CG2 3.79Å; L204-V281 HydrophobicContact CD2-CG2 4.07Å; C227-V281 VanDerWaalsContact CB-O 3.23Å; C227-V281 WeakPolarHBondContact CB-O 3.27Å; L228-V281 HydrophobicContact CB-CB 4.37Å; L228-V281 HydrophobicContact CB-CG1 4.1Å; L228-V281 HydrophobicContact CB-CG2 4.14Å; L228-V281 HydrophobicContact CD2-CG2 3.83Å; L228-V281 PolarHBondContact N-O 3.14Å; L228-V281 VanDerWaalsContact N-O 3.12Å; M277-V281 PolarHBondContact O-N 3.05Å; W278-V281 HydrophobicContact CE3-CB 4.26Å; W278-V281 HydrophobicContact CE3-CG1 4.49Å; W278-V281 HydrophobicContact CE3-CG2 3.81Å; W278-V281 HydrophobicContact CZ3-CG2 4.13Å; W278-V281 WeakPolarHBondContact O-CB 3.37Å; W278-V281 PolarHBondContact O-N 2.86Å; W278-V281 VanDerWaalsContact O-N 3.11Å; Q279-V281 PolarHBondContact O-N 3.16Å
282	K	60	Low	62.7	Low	26 Å²	26	61.2 Å²	61.2	11%	0.113	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.7	-10.9	-158	-77.8	168.5	-175.1	-87.6	0	118.8	S150 E151 T152 W278 Q279 A280 R284	S150-K282 PolarHBondContact O-NZ 3.35Å; E151-K282 WeakPolarHBondContact O-CD 3.19Å; E151-K282 WeakPolarHBondContact O-CE 3.23Å; E151-K282 PolarHBondContact O-NZ 2.87Å; T152-K282 PolarHBondContact O-NZ 3.28Å; W278-K282 WeakPolarHBondContact O-CD 3.32Å; Q279-K282 PolarHBondContact O-N 3.11Å; Q279-K282 VanDerWaalsContact O-N 3.15Å; A280-K282 VanDerWaalsContact C-N 3.32Å; K282-R284 WeakPolarHBondContact O-CG 3.3Å; K282-R284 PolarHBondContact O-N 3.18Å; K282-R284 VanDerWaalsContact O-N 3.07Å
283	R	59.1	Low	64.3	Low	158 Å²	158	58.2 Å²	58.2	60%	0.596	29%	0.286	S	S	*	.			trans	-58.9	121.2	179.4	-70.4	-158.4	-167.9	175.3	-4.8	109.3	Q209 D226 C227	Q209-R283 VanDerWaalsContact OE1-NE 3.08Å; D226-R283 CarbonylContact C-O 3.58Å; D226-R283 VanDerWaalsContact C-O 3.25Å; D226-R283 WeakPolarHBondContact CB-O 3.32Å; D226-R283 VanDerWaalsContact O-O 3.1Å; D226-R283 VanDerWaalsContact OD1-O 3.12Å; C227-R283 WeakPolarHBondContact CB-O 3.47Å
284	R	63.8	Low	65.6	Low	60 Å²	60	59.4 Å²	59.4	23%	0.226	29%	0.286	C	S	.	.			trans	-129	146.8	-173.3	-80.7	177.8	-164.8	162	1	113	E148 D226 C227 D229 K282	E148-R284 PolarHBondContact O-NH1 3.09Å; E148-R284 PolarHBondContact O-NH2 3.42Å; D226-R284 VanDerWaalsContact OD2-C 3.27Å; D226-R284 WeakPolarHBondContact OD2-CA 3.3Å; C227-R284 HydrophobicContact CB-CG 3.91Å; D229-R284 IonicContact OD2-NH2 3.87Å; D229-R284 PolarHBondContact OD2-NH2 2.87Å; K282-R284 WeakPolarHBondContact O-CG 3.3Å; K282-R284 PolarHBondContact O-N 3.18Å; K282-R284 VanDerWaalsContact O-N 3.07Å
285	N	64.3	Low	67	Low	43 Å²	43	58.6 Å²	58.6	23%	0.23	28%	0.275	C	S	.	.			trans	-91.1	93.4	165.3	-173.8	-11.3	0	0	0	109.2	D226 A287 G288 S289 K374	D226-N285 VanDerWaalsContact OD2-CB 3.29Å; D226-N285 WeakPolarHBondContact OD2-CB 3.18Å; D226-N285 PolarHBondContact OD2-N 3.33Å; N285-A287 PolarHBondContact O-N 3.44Å; N285-A287 WeakPolarHBondContact OD1-CB 3.46Å; N285-A287 PolarHBondContact OD1-N 2.66Å; N285-G288 PolarHBondContact O-N 2.78Å; N285-S289 PolarHBondContact O-N 3.22Å; N285-S289 PolarHBondContact O-OG 3.21Å; N285-K374 PolarHBondContact ND2-O 3.08Å
286	E	64.5	Low	68.3	Low	109 Å²	109	52.9 Å²	52.9	51%	0.509	25%	0.248	S	C	.	.	H	α-helix	trans	-54.3	-30.1	179.8	-67.9	-172	-163.9	0	0	113.6	R290	E286-R290 WeakPolarHBondContact O-CB 3.47Å; E286-R290 VanDerWaalsContact O-CG 3.26Å; E286-R290 WeakPolarHBondContact O-CG 3.26Å; E286-R290 PolarHBondContact O-N 2.93Å; E286-R290 IonicContact OE2-CZ 3.44Å; E286-R290 IonicContact OE2-NE 3.92Å; E286-R290 IonicContact OE2-NH2 3.58Å; E286-R290 PolarHBondContact OE2-NH2 2.76Å
287	A	65.1	Low	69.7	Low	47 Å²	47	45.8 Å²	45.8	39%	0.388	22%	0.215	S	C	.	.	H	α-helix	trans	-66.5	-43.2	-177.9	0	0	0	0	0	111.8	N285 L291	N285-A287 PolarHBondContact O-N 3.44Å; N285-A287 WeakPolarHBondContact OD1-CB 3.46Å; N285-A287 PolarHBondContact OD1-N 2.66Å; A287-L291 PolarHBondContact O-N 3.22Å
288	G	63.9	Low	71	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-68	-45.9	176.1	0	0	0	0	0	111.7	N285 R290 L291 R292	N285-G288 PolarHBondContact O-N 2.78Å; G288-R290 VanDerWaalsContact C-N 3.34Å; G288-R290 PolarHBondContact O-N 3.17Å; G288-L291 WeakPolarHBondContact O-CB 3.07Å; G288-L291 PolarHBondContact O-N 3.1Å; G288-R292 PolarHBondContact O-N 3.18Å; G288-R292 VanDerWaalsContact O-N 3.14Å
289	S	69.3	Low	72.3	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-61.2	-40.5	180	-45.2	0	0	0	0	112.2	E230 N285 R292 S293 W294	E230-S289 PolarHBondContact OE1-OG 3.43Å; N285-S289 PolarHBondContact O-N 3.22Å; N285-S289 PolarHBondContact O-OG 3.21Å; S289-R292 PolarHBondContact O-N 2.78Å; S289-S293 PolarHBondContact O-N 3.3Å; S289-W294 VanDerWaalsContact O-CA 3.3Å; S289-W294 WeakPolarHBondContact O-CA 3.11Å; S289-W294 PolarHBondContact O-N 3.24Å
290	R	72	Confident	73.8	Confident	151 Å²	151	41.3 Å²	41.3	57%	0.57	19%	0.194	S	C	*	.	H	α-helix	trans	-65.2	-41.4	177.2	-72.7	177.4	-165.4	-160.3	7.9	112.7	E286 G288 R292 S293 W294	E286-R290 WeakPolarHBondContact O-CB 3.47Å; E286-R290 VanDerWaalsContact O-CG 3.26Å; E286-R290 WeakPolarHBondContact O-CG 3.26Å; E286-R290 PolarHBondContact O-N 2.93Å; E286-R290 IonicContact OE2-CZ 3.44Å; E286-R290 IonicContact OE2-NE 3.92Å; E286-R290 IonicContact OE2-NH2 3.58Å; E286-R290 PolarHBondContact OE2-NH2 2.76Å; G288-R290 VanDerWaalsContact C-N 3.34Å; G288-R290 PolarHBondContact O-N 3.17Å; R290-R292 VanDerWaalsContact C-N 3.27Å; R290-R292 PolarHBondContact O-N 3.13Å; R290-S293 PolarHBondContact O-N 3.36Å; R290-W294 HydrophobicContact CG-CH2 4.41Å; R290-W294 HydrophobicContact CG-CZ2 3.75Å
291	L	76.5	Confident	75.2	Confident	20 Å²	20	41.9 Å²	41.9	11%	0.105	19%	0.191	C	C	.	.	H	α-helix	trans	-58.2	-41	175.6	-82.7	171.9	0	0	0	112.1	A287 G288 S293 Y375 T387 Y388	A287-L291 PolarHBondContact O-N 3.22Å; G288-L291 WeakPolarHBondContact O-CB 3.07Å; G288-L291 PolarHBondContact O-N 3.1Å; L291-S293 PolarHBondContact O-N 3.47Å; L291-Y375 HydrophobicContact CD1-CE1 3.92Å; L291-Y375 HydrophobicContact CD1-CE2 4.4Å; L291-Y375 WeakPolarHBondContact CD1-OH 3.49Å; L291-T387 HydrophobicContact CD2-CG2 3.96Å; L291-Y388 HydrophobicContact CD2-CD2 4.48Å; L291-Y388 HydrophobicContact CD2-CE2 3.71Å
292	R	76.8	Confident	76.4	Confident	12 Å²	12	42.1 Å²	42.1	5%	0.045	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	10.5	176.4	-62.1	-175.2	-63.2	-118	-4.1	113.9	E230 G288 S289 R290 W294 R295 D380 L383	E230-R292 VanDerWaalsContact CD-NH2 3.33Å; E230-R292 IonicContact OE1-CZ 3.32Å; E230-R292 IonicContact OE1-NH2 2.66Å; E230-R292 PolarHBondContact OE1-NH2 3.46Å; E230-R292 IonicContact OE2-NH2 2.6Å; G288-R292 PolarHBondContact O-N 3.18Å; G288-R292 VanDerWaalsContact O-N 3.14Å; S289-R292 PolarHBondContact O-N 2.78Å; R290-R292 VanDerWaalsContact C-N 3.27Å; R290-R292 PolarHBondContact O-N 3.13Å; R292-W294 PolarHBondContact O-N 2.68Å; R292-R295 HydrophobicContact CB-CB 4.45Å; R292-R295 WeakPolarHBondContact CB-O 3.48Å; R292-R295 WeakPolarHBondContact CD-O 2.73Å; R292-R295 PolarHBondContact NE-O 2.75Å; R292-R295 WeakPolarHBondContact O-CB 3.42Å; R292-R295 WeakPolarHBondContact O-CG 3.48Å; R292-R295 PolarHBondContact O-N 3.48Å; R292-D380 VanDerWaalsContact CD-OD1 3.24Å; R292-D380 WeakPolarHBondContact CD-OD1 3.13Å; R292-D380 WeakPolarHBondContact CG-OD1 3.42Å; R292-D380 IonicContact CZ-OD1 3.35Å; R292-D380 VanDerWaalsContact CZ-OD1 3.32Å; R292-D380 IonicContact CZ-OD2 3.18Å; R292-D380 IonicContact NE-OD1 3.57Å; R292-D380 IonicContact NH1-OD1 2.78Å; R292-D380 PolarHBondContact NH1-OD1 2.89Å; R292-D380 IonicContact NH1-OD2 3.31Å; R292-D380 PolarHBondContact NH1-OD2 2.98Å; R292-L383 HydrophobicContact CG-CD1 3.66Å
293	S	79.4	Confident	77.7	Confident	72 Å²	72	40.9 Å²	40.9	50%	0.503	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.9	41.1	-173	-58.9	0	0	0	0	112.7	S289 R290 L291 R295	S289-S293 PolarHBondContact O-N 3.3Å; R290-S293 PolarHBondContact O-N 3.36Å; L291-S293 PolarHBondContact O-N 3.47Å; S293-R295 PolarHBondContact O-N 3.39Å
294	W	79.6	Confident	78.9	Confident	61 Å²	61	34.2 Å²	34.2	23%	0.231	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	63	33	-177.3	-56.5	94.1	0	0	0	114.6	K146 L147 Q149 S289 R290 R292	K146-W294 CarbonylContact C-O 3.46Å; L147-W294 WeakPolarHBondContact CB-O 3.42Å; L147-W294 WeakPolarHBondContact CG-O 3.49Å; L147-W294 PolarHBondContact N-O 2.96Å; Q149-W294 HydrophobicContact CG-CE3 4.3Å; Q149-W294 HydrophobicContact CG-CZ3 4.37Å; S289-W294 VanDerWaalsContact O-CA 3.3Å; S289-W294 WeakPolarHBondContact O-CA 3.11Å; S289-W294 PolarHBondContact O-N 3.24Å; R290-W294 HydrophobicContact CG-CH2 4.41Å; R290-W294 HydrophobicContact CG-CZ2 3.75Å; R292-W294 PolarHBondContact O-N 2.68Å
295	R	84.7	Confident	80.1	Confident	53 Å²	53	31.8 Å²	31.8	20%	0.2	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-100.4	150.2	169.5	-62.5	178.9	177.1	131	-8.9	111.1	V6 R292 S293	V6-R295 VanDerWaalsContact O-CZ 3.26Å; V6-R295 PolarHBondContact O-NE 2.91Å; V6-R295 PolarHBondContact O-NH2 2.83Å; R292-R295 HydrophobicContact CB-CB 4.45Å; R292-R295 WeakPolarHBondContact CB-O 3.48Å; R292-R295 WeakPolarHBondContact CD-O 2.73Å; R292-R295 PolarHBondContact NE-O 2.75Å; R292-R295 WeakPolarHBondContact O-CB 3.42Å; R292-R295 WeakPolarHBondContact O-CG 3.48Å; R292-R295 PolarHBondContact O-N 3.48Å; S293-R295 PolarHBondContact O-N 3.39Å
296	A	87.4	Confident	81.4	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.147	C	C	.	.	P	Polyproline II helix	trans	-65.1	148.4	171.7	0	0	0	0	0	111.1	L147 E230 K233 S234 R237	L147-A296 HydrophobicContact CD2-CB 3.97Å; E230-A296 WeakPolarHBondContact O-CB 3.25Å; K233-A296 VanDerWaalsContact C-CB 3.44Å; K233-A296 HydrophobicContact CB-CB 3.59Å; S234-A296 VanDerWaalsContact N-CB 3.32Å; R237-A296 VanDerWaalsContact CD-O 3.24Å; R237-A296 WeakPolarHBondContact CD-O 3.13Å; R237-A296 PolarHBondContact NH1-O 3.2Å
297	P	89.3	Confident	82.7	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.129	C	C	.	.	P	Polyproline II helix	trans	-69.4	153.7	-179.2	23.7	-27.8	0	0	0	112.9	L213 V225 S234 T377 E379	L213-P297 HydrophobicContact CD1-CB 4.5Å; L213-P297 HydrophobicContact CD1-CG 4.17Å; V225-P297 HydrophobicContact CG1-CG 3.33Å; S234-P297 VanDerWaalsContact CB-O 3.24Å; S234-P297 WeakPolarHBondContact CB-O 3.44Å; S234-P297 PolarHBondContact OG-O 3.25Å; P297-T377 HydrophobicContact CB-CG2 3.87Å; P297-T377 HydrophobicContact CG-CG2 4Å; P297-E379 WeakPolarHBondContact CA-OE2 3.4Å; P297-E379 WeakPolarHBondContact CB-OE2 3.35Å
298	R	89.3	Confident	83.9	Confident	24 Å²	24	25.1 Å²	25.1	9%	0.091	12%	0.119	C	C	.	.	P	Polyproline II helix	trans	-87.5	129.2	165.9	-72.2	170.3	-69.2	-173.8	1.8	108.2	E13 R237 C302 L303 E379	E13-R298 IonicContact OE1-NH1 2.8Å; E13-R298 WeakPolarHBondContact OE2-CD 3.25Å; E13-R298 IonicContact OE2-CZ 2.79Å; E13-R298 IonicContact OE2-NE 3.67Å; E13-R298 IonicContact OE2-NH1 3.91Å; E13-R298 PolarHBondContact OE2-NH1 3.2Å; R237-R298 VanDerWaalsContact NH2-CZ 3.32Å; R237-R298 VanDerWaalsContact NH2-NE 3.17Å; R298-C302 HydrophobicContact CB-CB 4.43Å; R298-L303 HydrophobicContact CB-CD2 3.61Å; R298-L303 HydrophobicContact CB-CG 4.5Å; R298-E379 IonicContact CZ-OE1 3.72Å; R298-E379 PolarHBondContact N-OE2 2.75Å; R298-E379 IonicContact NE-OE1 2.57Å; R298-E379 PolarHBondContact NE-OE1 2.78Å; R298-E379 IonicContact NH2-OE1 2.61Å; R298-E379 PolarHBondContact NH2-OE1 2.89Å
299	P	91.4	Very high	85.3	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-62.8	156.8	165.1	-15.7	29.9	0	0	0	110.7	L213 P214 E223 S234 C238 I240 Q301 C302 L303	L213-P299 HydrophobicContact CB-CB 4.33Å; L213-P299 HydrophobicContact CB-CG 4.15Å; L213-P299 HydrophobicContact CD1-CB 4.49Å; L213-P299 HydrophobicContact CD1-CG 4.26Å; P214-P299 HydrophobicContact CG-CG 3.89Å; P214-P299 WeakPolarHBondContact O-CB 2.73Å; E223-P299 VanDerWaalsContact OE2-CA 3.26Å; E223-P299 WeakPolarHBondContact OE2-CA 3.06Å; S234-P299 WeakPolarHBondContact OG-CD 3.43Å; C238-P299 WeakPolarHBondContact SG-CD 3.29Å; I240-P299 HydrophobicContact CD1-CG 3.88Å; P299-Q301 VanDerWaalsContact C-N 3.33Å; P299-Q301 PolarHBondContact O-N 2.79Å; P299-C302 WeakPolarHBondContact O-CA 3.44Å; P299-C302 WeakPolarHBondContact O-CB 3.34Å; P299-C302 PolarHBondContact O-N 2.94Å; P299-L303 PolarHBondContact O-N 3.12Å
300	L	92.4	Very high	86.4	Confident	1 Å²	1	30.4 Å²	30.4	1%	0.005	15%	0.151	C	C	.	.	G	3₁₀ helix	trans	-50.4	-49.3	-173.5	177.3	63.6	0	0	0	112.4	E220 P221 E223 C302 L303 Y306 L327 L336 A378	E220-L300 HydrophobicContact CG-CD2 4.29Å; P221-L300 HydrophobicContact CG-CD2 3.97Å; E223-L300 WeakPolarHBondContact OE2-CB 3.48Å; E223-L300 PolarHBondContact OE2-N 2.92Å; L300-C302 PolarHBondContact O-N 3.45Å; L300-C302 VanDerWaalsContact O-N 3.1Å; L300-L303 HydrophobicContact CD1-CD1 4.13Å; L300-L303 WeakPolarHBondContact O-CB 3.43Å; L300-L303 PolarHBondContact O-N 2.9Å; L300-Y306 HydrophobicContact CD1-CD1 4.47Å; L300-Y306 HydrophobicContact CD1-CD2 3.72Å; L300-Y306 HydrophobicContact CD1-CE2 4.06Å; L300-Y306 HydrophobicContact CD1-CG 3.93Å; L300-Y306 HydrophobicContact CD2-CE1 4.47Å; L300-Y306 HydrophobicContact CD2-CE2 4.06Å; L300-Y306 HydrophobicContact CG-CD1 4.14Å; L300-Y306 HydrophobicContact CG-CD2 4.06Å; L300-Y306 HydrophobicContact CG-CE1 4.09Å; L300-Y306 HydrophobicContact CG-CE2 4.03Å; L300-Y306 HydrophobicContact CG-CG 4.11Å; L300-Y306 WeakPolarHBondContact O-CB 3.45Å; L300-Y306 WeakPolarHBondContact O-CD1 3.34Å; L300-L327 HydrophobicContact CD1-CD1 4.04Å; L300-L336 HydrophobicContact CD1-CD1 3.94Å; L300-L336 HydrophobicContact CD1-CD2 4.26Å; L300-L336 HydrophobicContact CD2-CD1 3.94Å; L300-L336 HydrophobicContact CD2-CD2 4.16Å; L300-A378 HydrophobicContact CD1-CB 4.35Å
301	Q	87.7	Confident	87.6	Confident	42 Å²	42	26.8 Å²	26.8	20%	0.196	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-64.3	-15.9	-180	74.1	-77.1	-0.1	0	0	113.8	P214 P299	P214-Q301 VanDerWaalsContact C-NE2 3.32Å; P214-Q301 PolarHBondContact O-NE2 3.44Å; P214-Q301 PolarHBondContact O-OE1 3.11Å; P299-Q301 VanDerWaalsContact C-N 3.33Å; P299-Q301 PolarHBondContact O-N 2.79Å
302	C	86.9	Confident	88.4	Confident	5 Å²	5	27.1 Å²	27.1	3%	0.034	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-97.4	-2.1	177.1	-66	0	0	0	0	113	W10 C238 R298 P299 L300	W10-C302 VanDerWaalsContact CD1-O 3.25Å; W10-C302 PolarHBondContact NE1-O 2.88Å; C238-C302 HydrophobicContact CB-CB 4.19Å; R298-C302 HydrophobicContact CB-CB 4.43Å; P299-C302 WeakPolarHBondContact O-CA 3.44Å; P299-C302 WeakPolarHBondContact O-CB 3.34Å; P299-C302 PolarHBondContact O-N 2.94Å; L300-C302 PolarHBondContact O-N 3.45Å; L300-C302 VanDerWaalsContact O-N 3.1Å
303	L	88.5	Confident	89.2	Confident	1 Å²	1	32 Å²	32	1%	0.005	17%	0.166	C	C	.	.			trans	-74.3	128.5	176.9	-63	178.2	0	0	0	110.5	R298 P299 L300 Y305 Y306 L327 E379	R298-L303 HydrophobicContact CB-CD2 3.61Å; R298-L303 HydrophobicContact CB-CG 4.5Å; P299-L303 PolarHBondContact O-N 3.12Å; L300-L303 HydrophobicContact CD1-CD1 4.13Å; L300-L303 WeakPolarHBondContact O-CB 3.43Å; L300-L303 PolarHBondContact O-N 2.9Å; L303-Y305 HydrophobicContact CB-CD2 4.38Å; L303-Y305 HydrophobicContact CB-CE2 4.1Å; L303-Y305 HydrophobicContact CD1-CE2 3.9Å; L303-Y305 HydrophobicContact CG-CE2 4.44Å; L303-Y305 PolarHBondContact O-N 2.76Å; L303-Y305 VanDerWaalsContact O-N 3.11Å; L303-Y306 PolarHBondContact O-N 3.3Å; L303-Y306 VanDerWaalsContact O-N 3.07Å; L303-L327 HydrophobicContact CD1-CD1 3.88Å; L303-E379 HydrophobicContact CD2-CB 3.95Å; L303-E379 HydrophobicContact CD2-CG 3.86Å
304	P	84.2	Confident	90	Very high	18 Å²	18	32.9 Å²	32.9	12%	0.117	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-18.1	-176.2	25.6	-33.6	0	0	0	113.3	V414 N415	P304-V414 HydrophobicContact CB-CG1 4.5Å; P304-V414 CarbonylContact O-C 3.57Å; P304-V414 WeakPolarHBondContact O-CA 3.26Å; P304-N415 PolarHBondContact O-N 2.83Å
305	Y	89.9	Confident	90.7	Very high	8 Å²	8	30 Å²	30	3%	0.031	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.3	13.7	178.4	49.3	-99.7	0	0	0	113.2	L303 H307 F325 L327 V382 P412	L303-Y305 HydrophobicContact CB-CD2 4.38Å; L303-Y305 HydrophobicContact CB-CE2 4.1Å; L303-Y305 HydrophobicContact CD1-CE2 3.9Å; L303-Y305 HydrophobicContact CG-CE2 4.44Å; L303-Y305 PolarHBondContact O-N 2.76Å; L303-Y305 VanDerWaalsContact O-N 3.11Å; Y305-H307 PolarHBondContact O-CD2 3.49Å; Y305-F325 AromaticContact CD2-CE2 3.99Å; Y305-F325 HydrophobicContact CD2-CE2 3.99Å; Y305-F325 HydrophobicContact CE2-CE2 4.17Å; Y305-F325 HydrophobicContact CG-CE2 4.17Å; Y305-L327 HydrophobicContact CD2-CB 4.49Å; Y305-L327 HydrophobicContact CD2-CD1 4.04Å; Y305-L327 HydrophobicContact CD2-CG 3.85Å; Y305-L327 HydrophobicContact CE2-CD1 3.71Å; Y305-L327 HydrophobicContact CE2-CG 3.97Å; Y305-L327 PolarHBondContact O-N 3.5Å; Y305-V382 HydrophobicContact CE2-CG1 4.05Å; Y305-V382 HydrophobicContact CE2-CG2 4.44Å; Y305-P412 HydrophobicContact CD1-CB 3.53Å; Y305-P412 HydrophobicContact CD1-CG 4.29Å; Y305-P412 HydrophobicContact CE1-CB 4.46Å; Y305-P412 HydrophobicContact CG-CB 3.84Å
306	Y	91.5	Very high	91.1	Very high	12 Å²	12	30.6 Å²	30.6	5%	0.047	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	124.4	168	177.3	-117.3	0	0	0	110.2	E220 L300 L303 L327 S329 L336 N415	E220-Y306 VanDerWaalsContact OE1-CE1 3.32Å; E220-Y306 WeakPolarHBondContact OE1-CE1 3.26Å; E220-Y306 PolarHBondContact OE1-OH 3.38Å; L300-Y306 HydrophobicContact CD1-CD1 4.47Å; L300-Y306 HydrophobicContact CD1-CD2 3.72Å; L300-Y306 HydrophobicContact CD1-CE2 4.06Å; L300-Y306 HydrophobicContact CD1-CG 3.93Å; L300-Y306 HydrophobicContact CD2-CE1 4.47Å; L300-Y306 HydrophobicContact CD2-CE2 4.06Å; L300-Y306 HydrophobicContact CG-CD1 4.14Å; L300-Y306 HydrophobicContact CG-CD2 4.06Å; L300-Y306 HydrophobicContact CG-CE1 4.09Å; L300-Y306 HydrophobicContact CG-CE2 4.03Å; L300-Y306 HydrophobicContact CG-CG 4.11Å; L300-Y306 WeakPolarHBondContact O-CB 3.45Å; L300-Y306 WeakPolarHBondContact O-CD1 3.34Å; L303-Y306 PolarHBondContact O-N 3.3Å; L303-Y306 VanDerWaalsContact O-N 3.07Å; Y306-L327 CarbonylContact C-O 3.51Å; Y306-L327 WeakPolarHBondContact CA-O 3.47Å; Y306-L327 HydrophobicContact CD2-CB 3.94Å; Y306-S329 PolarHBondContact OH-OG 3.19Å; Y306-L336 HydrophobicContact CE2-CD1 4.14Å; Y306-N415 PolarHBondContact O-ND2 3.29Å
307	H	91.9	Very high	91.4	Very high	28 Å²	28	35.6 Å²	35.6	13%	0.13	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	5.7	-173.8	-69.5	-102.2	0	0	0	113.6	Y305 M310 L327 V413 N415	Y305-H307 PolarHBondContact O-CD2 3.49Å; H307-M310 HydrophobicContact CB-CE 4.43Å; H307-M310 HydrophobicContact CB-SD 3.53Å; H307-M310 VanDerWaalsContact CB-SD 3.53Å; H307-L327 PolarHBondContact N-O 3.3Å; H307-V413 PolarHBondContact NE2-O 2.83Å; H307-N415 WeakPolarHBondContact CA-ND2 3.5Å; H307-N415 VanDerWaalsContact CE1-CA 3.41Å; H307-N415 WeakPolarHBondContact CE1-CA 3.46Å
308	G	90.1	Very high	91.6	Very high	19 Å²	19	38.8 Å²	38.8	20%	0.196	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	73.3	-146.2	-176	0	0	0	0	0	111.4	Y328 S329	G308-Y328 CarbonylContact O-C 3.59Å; G308-Y328 WeakPolarHBondContact O-CA 3.19Å; G308-S329 PolarHBondContact O-N 3.42Å
309	T	92	Very high	91.8	Very high	91 Å²	91	37.6 Å²	37.6	56%	0.558	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	121.1	-177.5	-53.7	0	0	0	0	111.2	S329 K331	T309-S329 VanDerWaalsContact CA-O 3.27Å; T309-S329 WeakPolarHBondContact CA-O 3.18Å; T309-K331 HydrophobicContact CG2-CB 3.79Å; T309-K331 HydrophobicContact CG2-CD 4.46Å; T309-K331 HydrophobicContact CG2-CG 3.95Å
310	M	93.7	Very high	91.7	Very high	21 Å²	21	42.9 Å²	42.9	10%	0.103	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	166	179.7	74	-162	-47.8	0	0	111.9	H307 E314 A315 L318 Y328 S329 K331	H307-M310 HydrophobicContact CB-CE 4.43Å; H307-M310 HydrophobicContact CB-SD 3.53Å; H307-M310 VanDerWaalsContact CB-SD 3.53Å; M310-E314 WeakPolarHBondContact CA-OE2 3.46Å; M310-E314 HydrophobicContact CB-CB 4.35Å; M310-E314 WeakPolarHBondContact CB-OE2 3.32Å; M310-E314 HydrophobicContact CE-CB 3.61Å; M310-A315 HydrophobicContact CG-CB 4.32Å; M310-A315 HydrophobicContact SD-CB 4.02Å; M310-L318 HydrophobicContact CE-CD1 3.84Å; M310-Y328 HydrophobicContact CG-CD2 3.54Å; M310-Y328 HydrophobicContact CG-CE2 4.39Å; M310-Y328 HydrophobicContact CG-CG 3.77Å; M310-Y328 WeakPolarHBondContact O-CD2 3.4Å; M310-Y328 HydrophobicContact SD-CG 4.16Å; M310-S329 PolarHBondContact N-O 2.82Å; M310-K331 PolarHBondContact O-N 3.16Å
311	F	95.6	Very high	91.5	Very high	74 Å²	74	49.3 Å²	49.3	33%	0.325	25%	0.246	S	C	.	.			trans	-78.9	152.2	172.1	-69.4	-69.8	0	0	0	111.3	E313 E314 A315 K331	F311-E313 WeakPolarHBondContact CB-OE2 3.27Å; F311-E313 PolarHBondContact O-N 3.2Å; F311-E314 HydrophobicContact CB-CG 4.28Å; F311-E314 PolarHBondContact N-OE2 3.26Å; F311-E314 PolarHBondContact O-N 3.3Å; F311-E314 VanDerWaalsContact O-N 3.15Å; F311-A315 PolarHBondContact O-N 3.32Å; F311-K331 HydrophobicContact CD1-CB 4.01Å; F311-K331 HydrophobicContact CD2-CD 4.04Å; F311-K331 HydrophobicContact CE1-CB 3.97Å; F311-K331 HydrophobicContact CE1-CD 4.18Å; F311-K331 HydrophobicContact CE1-CG 4.13Å; F311-K331 HydrophobicContact CE2-CD 3.63Å; F311-K331 HydrophobicContact CE2-CG 4.45Å; F311-K331 HydrophobicContact CG-CB 4.38Å; F311-K331 HydrophobicContact CZ-CB 4.34Å; F311-K331 HydrophobicContact CZ-CD 3.7Å; F311-K331 HydrophobicContact CZ-CG 4.06Å
312	P	93.8	Very high	91.5	Very high	28 Å²	28	51.1 Å²	51.1	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-52.2	-39.9	177	-26.8	35.1	0	0	0	113.5	E314 A315 E316 H352	P312-E314 PolarHBondContact O-N 2.69Å; P312-A315 WeakPolarHBondContact O-CB 3.47Å; P312-A315 PolarHBondContact O-N 2.78Å; P312-A315 VanDerWaalsContact O-N 3.15Å; P312-E316 WeakPolarHBondContact O-CG 3.09Å; P312-E316 PolarHBondContact O-N 3.24Å; P312-H352 PolarHBondContact O-CE1 3.09Å
313	E	94.6	Very high	91.6	Very high	115 Å²	115	51.1 Å²	51.1	54%	0.537	26%	0.258	S	S	.	.	H	α-helix	trans	-65	-38.9	-178.7	-58.6	75.5	-165	0	0	111.8	F311 A315 E316 D317	F311-E313 WeakPolarHBondContact CB-OE2 3.27Å; F311-E313 PolarHBondContact O-N 3.2Å; E313-A315 VanDerWaalsContact C-N 3.31Å; E313-A315 PolarHBondContact O-N 3.03Å; E313-E316 WeakPolarHBondContact O-CB 3.45Å; E313-E316 PolarHBondContact O-N 3.26Å; E313-D317 PolarHBondContact O-N 3.41Å
314	E	95.1	Very high	91.8	Very high	89 Å²	89	51.6 Å²	51.6	42%	0.416	26%	0.26	S	S	.	.	H	α-helix	trans	-65.5	-36.9	175.4	-61.2	173.8	137.6	0	0	111	M310 F311 P312 D317 L318	M310-E314 WeakPolarHBondContact CA-OE2 3.46Å; M310-E314 HydrophobicContact CB-CB 4.35Å; M310-E314 WeakPolarHBondContact CB-OE2 3.32Å; M310-E314 HydrophobicContact CE-CB 3.61Å; F311-E314 HydrophobicContact CB-CG 4.28Å; F311-E314 PolarHBondContact N-OE2 3.26Å; F311-E314 PolarHBondContact O-N 3.3Å; F311-E314 VanDerWaalsContact O-N 3.15Å; P312-E314 PolarHBondContact O-N 2.69Å; E314-D317 PolarHBondContact O-N 3.44Å; E314-L318 WeakPolarHBondContact O-CG 3.28Å
315	A	94.2	Very high	92.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-67.6	-40.6	174.2	0	0	0	0	0	111.5	M310 F311 P312 E313 D317 L318 L326 Y328 A339	M310-A315 HydrophobicContact CG-CB 4.32Å; M310-A315 HydrophobicContact SD-CB 4.02Å; F311-A315 PolarHBondContact O-N 3.32Å; P312-A315 WeakPolarHBondContact O-CB 3.47Å; P312-A315 PolarHBondContact O-N 2.78Å; P312-A315 VanDerWaalsContact O-N 3.15Å; E313-A315 VanDerWaalsContact C-N 3.31Å; E313-A315 PolarHBondContact O-N 3.03Å; A315-D317 VanDerWaalsContact C-N 3.29Å; A315-D317 PolarHBondContact O-N 2.94Å; A315-L318 PolarHBondContact O-N 2.97Å; A315-L326 HydrophobicContact CB-CD1 3.92Å; A315-Y328 HydrophobicContact CB-CD1 3.87Å; A315-Y328 HydrophobicContact CB-CE1 3.84Å; A315-Y328 HydrophobicContact CB-CG 4.3Å; A315-A339 HydrophobicContact CB-CB 4.43Å
316	E	94	Very high	92.6	Very high	66 Å²	66	50.3 Å²	50.3	31%	0.308	25%	0.253	S	S	.	.	H	α-helix	trans	-60.5	-39.3	175.3	-74.1	-173.8	-176.3	0	0	112.1	P312 E313 L318 L319 K350 H352	P312-E316 WeakPolarHBondContact O-CG 3.09Å; P312-E316 PolarHBondContact O-N 3.24Å; E313-E316 WeakPolarHBondContact O-CB 3.45Å; E313-E316 PolarHBondContact O-N 3.26Å; E316-L318 PolarHBondContact O-N 2.86Å; E316-L319 PolarHBondContact O-N 3.14Å; E316-K350 HydrophobicContact CB-CD 3.45Å; E316-K350 VanDerWaalsContact CB-CD 3.45Å; E316-K350 HydrophobicContact CG-CB 4.03Å; E316-K350 HydrophobicContact CG-CD 3.54Å; E316-K350 HydrophobicContact CG-CG 4.42Å; E316-K350 WeakPolarHBondContact O-CE 3.41Å; E316-K350 PolarHBondContact O-NZ 2.83Å; E316-H352 WeakPolarHBondContact CG-NE2 3.32Å; E316-H352 IonicContact OE1-CD2 3.02Å; E316-H352 IonicContact OE1-NE2 2.85Å; E316-H352 PolarHBondContact OE1-NE2 3.16Å
317	D	93.7	Very high	92.8	Very high	106 Å²	106	49.8 Å²	49.8	57%	0.567	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-18	178.3	-79.8	-21.8	0	0	0	113.7	E313 E314 A315 K320	E313-D317 PolarHBondContact O-N 3.41Å; E314-D317 PolarHBondContact O-N 3.44Å; A315-D317 VanDerWaalsContact C-N 3.29Å; A315-D317 PolarHBondContact O-N 2.94Å; D317-K320 WeakPolarHBondContact O-CE 3.2Å; D317-K320 PolarHBondContact O-NZ 3.04Å
318	L	93.1	Very high	93	Very high	66 Å²	66	48.5 Å²	48.5	35%	0.346	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-19.4	177.6	-64.2	175.3	0	0	0	113.3	M310 E314 A315 E316 L326 V413	M310-L318 HydrophobicContact CE-CD1 3.84Å; E314-L318 WeakPolarHBondContact O-CG 3.28Å; A315-L318 PolarHBondContact O-N 2.97Å; E316-L318 PolarHBondContact O-N 2.86Å; L318-L326 HydrophobicContact CB-CD2 3.72Å; L318-L326 HydrophobicContact CD1-CD2 4.04Å; L318-V413 HydrophobicContact CB-CG1 4.26Å
319	L	92.8	Very high	93.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.238	C	C	.	.			trans	-84.7	125	178.3	-61.8	170.8	0	0	0	110.1	E316 Q324 L326 A339 C341 V413	E316-L319 PolarHBondContact O-N 3.14Å; L319-Q324 HydrophobicContact CD2-CB 4.11Å; L319-Q324 WeakPolarHBondContact CD2-O 3.41Å; L319-L326 HydrophobicContact CD2-CD2 4.21Å; L319-L326 HydrophobicContact CD2-CG 4.31Å; L319-L326 HydrophobicContact CG-CD2 4.36Å; L319-A339 HydrophobicContact CD1-CB 3.83Å; L319-C341 HydrophobicContact CB-CB 3.72Å; L319-C341 HydrophobicContact CD1-CB 4.24Å; L319-C341 HydrophobicContact CG-CB 4.42Å; L319-V413 HydrophobicContact CD2-CG2 3.94Å
320	K	89.5	Confident	93.3	Very high	110 Å²	110	44.2 Å²	44.2	48%	0.478	22%	0.215	S	C	.	.			trans	-128	-27.9	-174.1	-58.4	-61.7	171.6	-159.6	0	114.9	D317 H343	D317-K320 WeakPolarHBondContact O-CE 3.2Å; D317-K320 PolarHBondContact O-NZ 3.04Å; K320-H343 PolarHBondContact O-CE1 3.12Å
321	F	88.5	Confident	93.3	Very high	136 Å²	136	48.9 Å²	48.9	60%	0.596	24%	0.235	S	C	*	.	S	Bend	trans	-130.6	163.6	-173.7	-53.9	-63.5	0	0	0	112.8	G323 Q324	F321-G323 PolarHBondContact O-N 2.61Å; F321-Q324 HydrophobicContact CB-CG 4.02Å; F321-Q324 VanDerWaalsContact O-CB 3.27Å; F321-Q324 WeakPolarHBondContact O-CB 3.26Å; F321-Q324 PolarHBondContact O-N 2.91Å; F321-Q324 VanDerWaalsContact O-N 3.08Å
322	D	88.9	Confident	93.2	Very high	81 Å²	81	49.8 Å²	49.8	43%	0.433	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	126.8	-178.7	-74.5	-3.7	0	0	0	113.2	Q324 H343	D322-Q324 PolarHBondContact O-N 3.37Å; D322-H343 WeakPolarHBondContact OD1-CA 3.38Å; D322-H343 WeakPolarHBondContact OD1-CB 3.47Å; D322-H343 IonicContact OD1-CE1 3.99Å; D322-H343 IonicContact OD1-CG 2.67Å; D322-H343 VanDerWaalsContact OD1-CG 3.29Å; D322-H343 PolarHBondContact OD1-N 2.88Å; D322-H343 IonicContact OD1-ND1 2.8Å; D322-H343 PolarHBondContact OD1-ND1 3.38Å
323	G	88.5	Confident	93	Very high	4 Å²	4	53.4 Å²	53.4	4%	0.041	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	74	8	-178.5	0	0	0	0	0	113.7	F321 C341 I408 N410 E411	F321-G323 PolarHBondContact O-N 2.61Å; G323-C341 PolarHBondContact N-O 2.59Å; G323-I408 WeakPolarHBondContact CA-O 3.34Å; G323-N410 PolarHBondContact O-N 3.48Å; G323-E411 PolarHBondContact O-N 3.44Å
324	Q	93.2	Very high	92.8	Very high	11 Å²	11	50.1 Å²	50.1	5%	0.051	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	139.1	165.3	-75.8	-167.8	-30.6	0	0	110.2	L319 F321 D322 A340 C341 E411 V413	L319-Q324 HydrophobicContact CD2-CB 4.11Å; L319-Q324 WeakPolarHBondContact CD2-O 3.41Å; F321-Q324 HydrophobicContact CB-CG 4.02Å; F321-Q324 VanDerWaalsContact O-CB 3.27Å; F321-Q324 WeakPolarHBondContact O-CB 3.26Å; F321-Q324 PolarHBondContact O-N 2.91Å; F321-Q324 VanDerWaalsContact O-N 3.08Å; D322-Q324 PolarHBondContact O-N 3.37Å; Q324-A340 CarbonylContact O-C 3.59Å; Q324-A340 WeakPolarHBondContact O-CA 3.32Å; Q324-C341 PolarHBondContact O-N 3.35Å; Q324-E411 VanDerWaalsContact CA-O 3.24Å; Q324-E411 WeakPolarHBondContact CA-O 3.36Å; Q324-E411 HydrophobicContact CG-CB 4.38Å; Q324-E411 PolarHBondContact NE2-OE2 3.48Å; Q324-V413 HydrophobicContact CB-CG2 3.83Å; Q324-V413 HydrophobicContact CG-CG2 4.23Å
325	F	94.8	Very high	92.8	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	158.3	178.1	74	-81.9	0	0	0	112	Y305 A339 A340 V382 L386 F409 E411 P412 V413	Y305-F325 AromaticContact CD2-CE2 3.99Å; Y305-F325 HydrophobicContact CD2-CE2 3.99Å; Y305-F325 HydrophobicContact CE2-CE2 4.17Å; Y305-F325 HydrophobicContact CG-CE2 4.17Å; F325-A339 CarbonylContact C-O 3.6Å; F325-A339 WeakPolarHBondContact CA-O 3.28Å; F325-A339 WeakPolarHBondContact CB-O 3.29Å; F325-A340 HydrophobicContact CB-CB 3.95Å; F325-V382 HydrophobicContact CE2-CG1 3.64Å; F325-V382 HydrophobicContact CZ-CG1 4.03Å; F325-L386 HydrophobicContact CE1-CD1 4.27Å; F325-L386 HydrophobicContact CE1-CD2 3.72Å; F325-L386 HydrophobicContact CE1-CG 4.34Å; F325-L386 HydrophobicContact CZ-CD1 3.84Å; F325-L386 HydrophobicContact CZ-CD2 4.15Å; F325-L386 HydrophobicContact CZ-CG 4.31Å; F325-F409 HydrophobicContact CB-CD1 3.81Å; F325-F409 HydrophobicContact CB-CE1 4.08Å; F325-F409 HydrophobicContact CB-CG 4.26Å; F325-F409 HydrophobicContact CD1-CB 3.72Å; F325-F409 HydrophobicContact CD1-CD1 4.29Å; F325-F409 AromaticContact CD1-CG 3.95Å; F325-F409 HydrophobicContact CD1-CG 3.95Å; F325-F409 HydrophobicContact CD2-CD2 4.41Å; F325-F409 HydrophobicContact CD2-CG 4.49Å; F325-F409 HydrophobicContact CE1-CB 4.03Å; F325-F409 HydrophobicContact CE1-CG 4.49Å; F325-F409 HydrophobicContact CG-CB 4.25Å; F325-F409 HydrophobicContact CG-CD1 4.04Å; F325-F409 HydrophobicContact CG-CD2 4.32Å; F325-F409 AromaticContact CG-CG 3.95Å; F325-F409 HydrophobicContact CG-CG 3.95Å; F325-E411 VanDerWaalsContact CD1-O 3.28Å; F325-E411 WeakPolarHBondContact CD1-O 3.44Å; F325-E411 VanDerWaalsContact CE1-C 3.43Å; F325-E411 PolarHBondContact N-O 2.61Å; F325-E411 VanDerWaalsContact N-O 3.07Å; F325-P412 HydrophobicContact CE1-CB 3.91Å; F325-P412 HydrophobicContact CE1-CG 4.44Å; F325-P412 VanDerWaalsContact CE1-N 3.3Å; F325-P412 HydrophobicContact CE2-CB 4.23Å; F325-P412 HydrophobicContact CZ-CB 3.61Å; F325-P412 HydrophobicContact CZ-CG 4.3Å; F325-V413 PolarHBondContact O-N 2.57Å
326	L	95.4	Very high	92.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	162.8	172.5	64.4	81.5	0	0	0	111.7	A315 L318 L319 Y328 V338 A339 V413	A315-L326 HydrophobicContact CB-CD1 3.92Å; L318-L326 HydrophobicContact CB-CD2 3.72Å; L318-L326 HydrophobicContact CD1-CD2 4.04Å; L319-L326 HydrophobicContact CD2-CD2 4.21Å; L319-L326 HydrophobicContact CD2-CG 4.31Å; L319-L326 HydrophobicContact CG-CD2 4.36Å; L326-Y328 HydrophobicContact CD1-CD1 3.73Å; L326-Y328 HydrophobicContact CD1-CG 4.41Å; L326-V338 WeakPolarHBondContact O-CA 3.17Å; L326-A339 HydrophobicContact CD1-CB 4.24Å; L326-A339 HydrophobicContact CG-CB 4.39Å; L326-A339 PolarHBondContact N-O 3.27Å; L326-A339 PolarHBondContact O-N 2.83Å; L326-V413 HydrophobicContact CB-CB 4.2Å; L326-V413 HydrophobicContact CD2-CB 4.26Å; L326-V413 HydrophobicContact CD2-CG1 4.49Å
327	L	95.9	Very high	92.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	143.9	172.3	-59.9	-173.8	0	0	0	110.7	L300 L303 Y305 Y306 H307 M337 V338 I355 V382	L300-L327 HydrophobicContact CD1-CD1 4.04Å; L303-L327 HydrophobicContact CD1-CD1 3.88Å; Y305-L327 HydrophobicContact CD2-CB 4.49Å; Y305-L327 HydrophobicContact CD2-CD1 4.04Å; Y305-L327 HydrophobicContact CD2-CG 3.85Å; Y305-L327 HydrophobicContact CE2-CD1 3.71Å; Y305-L327 HydrophobicContact CE2-CG 3.97Å; Y305-L327 PolarHBondContact O-N 3.5Å; Y306-L327 CarbonylContact C-O 3.51Å; Y306-L327 WeakPolarHBondContact CA-O 3.47Å; Y306-L327 HydrophobicContact CD2-CB 3.94Å; H307-L327 PolarHBondContact N-O 3.3Å; L327-M337 WeakPolarHBondContact CA-O 3.38Å; L327-V338 HydrophobicContact CD2-CB 3.61Å; L327-V338 HydrophobicContact CD2-CG2 3.82Å; L327-I355 HydrophobicContact CD2-CD1 3.6Å; L327-V382 HydrophobicContact CD1-CG2 4.17Å; L327-V382 HydrophobicContact CD2-CG2 4.21Å
328	Y	95.3	Very high	93	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155	159.9	172.6	72	-77	0	0	0	110.6	G308 M310 A315 L326 D330 M337 A339 H352	G308-Y328 CarbonylContact O-C 3.59Å; G308-Y328 WeakPolarHBondContact O-CA 3.19Å; M310-Y328 HydrophobicContact CG-CD2 3.54Å; M310-Y328 HydrophobicContact CG-CE2 4.39Å; M310-Y328 HydrophobicContact CG-CG 3.77Å; M310-Y328 WeakPolarHBondContact O-CD2 3.4Å; M310-Y328 HydrophobicContact SD-CG 4.16Å; A315-Y328 HydrophobicContact CB-CD1 3.87Å; A315-Y328 HydrophobicContact CB-CE1 3.84Å; A315-Y328 HydrophobicContact CB-CG 4.3Å; L326-Y328 HydrophobicContact CD1-CD1 3.73Å; L326-Y328 HydrophobicContact CD1-CG 4.41Å; Y328-D330 HydrophobicContact CE2-CB 3.93Å; Y328-M337 HydrophobicContact CD1-CB 3.86Å; Y328-M337 HydrophobicContact CD2-CB 4.48Å; Y328-M337 HydrophobicContact CE1-CB 3.36Å; Y328-M337 HydrophobicContact CE1-CG 4.21Å; Y328-M337 HydrophobicContact CE2-CB 4.07Å; Y328-M337 HydrophobicContact CE2-CG 4.1Å; Y328-M337 HydrophobicContact CG-CB 4.39Å; Y328-M337 VanDerWaalsContact CZ-CB 3.48Å; Y328-M337 PolarHBondContact N-O 2.77Å; Y328-M337 PolarHBondContact O-N 3.4Å; Y328-A339 HydrophobicContact CE1-CB 4.02Å; Y328-H352 AromaticContact CE1-ND1 3.7Å; Y328-H352 AromaticContact CZ-ND1 3.64Å; Y328-H352 PolarHBondContact OH-ND1 3.48Å
329	S	95.1	Very high	93.1	Very high	7 Å²	7	37 Å²	37	5%	0.049	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	119.9	168.6	-62.9	0	0	0	0	108.4	Y306 G308 T309 M310 K331 A335	Y306-S329 PolarHBondContact OH-OG 3.19Å; G308-S329 PolarHBondContact O-N 3.42Å; T309-S329 VanDerWaalsContact CA-O 3.27Å; T309-S329 WeakPolarHBondContact CA-O 3.18Å; M310-S329 PolarHBondContact N-O 2.82Å; S329-K331 PolarHBondContact O-N 3.08Å; S329-A335 CarbonylContact C-O 3.54Å; S329-A335 WeakPolarHBondContact CA-O 3.48Å
330	D	94.4	Very high	93.1	Very high	13 Å²	13	37 Å²	37	7%	0.07	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	119.1	-178.3	175	-4.8	0	0	0	110.1	Y328 S332 N333 G334 A335 M337	Y328-D330 HydrophobicContact CE2-CB 3.93Å; D330-S332 PolarHBondContact O-N 2.78Å; D330-S332 VanDerWaalsContact O-N 3.17Å; D330-S332 WeakPolarHBondContact OD1-CB 3.28Å; D330-S332 PolarHBondContact OD1-N 3.23Å; D330-N333 WeakPolarHBondContact CB-OD1 3.43Å; D330-N333 PolarHBondContact O-N 3.35Å; D330-N333 PolarHBondContact OD2-ND2 3.25Å; D330-N333 PolarHBondContact OD2-OD1 3.49Å; D330-G334 VanDerWaalsContact O-CA 3.26Å; D330-G334 WeakPolarHBondContact O-CA 3.29Å; D330-G334 PolarHBondContact O-N 2.79Å; D330-A335 PolarHBondContact N-O 3.33Å; D330-M337 HydrophobicContact CB-CG 3.81Å
331	K	93	Very high	93.2	Very high	120 Å²	120	31.7 Å²	31.7	52%	0.522	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.6	-176.9	-169.1	164.9	172.8	-178.6	0	114	T309 M310 F311 S329	T309-K331 HydrophobicContact CG2-CB 3.79Å; T309-K331 HydrophobicContact CG2-CD 4.46Å; T309-K331 HydrophobicContact CG2-CG 3.95Å; M310-K331 PolarHBondContact O-N 3.16Å; F311-K331 HydrophobicContact CD1-CB 4.01Å; F311-K331 HydrophobicContact CD2-CD 4.04Å; F311-K331 HydrophobicContact CE1-CB 3.97Å; F311-K331 HydrophobicContact CE1-CD 4.18Å; F311-K331 HydrophobicContact CE1-CG 4.13Å; F311-K331 HydrophobicContact CE2-CD 3.63Å; F311-K331 HydrophobicContact CE2-CG 4.45Å; F311-K331 HydrophobicContact CG-CB 4.38Å; F311-K331 HydrophobicContact CZ-CB 4.34Å; F311-K331 HydrophobicContact CZ-CD 3.7Å; F311-K331 HydrophobicContact CZ-CG 4.06Å; S329-K331 PolarHBondContact O-N 3.08Å
332	S	92.4	Very high	93.1	Very high	92 Å²	92	27.1 Å²	27.1	64%	0.643	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-30.1	-178.3	-68.1	0	0	0	0	113.7	D330	D330-S332 PolarHBondContact O-N 2.78Å; D330-S332 VanDerWaalsContact O-N 3.17Å; D330-S332 WeakPolarHBondContact OD1-CB 3.28Å; D330-S332 PolarHBondContact OD1-N 3.23Å
333	N	91.1	Very high	92.8	Very high	104 Å²	104	26.7 Å²	26.7	56%	0.556	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-137.5	-4.8	-171.9	59.4	33.9	0	0	0	114.7	D330 A335	D330-N333 WeakPolarHBondContact CB-OD1 3.43Å; D330-N333 PolarHBondContact O-N 3.35Å; D330-N333 PolarHBondContact OD2-ND2 3.25Å; D330-N333 PolarHBondContact OD2-OD1 3.49Å; N333-A335 PolarHBondContact O-N 3.14Å; N333-A335 WeakPolarHBondContact OD1-CB 3.38Å; N333-A335 PolarHBondContact OD1-N 2.97Å
334	G	90.4	Very high	92.1	Very high	46 Å²	46	29.2 Å²	29.2	47%	0.474	16%	0.164	S	C	.	.			trans	72.2	6.3	-177.4	0	0	0	0	0	114.8	D330	D330-G334 VanDerWaalsContact O-CA 3.26Å; D330-G334 WeakPolarHBondContact O-CA 3.29Å; D330-G334 PolarHBondContact O-N 2.79Å
335	A	93.7	Very high	91	Very high	19 Å²	19	37.4 Å²	37.4	16%	0.157	20%	0.2	C	C	.	.			trans	-71.8	137.6	-177.4	0	0	0	0	0	110.9	S329 D330 N333 M337 E354	S329-A335 CarbonylContact C-O 3.54Å; S329-A335 WeakPolarHBondContact CA-O 3.48Å; D330-A335 PolarHBondContact N-O 3.33Å; N333-A335 PolarHBondContact O-N 3.14Å; N333-A335 WeakPolarHBondContact OD1-CB 3.38Å; N333-A335 PolarHBondContact OD1-N 2.97Å; A335-M337 HydrophobicContact CB-SD 4.03Å; A335-M337 WeakPolarHBondContact O-CG 3.33Å; A335-M337 PolarHBondContact O-N 2.77Å; A335-E354 HydrophobicContact CB-CG 4.16Å
336	L	95.5	Very high	89.8	Confident	9 Å²	9	41.3 Å²	41.3	5%	0.047	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	121.1	171.8	178.3	61.6	0	0	0	109	P221 L300 Y306 E354 I355 F364 A378	P221-L336 HydrophobicContact CG-CD2 4.04Å; L300-L336 HydrophobicContact CD1-CD1 3.94Å; L300-L336 HydrophobicContact CD1-CD2 4.26Å; L300-L336 HydrophobicContact CD2-CD1 3.94Å; L300-L336 HydrophobicContact CD2-CD2 4.16Å; Y306-L336 HydrophobicContact CE2-CD1 4.14Å; L336-E354 CarbonylContact O-C 3.6Å; L336-E354 WeakPolarHBondContact O-CA 3.41Å; L336-I355 HydrophobicContact CB-CB 4.46Å; L336-I355 HydrophobicContact CD2-CB 4Å; L336-I355 HydrophobicContact CD2-CD1 4.25Å; L336-I355 HydrophobicContact CD2-CG2 4.12Å; L336-I355 HydrophobicContact CG-CB 4.02Å; L336-I355 HydrophobicContact CG-CD1 4.28Å; L336-I355 PolarHBondContact O-N 2.9Å; L336-F364 HydrophobicContact CD2-CE1 4.41Å; L336-A378 HydrophobicContact CD2-CB 4.22Å
337	M	95.9	Very high	88.8	Confident	22 Å²	22	45.6 Å²	45.6	11%	0.108	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	147.5	-175.8	-57.1	-57.7	-76.2	0	0	111.1	L327 Y328 D330 A335 H352 R353 E354	L327-M337 WeakPolarHBondContact CA-O 3.38Å; Y328-M337 HydrophobicContact CD1-CB 3.86Å; Y328-M337 HydrophobicContact CD2-CB 4.48Å; Y328-M337 HydrophobicContact CE1-CB 3.36Å; Y328-M337 HydrophobicContact CE1-CG 4.21Å; Y328-M337 HydrophobicContact CE2-CB 4.07Å; Y328-M337 HydrophobicContact CE2-CG 4.1Å; Y328-M337 HydrophobicContact CG-CB 4.39Å; Y328-M337 VanDerWaalsContact CZ-CB 3.48Å; Y328-M337 PolarHBondContact N-O 2.77Å; Y328-M337 PolarHBondContact O-N 3.4Å; D330-M337 HydrophobicContact CB-CG 3.81Å; A335-M337 HydrophobicContact CB-SD 4.03Å; A335-M337 WeakPolarHBondContact O-CG 3.33Å; A335-M337 PolarHBondContact O-N 2.77Å; M337-H352 HydrophobicContact CE-CB 4.18Å; M337-R353 CarbonylContact C-O 3.57Å; M337-R353 VanDerWaalsContact CA-O 3.32Å; M337-R353 WeakPolarHBondContact CA-O 3.22Å; M337-E354 HydrophobicContact CE-CB 4.4Å; M337-E354 VanDerWaalsContact SD-CA 3.52Å; M337-E354 HydrophobicContact SD-CB 3.8Å; M337-E354 HydrophobicContact SD-CG 4.2Å
338	V	95.7	Very high	88.1	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.8	159.9	60	0	0	0	0	108.9	L326 L327 H352 R353 I355 I366 L392 F409	L326-V338 WeakPolarHBondContact O-CA 3.17Å; L327-V338 HydrophobicContact CD2-CB 3.61Å; L327-V338 HydrophobicContact CD2-CG2 3.82Å; V338-H352 CarbonylContact O-C 3.54Å; V338-H352 WeakPolarHBondContact O-CA 3.5Å; V338-R353 HydrophobicContact CG1-CB 3.85Å; V338-R353 WeakPolarHBondContact CG1-O 3.44Å; V338-R353 PolarHBondContact N-O 3.48Å; V338-R353 PolarHBondContact O-N 3.11Å; V338-I355 HydrophobicContact CB-CD1 4.24Å; V338-I355 HydrophobicContact CB-CG1 4.38Å; V338-I355 HydrophobicContact CG1-CG1 4.24Å; V338-I366 HydrophobicContact CG1-CD1 3.91Å; V338-I366 HydrophobicContact CG1-CG1 4.46Å; V338-L392 HydrophobicContact CG1-CD1 4.49Å; V338-L392 HydrophobicContact CG1-CD2 4.29Å; V338-F409 HydrophobicContact CG1-CZ 4.31Å; V338-F409 HydrophobicContact CG2-CE1 4.06Å; V338-F409 HydrophobicContact CG2-CE2 4.15Å; V338-F409 HydrophobicContact CG2-CZ 3.48Å; V338-F409 VanDerWaalsContact CG2-CZ 3.48Å
339	A	94.8	Very high	87.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	140.3	171.7	0	0	0	0	0	109.4	A315 L319 F325 L326 Y328 V351	A315-A339 HydrophobicContact CB-CB 4.43Å; L319-A339 HydrophobicContact CD1-CB 3.83Å; F325-A339 CarbonylContact C-O 3.6Å; F325-A339 WeakPolarHBondContact CA-O 3.28Å; F325-A339 WeakPolarHBondContact CB-O 3.29Å; L326-A339 HydrophobicContact CD1-CB 4.24Å; L326-A339 HydrophobicContact CG-CB 4.39Å; L326-A339 PolarHBondContact N-O 3.27Å; L326-A339 PolarHBondContact O-N 2.83Å; Y328-A339 HydrophobicContact CE1-CB 4.02Å; A339-V351 CarbonylContact C-O 3.57Å; A339-V351 VanDerWaalsContact CA-O 3.26Å; A339-V351 WeakPolarHBondContact CA-O 3.25Å
340	A	93.9	Very high	86.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	149.6	176.4	0	0	0	0	0	112.5	Q324 F325 K350 V351 L392 V407 F409	Q324-A340 CarbonylContact O-C 3.59Å; Q324-A340 WeakPolarHBondContact O-CA 3.32Å; F325-A340 HydrophobicContact CB-CB 3.95Å; A340-K350 WeakPolarHBondContact O-CA 3.43Å; A340-V351 PolarHBondContact N-O 3.47Å; A340-V351 PolarHBondContact O-N 2.9Å; A340-L392 HydrophobicContact CB-CD2 4.35Å; A340-V407 HydrophobicContact CB-CB 4.27Å; A340-V407 HydrophobicContact CB-CG1 3.68Å; A340-F409 HydrophobicContact CB-CD1 4.13Å; A340-F409 HydrophobicContact CB-CE1 3.8Å
341	C	91.2	Very high	86.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	143.2	-177	175.7	0	0	0	0	112.8	L319 G323 Q324 E348 K350 V407	L319-C341 HydrophobicContact CB-CB 3.72Å; L319-C341 HydrophobicContact CD1-CB 4.24Å; L319-C341 HydrophobicContact CG-CB 4.42Å; G323-C341 PolarHBondContact N-O 2.59Å; Q324-C341 PolarHBondContact O-N 3.35Å; C341-E348 PolarHBondContact SG-OE1 2.93Å; C341-K350 HydrophobicContact CB-CG 4.38Å; C341-V407 WeakPolarHBondContact O-CG1 3.38Å
342	K	86.9	Confident	86.6	Confident	39 Å²	39	47 Å²	47	17%	0.17	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	132.7	169.8	179.6	178.1	-174.9	179.6	0	110.7	T349 N404 S406 V407	K342-T349 PolarHBondContact N-O 2.85Å; K342-T349 PolarHBondContact O-N 2.65Å; K342-N404 PolarHBondContact NZ-O 2.83Å; K342-S406 WeakPolarHBondContact CD-O 3.2Å; K342-S406 WeakPolarHBondContact CE-O 3.35Å; K342-S406 PolarHBondContact NZ-O 3.05Å; K342-V407 HydrophobicContact CB-CB 4.39Å; K342-V407 HydrophobicContact CB-CG1 4.18Å; K342-V407 HydrophobicContact CB-CG2 3.67Å; K342-V407 HydrophobicContact CD-CG2 4.34Å
343	H	82.1	Confident	86.6	Confident	72 Å²	72	45.2 Å²	45.2	33%	0.333	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.8	170.1	-61.6	79.3	0	0	0	108.3	K320 D322 T347 E348	K320-H343 PolarHBondContact O-CE1 3.12Å; D322-H343 WeakPolarHBondContact OD1-CA 3.38Å; D322-H343 WeakPolarHBondContact OD1-CB 3.47Å; D322-H343 IonicContact OD1-CE1 3.99Å; D322-H343 IonicContact OD1-CG 2.67Å; D322-H343 VanDerWaalsContact OD1-CG 3.29Å; D322-H343 PolarHBondContact OD1-N 2.88Å; D322-H343 IonicContact OD1-ND1 2.8Å; D322-H343 PolarHBondContact OD1-ND1 3.38Å; H343-T347 WeakPolarHBondContact CA-O 3.46Å; H343-E348 IonicContact NE2-OE1 3.29Å
344	F	72.9	Confident	86.7	Confident	58 Å²	58	43.8 Å²	43.8	25%	0.254	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	120.2	178.5	-171.1	-112.7	0	0	0	109.1	G346 T347 T403	F344-G346 PolarHBondContact O-N 3.44Å; F344-G346 VanDerWaalsContact O-N 3.14Å; F344-T347 PolarHBondContact N-O 2.78Å; F344-T347 PolarHBondContact O-N 3.06Å; F344-T347 PolarHBondContact O-OG1 3.2Å; F344-T403 WeakPolarHBondContact CE1-O 3.46Å; F344-T403 WeakPolarHBondContact CZ-O 3.29Å
345	F	70.2	Confident	87	Confident	183 Å²	183	41.9 Å²	41.9	80%	0.803	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.6	39	-176.5	-65.3	-65.7	0	0	0	114.8	T347	F345-T347 VanDerWaalsContact C-N 3.25Å; F345-T347 PolarHBondContact O-N 3.19Å
346	G	69.6	Low	87	Confident	82 Å²	82	46 Å²	46	85%	0.845	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.8	-1.6	-179.7	0	0	0	0	0	114.9	F344	F344-G346 PolarHBondContact O-N 3.44Å; F344-G346 VanDerWaalsContact O-N 3.14Å
347	T	75.5	Confident	86.9	Confident	89 Å²	89	48.5 Å²	48.5	55%	0.546	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	124.4	170.2	16	0	0	0	0	110.5	H343 F344 F345	H343-T347 WeakPolarHBondContact CA-O 3.46Å; F344-T347 PolarHBondContact N-O 2.78Å; F344-T347 PolarHBondContact O-N 3.06Å; F344-T347 PolarHBondContact O-OG1 3.2Å; F345-T347 VanDerWaalsContact C-N 3.25Å; F345-T347 PolarHBondContact O-N 3.19Å
348	E	80.1	Confident	86.6	Confident	86 Å²	86	48.2 Å²	48.2	40%	0.402	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	127.3	171.1	-172.4	-177.9	-157.1	0	0	109.5	C341 H343 K350	C341-E348 PolarHBondContact SG-OE1 2.93Å; H343-E348 IonicContact NE2-OE1 3.29Å; E348-K350 HydrophobicContact CG-CG 4.36Å; E348-K350 WeakPolarHBondContact OE1-CE 3.33Å; E348-K350 IonicContact OE1-NZ 2.79Å; E348-K350 VanDerWaalsContact OE2-CE 3.25Å; E348-K350 WeakPolarHBondContact OE2-CE 3.48Å; E348-K350 IonicContact OE2-NZ 3.64Å
349	T	79.9	Confident	86	Confident	27 Å²	27	53.3 Å²	53.3	17%	0.166	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	121.5	174.4	-54.6	0	0	0	0	109	K342 V351 E405	K342-T349 PolarHBondContact N-O 2.85Å; K342-T349 PolarHBondContact O-N 2.65Å; T349-V351 HydrophobicContact CG2-CG2 4.11Å; T349-E405 HydrophobicContact CG2-CG 4.47Å
350	K	86.8	Confident	85.4	Confident	33 Å²	33	63.4 Å²	63.4	14%	0.143	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	125.8	174.6	-60.3	179.1	-169.9	173.9	0	109.4	E316 A340 C341 E348 N395	E316-K350 HydrophobicContact CB-CD 3.45Å; E316-K350 VanDerWaalsContact CB-CD 3.45Å; E316-K350 HydrophobicContact CG-CB 4.03Å; E316-K350 HydrophobicContact CG-CD 3.54Å; E316-K350 HydrophobicContact CG-CG 4.42Å; E316-K350 WeakPolarHBondContact O-CE 3.41Å; E316-K350 PolarHBondContact O-NZ 2.83Å; A340-K350 WeakPolarHBondContact O-CA 3.43Å; C341-K350 HydrophobicContact CB-CG 4.38Å; E348-K350 HydrophobicContact CG-CG 4.36Å; E348-K350 WeakPolarHBondContact OE1-CE 3.33Å; E348-K350 IonicContact OE1-NZ 2.79Å; E348-K350 VanDerWaalsContact OE2-CE 3.25Å; E348-K350 WeakPolarHBondContact OE2-CE 3.48Å; E348-K350 IonicContact OE2-NZ 3.64Å; K350-N395 PolarHBondContact O-ND2 3.15Å
351	V	88.8	Confident	84.8	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.4	-173.1	179.2	0	0	0	0	108.9	A339 A340 T349 R353 L392 E393 V407	A339-V351 CarbonylContact C-O 3.57Å; A339-V351 VanDerWaalsContact CA-O 3.26Å; A339-V351 WeakPolarHBondContact CA-O 3.25Å; A340-V351 PolarHBondContact N-O 3.47Å; A340-V351 PolarHBondContact O-N 2.9Å; T349-V351 HydrophobicContact CG2-CG2 4.11Å; V351-R353 HydrophobicContact CG1-CG 4.16Å; V351-L392 HydrophobicContact CB-CD2 4.45Å; V351-L392 HydrophobicContact CG1-CD2 3.96Å; V351-L392 HydrophobicContact CG1-CG 4.32Å; V351-E393 WeakPolarHBondContact CG1-O 3.25Å; V351-V407 HydrophobicContact CB-CG2 4.36Å; V351-V407 HydrophobicContact CG2-CG2 3.78Å
352	H	91.2	Very high	84.6	Confident	24 Å²	24	70.9 Å²	70.9	11%	0.111	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	129.8	177.3	-67.7	-111.4	0	0	0	109.5	P312 E316 Y328 M337 V338	P312-H352 PolarHBondContact O-CE1 3.09Å; E316-H352 WeakPolarHBondContact CG-NE2 3.32Å; E316-H352 IonicContact OE1-CD2 3.02Å; E316-H352 IonicContact OE1-NE2 2.85Å; E316-H352 PolarHBondContact OE1-NE2 3.16Å; Y328-H352 AromaticContact CE1-ND1 3.7Å; Y328-H352 AromaticContact CZ-ND1 3.64Å; Y328-H352 PolarHBondContact OH-ND1 3.48Å; M337-H352 HydrophobicContact CE-CB 4.18Å; V338-H352 CarbonylContact O-C 3.54Å; V338-H352 WeakPolarHBondContact O-CA 3.5Å
353	R	91.6	Very high	84.8	Confident	55 Å²	55	71.2 Å²	71.2	21%	0.208	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	133.8	179.1	-71.8	-66.2	178.8	-100.2	13.1	112.1	M337 V338 V351 I355 I366 L392 E393 G394 N395	M337-R353 CarbonylContact C-O 3.57Å; M337-R353 VanDerWaalsContact CA-O 3.32Å; M337-R353 WeakPolarHBondContact CA-O 3.22Å; V338-R353 HydrophobicContact CG1-CB 3.85Å; V338-R353 WeakPolarHBondContact CG1-O 3.44Å; V338-R353 PolarHBondContact N-O 3.48Å; V338-R353 PolarHBondContact O-N 3.11Å; V351-R353 HydrophobicContact CG1-CG 4.16Å; R353-I355 PolarHBondContact O-N 3.27Å; R353-I366 HydrophobicContact CB-CG2 3.98Å; R353-I366 HydrophobicContact CG-CG2 4.35Å; R353-L392 HydrophobicContact CB-CD1 4.08Å; R353-L392 HydrophobicContact CB-CD2 4.3Å; R353-L392 HydrophobicContact CG-CD1 3.74Å; R353-L392 HydrophobicContact CG-CD2 3.9Å; R353-L392 HydrophobicContact CG-CG 3.84Å; R353-E393 PolarHBondContact NE-O 2.82Å; R353-E393 PolarHBondContact NH2-O 2.61Å; R353-G394 PolarHBondContact NH2-O 2.86Å; R353-N395 PolarHBondContact NH1-OD1 3Å
354	E	94.2	Very high	85.4	Confident	74 Å²	74	67.9 Å²	67.9	35%	0.346	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	124.9	173.2	-171.8	-172.2	175.3	0	0	110.5	A335 L336 M337 R356	A335-E354 HydrophobicContact CB-CG 4.16Å; L336-E354 CarbonylContact O-C 3.6Å; L336-E354 WeakPolarHBondContact O-CA 3.41Å; M337-E354 HydrophobicContact CE-CB 4.4Å; M337-E354 VanDerWaalsContact SD-CA 3.52Å; M337-E354 HydrophobicContact SD-CB 3.8Å; M337-E354 HydrophobicContact SD-CG 4.2Å; E354-R356 HydrophobicContact CB-CG 4.32Å; E354-R356 VanDerWaalsContact CD-CG 3.46Å; E354-R356 HydrophobicContact CG-CG 3.72Å; E354-R356 PolarHBondContact O-N 2.76Å; E354-R356 IonicContact OE1-NE 3.03Å; E354-R356 IonicContact OE2-CZ 3.87Å; E354-R356 IonicContact OE2-NE 3.36Å; E354-R356 PolarHBondContact OE2-NE 2.77Å; E354-R356 IonicContact OE2-NH2 3.95Å; E354-R356 PolarHBondContact OE2-NH2 2.82Å
355	I	95.9	Very high	86.5	Confident	7 Å²	7	66.4 Å²	66.4	4%	0.036	33%	0.331	C	S	.	.			trans	-83.9	103.4	163.2	-57.3	-178.5	0	0	0	107.3	L327 L336 V338 R353 F364 I366 L381	L327-I355 HydrophobicContact CD2-CD1 3.6Å; L336-I355 HydrophobicContact CB-CB 4.46Å; L336-I355 HydrophobicContact CD2-CB 4Å; L336-I355 HydrophobicContact CD2-CD1 4.25Å; L336-I355 HydrophobicContact CD2-CG2 4.12Å; L336-I355 HydrophobicContact CG-CB 4.02Å; L336-I355 HydrophobicContact CG-CD1 4.28Å; L336-I355 PolarHBondContact O-N 2.9Å; V338-I355 HydrophobicContact CB-CD1 4.24Å; V338-I355 HydrophobicContact CB-CG1 4.38Å; V338-I355 HydrophobicContact CG1-CG1 4.24Å; R353-I355 PolarHBondContact O-N 3.27Å; I355-F364 HydrophobicContact CG2-CB 4.33Å; I355-F364 HydrophobicContact CG2-CD1 3.83Å; I355-I366 HydrophobicContact CG1-CD1 4.31Å; I355-I366 HydrophobicContact CG1-CG1 3.91Å; I355-L381 HydrophobicContact CG2-CD2 3.75Å
356	R	94.8	Very high	87.6	Confident	105 Å²	105	58.3 Å²	58.3	40%	0.396	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	155	-178.1	-66.9	177.5	-178.1	138.6	5.8	111.3	E354 F364 Y365	E354-R356 HydrophobicContact CB-CG 4.32Å; E354-R356 VanDerWaalsContact CD-CG 3.46Å; E354-R356 HydrophobicContact CG-CG 3.72Å; E354-R356 PolarHBondContact O-N 2.76Å; E354-R356 IonicContact OE1-NE 3.03Å; E354-R356 IonicContact OE2-CZ 3.87Å; E354-R356 IonicContact OE2-NE 3.36Å; E354-R356 PolarHBondContact OE2-NE 2.77Å; E354-R356 IonicContact OE2-NH2 3.95Å; E354-R356 PolarHBondContact OE2-NH2 2.82Å; R356-F364 CarbonylContact O-C 3.55Å; R356-F364 VanDerWaalsContact O-CA 3.3Å; R356-F364 WeakPolarHBondContact O-CA 3.37Å; R356-Y365 HydrophobicContact CB-CD1 4.12Å; R356-Y365 HydrophobicContact CB-CD2 4.12Å; R356-Y365 HydrophobicContact CB-CE1 3.61Å; R356-Y365 HydrophobicContact CB-CE2 3.65Å; R356-Y365 HydrophobicContact CB-CG 4.35Å; R356-Y365 HydrophobicContact CG-CE2 4.34Å; R356-Y365 PolarHBondContact N-O 2.8Å; R356-Y365 VanDerWaalsContact O-CD1 3.3Å; R356-Y365 WeakPolarHBondContact O-CD1 3.42Å; R356-Y365 PolarHBondContact O-N 3.39Å
357	K	93.2	Very high	88.5	Confident	61 Å²	61	55.6 Å²	55.6	27%	0.265	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.9	173.1	-171.2	179	175.8	-171.8	0	111.3	I222 Y363 F364	I222-K357 PolarHBondContact O-NZ 3.36Å; K357-Y363 CarbonylContact C-O 3.51Å; K357-Y363 WeakPolarHBondContact CA-O 3.06Å; K357-F364 HydrophobicContact CB-CE1 4.49Å; K357-F364 HydrophobicContact CD-CE1 4.41Å; K357-F364 HydrophobicContact CD-CE2 4.03Å; K357-F364 HydrophobicContact CD-CZ 3.87Å; K357-F364 HydrophobicContact CG-CE2 4.3Å; K357-F364 HydrophobicContact CG-CZ 4.36Å
358	S	90.1	Very high	89.1	Confident	16 Å²	16	55.6 Å²	55.6	11%	0.112	26%	0.264	C	S	.	.			trans	-72.9	131.5	176.8	73.2	0	0	0	0	110.2	R360 K362 Y363	S358-R360 PolarHBondContact O-N 3.1Å; S358-K362 VanDerWaalsContact O-CA 3.25Å; S358-K362 WeakPolarHBondContact O-CA 3.17Å; S358-K362 PolarHBondContact O-N 3.23Å; S358-K362 PolarHBondContact OG-N 2.71Å; S358-K362 VanDerWaalsContact OG-N 3.11Å; S358-Y363 PolarHBondContact N-O 2.93Å; S358-Y363 PolarHBondContact OG-N 3.45Å
359	S	83	Confident	89.5	Confident	108 Å²	108	56.8 Å²	56.8	76%	0.755	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-40.4	-173.3	52.9	0	0	0	0	113	K362	S359-K362 WeakPolarHBondContact O-CE 3.35Å; S359-K362 PolarHBondContact O-NZ 3.29Å
360	R	82.2	Confident	90	Very high	212 Å²	212	55.5 Å²	55.5	80%	0.8	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-58.2	-178.8	-171.5	179.4	176.5	165.2	0.7	112.6	S358	S358-R360 PolarHBondContact O-N 3.1Å
361	E	80.8	Confident	90.1	Very high	88 Å²	88	57.8 Å²	57.8	41%	0.411	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-9.3	-170.8	-48.9	-55.7	144.8	0	0	114.1	Y363	E361-Y363 HydrophobicContact CB-CD1 4.41Å; E361-Y363 HydrophobicContact CB-CD2 3.49Å; E361-Y363 VanDerWaalsContact CB-CD2 3.49Å; E361-Y363 HydrophobicContact CB-CE1 4.27Å; E361-Y363 HydrophobicContact CB-CE2 3.33Å; E361-Y363 HydrophobicContact CB-CG 4.03Å; E361-Y363 HydrophobicContact CG-CD2 4.29Å; E361-Y363 HydrophobicContact CG-CE2 3.94Å; E361-Y363 WeakPolarHBondContact O-CD1 3.49Å; E361-Y363 WeakPolarHBondContact O-CE1 3.05Å; E361-Y363 PolarHBondContact O-N 2.96Å
362	K	86.9	Confident	90.1	Very high	69 Å²	69	66.5 Å²	66.5	30%	0.3	31%	0.305	S	S	.	.			trans	63.9	18.6	179.2	-47.1	-55.2	-176.8	-174.3	0	115.3	S358 S359	S358-K362 VanDerWaalsContact O-CA 3.25Å; S358-K362 WeakPolarHBondContact O-CA 3.17Å; S358-K362 PolarHBondContact O-N 3.23Å; S358-K362 PolarHBondContact OG-N 2.71Å; S358-K362 VanDerWaalsContact OG-N 3.11Å; S359-K362 WeakPolarHBondContact O-CE 3.35Å; S359-K362 PolarHBondContact O-NZ 3.29Å
363	Y	91.8	Very high	90	Very high	47 Å²	47	67.4 Å²	67.4	18%	0.184	31%	0.311	C	S	.	.			trans	-80.6	138.6	179.1	-53.5	-37.1	0	0	0	112.7	K357 S358 E361 K374 Y375 T376	K357-Y363 CarbonylContact C-O 3.51Å; K357-Y363 WeakPolarHBondContact CA-O 3.06Å; S358-Y363 PolarHBondContact N-O 2.93Å; S358-Y363 PolarHBondContact OG-N 3.45Å; E361-Y363 HydrophobicContact CB-CD1 4.41Å; E361-Y363 HydrophobicContact CB-CD2 3.49Å; E361-Y363 VanDerWaalsContact CB-CD2 3.49Å; E361-Y363 HydrophobicContact CB-CE1 4.27Å; E361-Y363 HydrophobicContact CB-CE2 3.33Å; E361-Y363 HydrophobicContact CB-CG 4.03Å; E361-Y363 HydrophobicContact CG-CD2 4.29Å; E361-Y363 HydrophobicContact CG-CE2 3.94Å; E361-Y363 WeakPolarHBondContact O-CD1 3.49Å; E361-Y363 WeakPolarHBondContact O-CE1 3.05Å; E361-Y363 PolarHBondContact O-N 2.96Å; Y363-K374 HydrophobicContact CD1-CB 4.11Å; Y363-K374 HydrophobicContact CD2-CB 4.29Å; Y363-K374 HydrophobicContact CD2-CG 4.22Å; Y363-K374 HydrophobicContact CE1-CB 3.8Å; Y363-K374 HydrophobicContact CE1-CG 4.38Å; Y363-K374 HydrophobicContact CE2-CB 3.97Å; Y363-K374 HydrophobicContact CE2-CD 4.28Å; Y363-K374 HydrophobicContact CE2-CG 3.69Å; Y363-K374 HydrophobicContact CG-CB 4.37Å; Y363-Y375 CarbonylContact C-O 3.5Å; Y363-Y375 WeakPolarHBondContact CA-O 3.43Å; Y363-T376 HydrophobicContact CD1-CG2 3.8Å; Y363-T376 HydrophobicContact CE1-CG2 3.98Å
364	F	94.8	Very high	89.9	Confident	1 Å²	1	70.1 Å²	70.1	0%	0.004	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	138.9	174.6	-71.5	-101.5	0	0	0	110.6	P221 E223 L336 I355 R356 K357 Y375 T376 L381	P221-F364 HydrophobicContact CB-CE1 4.03Å; P221-F364 HydrophobicContact CB-CZ 4.06Å; P221-F364 HydrophobicContact CG-CE1 4.06Å; P221-F364 HydrophobicContact CG-CZ 4.38Å; E223-F364 HydrophobicContact CG-CE1 4.5Å; E223-F364 HydrophobicContact CG-CE2 3.9Å; E223-F364 HydrophobicContact CG-CZ 3.61Å; L336-F364 HydrophobicContact CD2-CE1 4.41Å; I355-F364 HydrophobicContact CG2-CB 4.33Å; I355-F364 HydrophobicContact CG2-CD1 3.83Å; R356-F364 CarbonylContact O-C 3.55Å; R356-F364 VanDerWaalsContact O-CA 3.3Å; R356-F364 WeakPolarHBondContact O-CA 3.37Å; K357-F364 HydrophobicContact CB-CE1 4.49Å; K357-F364 HydrophobicContact CD-CE1 4.41Å; K357-F364 HydrophobicContact CD-CE2 4.03Å; K357-F364 HydrophobicContact CD-CZ 3.87Å; K357-F364 HydrophobicContact CG-CE2 4.3Å; K357-F364 HydrophobicContact CG-CZ 4.36Å; F364-Y375 PolarHBondContact N-O 2.9Å; F364-T376 VanDerWaalsContact CD2-C 3.46Å; F364-T376 WeakPolarHBondContact CD2-O 3.32Å; F364-T376 WeakPolarHBondContact CE2-O 3.46Å; F364-L381 HydrophobicContact CB-CD2 4.2Å
365	Y	94.8	Very high	89.8	Confident	28 Å²	28	67 Å²	67	11%	0.11	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	144.8	-178.7	64.5	-80.6	0	0	0	111.4	R356 K371	R356-Y365 HydrophobicContact CB-CD1 4.12Å; R356-Y365 HydrophobicContact CB-CD2 4.12Å; R356-Y365 HydrophobicContact CB-CE1 3.61Å; R356-Y365 HydrophobicContact CB-CE2 3.65Å; R356-Y365 HydrophobicContact CB-CG 4.35Å; R356-Y365 HydrophobicContact CG-CE2 4.34Å; R356-Y365 PolarHBondContact N-O 2.8Å; R356-Y365 VanDerWaalsContact O-CD1 3.3Å; R356-Y365 WeakPolarHBondContact O-CD1 3.42Å; R356-Y365 PolarHBondContact O-N 3.39Å; Y365-K371 HydrophobicContact CD1-CD 4.37Å; Y365-K371 HydrophobicContact CD1-CG 3.73Å; Y365-K371 HydrophobicContact CD2-CG 4.07Å; Y365-K371 HydrophobicContact CE1-CD 4.37Å; Y365-K371 HydrophobicContact CE1-CG 4.21Å; Y365-K371 HydrophobicContact CE2-CD 4.5Å; Y365-K371 HydrophobicContact CE2-CG 4.49Å; Y365-K371 HydrophobicContact CG-CD 4.47Å; Y365-K371 HydrophobicContact CG-CG 3.66Å; Y365-K371 WeakPolarHBondContact OH-CE 3.38Å; Y365-K371 PolarHBondContact OH-NZ 3.45Å
366	I	93.2	Very high	89.6	Confident	13 Å²	13	67.3 Å²	67.3	7%	0.067	31%	0.312	C	S	.	.	S	Bend	trans	-95.9	-49.4	167.4	-68.6	159.5	0	0	0	108.4	V338 R353 I355 D370 L381 Y385 L392	V338-I366 HydrophobicContact CG1-CD1 3.91Å; V338-I366 HydrophobicContact CG1-CG1 4.46Å; R353-I366 HydrophobicContact CB-CG2 3.98Å; R353-I366 HydrophobicContact CG-CG2 4.35Å; I355-I366 HydrophobicContact CG1-CD1 4.31Å; I355-I366 HydrophobicContact CG1-CG1 3.91Å; I366-D370 PolarHBondContact N-OD2 3.24Å; I366-D370 VanDerWaalsContact N-OD2 3.08Å; I366-L381 HydrophobicContact CD1-CD2 4.23Å; I366-L381 HydrophobicContact CG1-CD2 4Å; I366-Y385 HydrophobicContact CD1-CD2 4.42Å; I366-Y385 HydrophobicContact CD1-CE1 4.3Å; I366-Y385 HydrophobicContact CD1-CE2 4.03Å; I366-L392 HydrophobicContact CD1-CD1 4.25Å; I366-L392 HydrophobicContact CG2-CD1 3.83Å
367	K	90	Very high	89.5	Confident	24 Å²	24	62.3 Å²	62.3	10%	0.104	29%	0.293	C	S	.	.	S	Bend	trans	-102.9	150.8	177.6	-61.1	175.9	-174.7	-168.3	0	110.2	Y369 D370 P391 E393	K367-Y369 HydrophobicContact CB-CD1 3.8Å; K367-Y369 HydrophobicContact CB-CE1 3.55Å; K367-Y369 HydrophobicContact CB-CE2 4.45Å; K367-Y369 HydrophobicContact CB-CG 4.39Å; K367-Y369 HydrophobicContact CD-CD1 4.38Å; K367-Y369 HydrophobicContact CD-CE1 3.32Å; K367-Y369 HydrophobicContact CD-CE2 4.43Å; K367-Y369 WeakPolarHBondContact CD-OH 3.22Å; K367-Y369 HydrophobicContact CG-CE1 4.07Å; K367-Y369 PolarHBondContact NZ-OH 2.59Å; K367-Y369 PolarHBondContact O-N 2.99Å; K367-Y369 VanDerWaalsContact O-N 3.09Å; K367-D370 PolarHBondContact N-OD2 3.16Å; K367-D370 WeakPolarHBondContact O-CB 3.38Å; K367-D370 PolarHBondContact O-N 2.67Å; K367-P391 WeakPolarHBondContact CE-O 3.31Å; K367-P391 PolarHBondContact NZ-O 2.93Å; K367-E393 VanDerWaalsContact CE-OE1 3.32Å; K367-E393 WeakPolarHBondContact CE-OE1 3.12Å; K367-E393 IonicContact NZ-OE1 2.71Å; K367-E393 PolarHBondContact NZ-OE1 3.03Å
368	S	86.8	Confident	89.5	Confident	89 Å²	89	59.4 Å²	59.4	62%	0.622	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-60.3	-27.1	-175.4	-55.8	0	0	0	0	113.7	K371	S368-K371 WeakPolarHBondContact O-CB 3.41Å; S368-K371 WeakPolarHBondContact O-CG 3.35Å
369	Y	88	Confident	89.7	Confident	111 Å²	111	58.7 Å²	58.7	44%	0.435	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-74.5	-25.1	176.7	64.4	-104.9	0	0	0	113.2	K367 K371 K372	K367-Y369 HydrophobicContact CB-CD1 3.8Å; K367-Y369 HydrophobicContact CB-CE1 3.55Å; K367-Y369 HydrophobicContact CB-CE2 4.45Å; K367-Y369 HydrophobicContact CB-CG 4.39Å; K367-Y369 HydrophobicContact CD-CD1 4.38Å; K367-Y369 HydrophobicContact CD-CE1 3.32Å; K367-Y369 HydrophobicContact CD-CE2 4.43Å; K367-Y369 WeakPolarHBondContact CD-OH 3.22Å; K367-Y369 HydrophobicContact CG-CE1 4.07Å; K367-Y369 PolarHBondContact NZ-OH 2.59Å; K367-Y369 PolarHBondContact O-N 2.99Å; K367-Y369 VanDerWaalsContact O-N 3.09Å; Y369-K371 PolarHBondContact O-N 2.8Å; Y369-K371 VanDerWaalsContact O-N 3.13Å; Y369-K372 WeakPolarHBondContact O-CB 3.45Å; Y369-K372 PolarHBondContact O-N 3.2Å
370	D	91.4	Very high	90.1	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-62.3	-22.9	178.3	-52.7	-22.8	0	0	0	111.3	I366 K367 K372 L373 L381 Y385	I366-D370 PolarHBondContact N-OD2 3.24Å; I366-D370 VanDerWaalsContact N-OD2 3.08Å; K367-D370 PolarHBondContact N-OD2 3.16Å; K367-D370 WeakPolarHBondContact O-CB 3.38Å; K367-D370 PolarHBondContact O-N 2.67Å; D370-K372 PolarHBondContact O-N 3.46Å; D370-L373 HydrophobicContact CB-CD1 4Å; D370-L373 WeakPolarHBondContact O-CB 3.34Å; D370-L373 VanDerWaalsContact O-CG 3.32Å; D370-L373 WeakPolarHBondContact O-CG 3.27Å; D370-L373 PolarHBondContact O-N 2.96Å; D370-L381 HydrophobicContact CB-CD1 4.13Å; D370-Y385 PolarHBondContact OD1-OH 2.9Å; D370-Y385 PolarHBondContact OD2-OH 3.3Å
371	K	89.4	Confident	90.7	Very high	82 Å²	82	43.6 Å²	43.6	36%	0.357	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-53	-29.2	173.4	-68.5	-178.4	178.3	178.7	0	113.1	Y365 S368 Y369 L373 K374	Y365-K371 HydrophobicContact CD1-CD 4.37Å; Y365-K371 HydrophobicContact CD1-CG 3.73Å; Y365-K371 HydrophobicContact CD2-CG 4.07Å; Y365-K371 HydrophobicContact CE1-CD 4.37Å; Y365-K371 HydrophobicContact CE1-CG 4.21Å; Y365-K371 HydrophobicContact CE2-CD 4.5Å; Y365-K371 HydrophobicContact CE2-CG 4.49Å; Y365-K371 HydrophobicContact CG-CD 4.47Å; Y365-K371 HydrophobicContact CG-CG 3.66Å; Y365-K371 WeakPolarHBondContact OH-CE 3.38Å; Y365-K371 PolarHBondContact OH-NZ 3.45Å; S368-K371 WeakPolarHBondContact O-CB 3.41Å; S368-K371 WeakPolarHBondContact O-CG 3.35Å; Y369-K371 PolarHBondContact O-N 2.8Å; Y369-K371 VanDerWaalsContact O-N 3.13Å; K371-L373 PolarHBondContact O-N 2.96Å; K371-K374 PolarHBondContact O-N 3.01Å
372	K	88.7	Confident	91.3	Very high	182 Å²	182	39.5 Å²	39.5	79%	0.791	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-70.8	-19.3	178.3	-65	-177.5	178.1	-179.5	0	112.9	Y369 D370 K374	Y369-K372 WeakPolarHBondContact O-CB 3.45Å; Y369-K372 PolarHBondContact O-N 3.2Å; D370-K372 PolarHBondContact O-N 3.46Å; K372-K374 VanDerWaalsContact C-N 3.28Å
373	L	89.1	Confident	91.6	Very high	43 Å²	43	37.7 Å²	37.7	23%	0.225	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-75.5	-20.1	178.3	-53	170.9	0	0	0	112.2	D370 K371 Y375 Y384	D370-L373 HydrophobicContact CB-CD1 4Å; D370-L373 WeakPolarHBondContact O-CB 3.34Å; D370-L373 VanDerWaalsContact O-CG 3.32Å; D370-L373 WeakPolarHBondContact O-CG 3.27Å; D370-L373 PolarHBondContact O-N 2.96Å; K371-L373 PolarHBondContact O-N 2.96Å; L373-Y375 VanDerWaalsContact C-N 3.25Å; L373-Y375 HydrophobicContact CB-CD2 3.67Å; L373-Y375 HydrophobicContact CB-CE2 3.46Å; L373-Y375 VanDerWaalsContact CB-CE2 3.46Å; L373-Y375 HydrophobicContact CB-CG 4.27Å; L373-Y375 HydrophobicContact CD1-CD2 4.1Å; L373-Y375 HydrophobicContact CD1-CE2 3.6Å; L373-Y375 HydrophobicContact CG-CE2 4.04Å; L373-Y375 PolarHBondContact O-N 2.81Å; L373-Y384 HydrophobicContact CD1-CD1 3.61Å; L373-Y384 HydrophobicContact CD1-CD2 4.11Å; L373-Y384 HydrophobicContact CD1-CE1 3.41Å; L373-Y384 VanDerWaalsContact CD1-CE1 3.41Å; L373-Y384 HydrophobicContact CD1-CE2 3.98Å; L373-Y384 HydrophobicContact CD1-CG 3.98Å; L373-Y384 HydrophobicContact CD2-CE2 4.03Å
374	K	89.2	Confident	91.6	Very high	113 Å²	113	37.2 Å²	37.2	49%	0.491	17%	0.174	S	C	.	.			trans	57.5	32.4	176.4	-54.2	-176.5	178.9	-178.8	0	114.2	N285 Y363 K371 K372	N285-K374 PolarHBondContact ND2-O 3.08Å; Y363-K374 HydrophobicContact CD1-CB 4.11Å; Y363-K374 HydrophobicContact CD2-CB 4.29Å; Y363-K374 HydrophobicContact CD2-CG 4.22Å; Y363-K374 HydrophobicContact CE1-CB 3.8Å; Y363-K374 HydrophobicContact CE1-CG 4.38Å; Y363-K374 HydrophobicContact CE2-CB 3.97Å; Y363-K374 HydrophobicContact CE2-CD 4.28Å; Y363-K374 HydrophobicContact CE2-CG 3.69Å; Y363-K374 HydrophobicContact CG-CB 4.37Å; K371-K374 PolarHBondContact O-N 3.01Å; K372-K374 VanDerWaalsContact C-N 3.28Å
375	Y	91.9	Very high	91.5	Very high	8 Å²	8	37.2 Å²	37.2	3%	0.031	17%	0.174	C	C	.	.			trans	-72.2	130.2	174.5	-62.9	-43.1	0	0	0	110.9	L291 Y363 F364 L373 D380 L381 Y384	L291-Y375 HydrophobicContact CD1-CE1 3.92Å; L291-Y375 HydrophobicContact CD1-CE2 4.4Å; L291-Y375 WeakPolarHBondContact CD1-OH 3.49Å; Y363-Y375 CarbonylContact C-O 3.5Å; Y363-Y375 WeakPolarHBondContact CA-O 3.43Å; F364-Y375 PolarHBondContact N-O 2.9Å; L373-Y375 VanDerWaalsContact C-N 3.25Å; L373-Y375 HydrophobicContact CB-CD2 3.67Å; L373-Y375 HydrophobicContact CB-CE2 3.46Å; L373-Y375 VanDerWaalsContact CB-CE2 3.46Å; L373-Y375 HydrophobicContact CB-CG 4.27Å; L373-Y375 HydrophobicContact CD1-CD2 4.1Å; L373-Y375 HydrophobicContact CD1-CE2 3.6Å; L373-Y375 HydrophobicContact CG-CE2 4.04Å; L373-Y375 PolarHBondContact O-N 2.81Å; Y375-D380 HydrophobicContact CD1-CB 3.56Å; Y375-D380 HydrophobicContact CD2-CB 4.32Å; Y375-D380 HydrophobicContact CE1-CB 4.24Å; Y375-D380 HydrophobicContact CG-CB 3.64Å; Y375-L381 HydrophobicContact CD2-CB 4.42Å; Y375-L381 HydrophobicContact CD2-CD1 4.2Å; Y375-Y384 HydrophobicContact CE2-CD1 4.38Å; Y375-Y384 HydrophobicContact CE2-CD2 4.06Å; Y375-Y384 AromaticContact CE2-CG 3.74Å; Y375-Y384 HydrophobicContact CE2-CG 3.74Å
376	T	90.7	Very high	91.3	Very high	13 Å²	13	38 Å²	38	8%	0.08	18%	0.18	C	C	.	.			trans	-104.9	3.6	-177.5	51.5	0	0	0	0	113.1	L210 H224 Y363 F364	L210-T376 HydrophobicContact CD2-CG2 4.46Å; H224-T376 PolarHBondContact N-O 2.78Å; H224-T376 WeakPolarHBondContact O-CB 3.41Å; H224-T376 PolarHBondContact O-OG1 3.49Å; Y363-T376 HydrophobicContact CD1-CG2 3.8Å; Y363-T376 HydrophobicContact CE1-CG2 3.98Å; F364-T376 VanDerWaalsContact CD2-C 3.46Å; F364-T376 WeakPolarHBondContact CD2-O 3.32Å; F364-T376 WeakPolarHBondContact CE2-O 3.46Å
377	T	93.1	Very high	91.1	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.2	C	C	.	.	S	Bend	trans	-131.4	152.8	175.4	69.8	0	0	0	0	110.3	L213 E223 P297 E379 D380	L213-T377 HydrophobicContact CD1-CG2 3.84Å; E223-T377 HydrophobicContact CB-CG2 4.37Å; E223-T377 VanDerWaalsContact OE1-CA 3.22Å; E223-T377 WeakPolarHBondContact OE1-CA 3.49Å; E223-T377 WeakPolarHBondContact OE1-CB 3.43Å; P297-T377 HydrophobicContact CB-CG2 3.87Å; P297-T377 HydrophobicContact CG-CG2 4Å; T377-E379 VanDerWaalsContact C-N 3.32Å; T377-D380 WeakPolarHBondContact OG1-CB 3.36Å; T377-D380 VanDerWaalsContact OG1-CG 3.25Å; T377-D380 PolarHBondContact OG1-N 3.41Å; T377-D380 PolarHBondContact OG1-OD2 3.01Å
378	A	94.2	Very high	91.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-67.7	-34.4	172.7	0	0	0	0	0	111.2	E223 L300 L336 D380 L381 V382	E223-A378 PolarHBondContact OE1-N 3.02Å; L300-A378 HydrophobicContact CD1-CB 4.35Å; L336-A378 HydrophobicContact CD2-CB 4.22Å; A378-D380 PolarHBondContact O-N 2.88Å; A378-L381 PolarHBondContact O-N 3.46Å; A378-V382 WeakPolarHBondContact O-CG2 3.41Å; A378-V382 PolarHBondContact O-N 2.8Å
379	E	93.3	Very high	91.2	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-57.4	-48.5	176.7	-168.3	-169.4	-165	0	0	111.7	R237 P297 R298 L303 T377 L381 V382 L383	R237-E379 IonicContact CZ-OE1 2.67Å; R237-E379 IonicContact NH1-OE1 2.82Å; R237-E379 PolarHBondContact NH1-OE1 3.34Å; R237-E379 IonicContact NH1-OE2 3.06Å; R237-E379 IonicContact NH2-OE1 3.17Å; P297-E379 WeakPolarHBondContact CA-OE2 3.4Å; P297-E379 WeakPolarHBondContact CB-OE2 3.35Å; R298-E379 IonicContact CZ-OE1 3.72Å; R298-E379 PolarHBondContact N-OE2 2.75Å; R298-E379 IonicContact NE-OE1 2.57Å; R298-E379 PolarHBondContact NE-OE1 2.78Å; R298-E379 IonicContact NH2-OE1 2.61Å; R298-E379 PolarHBondContact NH2-OE1 2.89Å; L303-E379 HydrophobicContact CD2-CB 3.95Å; L303-E379 HydrophobicContact CD2-CG 3.86Å; T377-E379 VanDerWaalsContact C-N 3.32Å; E379-L381 VanDerWaalsContact C-N 3.29Å; E379-L381 PolarHBondContact O-N 3.49Å; E379-V382 PolarHBondContact O-N 3.39Å; E379-L383 HydrophobicContact CG-CD1 3.89Å; E379-L383 HydrophobicContact CG-CG 4.24Å; E379-L383 WeakPolarHBondContact O-CB 3.44Å; E379-L383 WeakPolarHBondContact O-CG 3.27Å; E379-L383 PolarHBondContact O-N 2.68Å
380	D	92.7	Very high	91.3	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.021	20%	0.197	C	C	.	.	H	α-helix	trans	-61.5	-41	-178.6	-77.7	-14.3	0	0	0	112.3	R292 Y375 T377 A378 L383 Y384	R292-D380 VanDerWaalsContact CD-OD1 3.24Å; R292-D380 WeakPolarHBondContact CD-OD1 3.13Å; R292-D380 WeakPolarHBondContact CG-OD1 3.42Å; R292-D380 IonicContact CZ-OD1 3.35Å; R292-D380 VanDerWaalsContact CZ-OD1 3.32Å; R292-D380 IonicContact CZ-OD2 3.18Å; R292-D380 IonicContact NE-OD1 3.57Å; R292-D380 IonicContact NH1-OD1 2.78Å; R292-D380 PolarHBondContact NH1-OD1 2.89Å; R292-D380 IonicContact NH1-OD2 3.31Å; R292-D380 PolarHBondContact NH1-OD2 2.98Å; Y375-D380 HydrophobicContact CD1-CB 3.56Å; Y375-D380 HydrophobicContact CD2-CB 4.32Å; Y375-D380 HydrophobicContact CE1-CB 4.24Å; Y375-D380 HydrophobicContact CG-CB 3.64Å; T377-D380 WeakPolarHBondContact OG1-CB 3.36Å; T377-D380 VanDerWaalsContact OG1-CG 3.25Å; T377-D380 PolarHBondContact OG1-N 3.41Å; T377-D380 PolarHBondContact OG1-OD2 3.01Å; A378-D380 PolarHBondContact O-N 2.88Å; D380-L383 PolarHBondContact O-N 3.26Å; D380-Y384 WeakPolarHBondContact O-CB 3.38Å; D380-Y384 PolarHBondContact O-N 3.07Å
381	L	94.4	Very high	91.1	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.8	-46.6	177.1	-175.3	66.2	0	0	0	110.7	I355 F364 I366 D370 Y375 A378 E379 Y384 Y385	I355-L381 HydrophobicContact CG2-CD2 3.75Å; F364-L381 HydrophobicContact CB-CD2 4.2Å; I366-L381 HydrophobicContact CD1-CD2 4.23Å; I366-L381 HydrophobicContact CG1-CD2 4Å; D370-L381 HydrophobicContact CB-CD1 4.13Å; Y375-L381 HydrophobicContact CD2-CB 4.42Å; Y375-L381 HydrophobicContact CD2-CD1 4.2Å; A378-L381 PolarHBondContact O-N 3.46Å; E379-L381 VanDerWaalsContact C-N 3.29Å; E379-L381 PolarHBondContact O-N 3.49Å; L381-Y384 WeakPolarHBondContact O-CB 3.45Å; L381-Y384 PolarHBondContact O-N 3.42Å; L381-Y385 HydrophobicContact CD1-CD2 4.22Å; L381-Y385 HydrophobicContact CD1-CE2 3.85Å; L381-Y385 HydrophobicContact CG-CD2 4.4Å; L381-Y385 HydrophobicContact CG-CE2 4.32Å; L381-Y385 VanDerWaalsContact O-CD2 3.3Å; L381-Y385 WeakPolarHBondContact O-CD2 3.18Å; L381-Y385 PolarHBondContact O-N 3.16Å; L381-Y385 VanDerWaalsContact O-N 3.12Å
382	V	93.8	Very high	90.9	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.006	20%	0.196	C	C	.	.	H	α-helix	trans	-63.8	-43.7	178.2	170.9	0	0	0	0	111.3	Y305 F325 L327 A378 E379 Y384 Y385 L386	Y305-V382 HydrophobicContact CE2-CG1 4.05Å; Y305-V382 HydrophobicContact CE2-CG2 4.44Å; F325-V382 HydrophobicContact CE2-CG1 3.64Å; F325-V382 HydrophobicContact CZ-CG1 4.03Å; L327-V382 HydrophobicContact CD1-CG2 4.17Å; L327-V382 HydrophobicContact CD2-CG2 4.21Å; A378-V382 WeakPolarHBondContact O-CG2 3.41Å; A378-V382 PolarHBondContact O-N 2.8Å; E379-V382 PolarHBondContact O-N 3.39Å; V382-Y384 VanDerWaalsContact C-N 3.3Å; V382-Y384 PolarHBondContact O-N 2.58Å; V382-Y385 PolarHBondContact O-N 3.43Å; V382-L386 HydrophobicContact CG1-CD1 3.86Å; V382-L386 HydrophobicContact CG1-CG 4.48Å; V382-L386 WeakPolarHBondContact O-CG 3.41Å; V382-L386 PolarHBondContact O-N 3.05Å
383	L	91.3	Very high	90.2	Very high	32 Å²	32	33.9 Å²	33.9	17%	0.168	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-36.4	176.6	-74.1	175.6	0	0	0	112.3	R292 E379 D380 L386 T387	R292-L383 HydrophobicContact CG-CD1 3.66Å; E379-L383 HydrophobicContact CG-CD1 3.89Å; E379-L383 HydrophobicContact CG-CG 4.24Å; E379-L383 WeakPolarHBondContact O-CB 3.44Å; E379-L383 WeakPolarHBondContact O-CG 3.27Å; E379-L383 PolarHBondContact O-N 2.68Å; D380-L383 PolarHBondContact O-N 3.26Å; L383-L386 HydrophobicContact CD2-CD1 4.46Å; L383-L386 PolarHBondContact O-N 3.17Å; L383-T387 WeakPolarHBondContact O-CB 3.03Å; L383-T387 PolarHBondContact O-N 3.13Å; L383-T387 PolarHBondContact O-OG1 3.28Å
384	Y	92.5	Very high	89	Confident	37 Å²	37	31.8 Å²	31.8	15%	0.145	16%	0.161	C	C	.	.	H	α-helix	trans	-60.7	-47.4	172.7	169.2	-99.7	0	0	0	111.5	L373 Y375 D380 L381 V382 L386 Y388 I390	L373-Y384 HydrophobicContact CD1-CD1 3.61Å; L373-Y384 HydrophobicContact CD1-CD2 4.11Å; L373-Y384 HydrophobicContact CD1-CE1 3.41Å; L373-Y384 VanDerWaalsContact CD1-CE1 3.41Å; L373-Y384 HydrophobicContact CD1-CE2 3.98Å; L373-Y384 HydrophobicContact CD1-CG 3.98Å; L373-Y384 HydrophobicContact CD2-CE2 4.03Å; Y375-Y384 HydrophobicContact CE2-CD1 4.38Å; Y375-Y384 HydrophobicContact CE2-CD2 4.06Å; Y375-Y384 AromaticContact CE2-CG 3.74Å; Y375-Y384 HydrophobicContact CE2-CG 3.74Å; D380-Y384 WeakPolarHBondContact O-CB 3.38Å; D380-Y384 PolarHBondContact O-N 3.07Å; L381-Y384 WeakPolarHBondContact O-CB 3.45Å; L381-Y384 PolarHBondContact O-N 3.42Å; V382-Y384 VanDerWaalsContact C-N 3.3Å; V382-Y384 PolarHBondContact O-N 2.58Å; Y384-L386 PolarHBondContact O-N 3.28Å; Y384-Y388 AromaticContact CD2-CD2 3.33Å; Y384-Y388 HydrophobicContact CD2-CD2 3.33Å; Y384-Y388 AromaticContact CD2-CE2 3.58Å; Y384-Y388 HydrophobicContact CD2-CE2 3.58Å; Y384-Y388 AromaticContact CE2-CD2 3.48Å; Y384-Y388 HydrophobicContact CE2-CD2 3.48Å; Y384-Y388 VanDerWaalsContact CE2-CD2 3.48Å; Y384-Y388 AromaticContact CE2-CE2 3.88Å; Y384-Y388 HydrophobicContact CE2-CE2 3.88Å; Y384-Y388 HydrophobicContact CE2-CG 4.41Å; Y384-Y388 HydrophobicContact CG-CD2 4.19Å; Y384-Y388 WeakPolarHBondContact O-CD2 3.49Å; Y384-Y388 PolarHBondContact O-N 2.95Å; Y384-Y388 VanDerWaalsContact O-N 3.15Å; Y384-I390 HydrophobicContact CD1-CG1 4.2Å; Y384-I390 HydrophobicContact CE1-CD1 4.24Å; Y384-I390 HydrophobicContact CE1-CG1 3.67Å
385	Y	93.4	Very high	87.8	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.7	-40.2	178.3	-86.8	-108	0	0	0	112.3	I366 D370 L381 V382 S389 I390 L392 F409	I366-Y385 HydrophobicContact CD1-CD2 4.42Å; I366-Y385 HydrophobicContact CD1-CE1 4.3Å; I366-Y385 HydrophobicContact CD1-CE2 4.03Å; D370-Y385 PolarHBondContact OD1-OH 2.9Å; D370-Y385 PolarHBondContact OD2-OH 3.3Å; L381-Y385 HydrophobicContact CD1-CD2 4.22Å; L381-Y385 HydrophobicContact CD1-CE2 3.85Å; L381-Y385 HydrophobicContact CG-CD2 4.4Å; L381-Y385 HydrophobicContact CG-CE2 4.32Å; L381-Y385 VanDerWaalsContact O-CD2 3.3Å; L381-Y385 WeakPolarHBondContact O-CD2 3.18Å; L381-Y385 PolarHBondContact O-N 3.16Å; L381-Y385 VanDerWaalsContact O-N 3.12Å; V382-Y385 PolarHBondContact O-N 3.43Å; Y385-S389 CarbonylContact O-C 3.53Å; Y385-S389 VanDerWaalsContact O-CA 3.31Å; Y385-S389 WeakPolarHBondContact O-CA 3.45Å; Y385-S389 PolarHBondContact O-N 3.49Å; Y385-S389 VanDerWaalsContact O-N 3.1Å; Y385-I390 HydrophobicContact CD1-CB 3.69Å; Y385-I390 HydrophobicContact CD1-CG2 3.83Å; Y385-I390 WeakPolarHBondContact CD1-O 3.16Å; Y385-I390 HydrophobicContact CE1-CB 4.03Å; Y385-I390 HydrophobicContact CE1-CG2 3.6Å; Y385-I390 HydrophobicContact CG-CB 4.01Å; Y385-I390 HydrophobicContact CG-CG2 4.43Å; Y385-I390 PolarHBondContact O-N 2.87Å; Y385-L392 HydrophobicContact CE1-CD1 4.27Å; Y385-F409 HydrophobicContact CD1-CE2 4.26Å; Y385-F409 HydrophobicContact CG-CE2 4.15Å
386	L	90.4	Very high	86.2	Confident	44 Å²	44	34.6 Å²	34.6	23%	0.23	18%	0.182	C	C	.	.	H	α-helix	trans	-65.5	-54.4	175.3	-77.7	164.7	0	0	0	112.4	F325 V382 L383 Y384 Y388 S389 F409	F325-L386 HydrophobicContact CE1-CD1 4.27Å; F325-L386 HydrophobicContact CE1-CD2 3.72Å; F325-L386 HydrophobicContact CE1-CG 4.34Å; F325-L386 HydrophobicContact CZ-CD1 3.84Å; F325-L386 HydrophobicContact CZ-CD2 4.15Å; F325-L386 HydrophobicContact CZ-CG 4.31Å; V382-L386 HydrophobicContact CG1-CD1 3.86Å; V382-L386 HydrophobicContact CG1-CG 4.48Å; V382-L386 WeakPolarHBondContact O-CG 3.41Å; V382-L386 PolarHBondContact O-N 3.05Å; L383-L386 HydrophobicContact CD2-CD1 4.46Å; L383-L386 PolarHBondContact O-N 3.17Å; Y384-L386 PolarHBondContact O-N 3.28Å; L386-Y388 VanDerWaalsContact C-N 3.32Å; L386-Y388 PolarHBondContact O-N 2.87Å; L386-S389 PolarHBondContact O-N 2.91Å; L386-F409 HydrophobicContact CD2-CB 3.45Å; L386-F409 VanDerWaalsContact CD2-CB 3.45Å; L386-F409 HydrophobicContact CG-CB 3.95Å; L386-F409 HydrophobicContact CG-CD2 4.46Å
387	T	88.5	Confident	84.6	Confident	79 Å²	79	40.9 Å²	40.9	49%	0.485	21%	0.208	S	C	.	.	H	α-helix	trans	-64.4	-38	-170.9	-57.6	0	0	0	0	112.1	L291 L383	L291-T387 HydrophobicContact CD2-CG2 3.96Å; L383-T387 WeakPolarHBondContact O-CB 3.03Å; L383-T387 PolarHBondContact O-N 3.13Å; L383-T387 PolarHBondContact O-OG1 3.28Å
388	Y	90.1	Very high	82.7	Confident	136 Å²	136	43.6 Å²	43.6	53%	0.533	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	10.3	-178.2	-57.8	-66.4	0	0	0	113.2	L291 Y384 L386 I390	L291-Y388 HydrophobicContact CD2-CD2 4.48Å; L291-Y388 HydrophobicContact CD2-CE2 3.71Å; Y384-Y388 AromaticContact CD2-CD2 3.33Å; Y384-Y388 HydrophobicContact CD2-CD2 3.33Å; Y384-Y388 AromaticContact CD2-CE2 3.58Å; Y384-Y388 HydrophobicContact CD2-CE2 3.58Å; Y384-Y388 AromaticContact CE2-CD2 3.48Å; Y384-Y388 HydrophobicContact CE2-CD2 3.48Å; Y384-Y388 VanDerWaalsContact CE2-CD2 3.48Å; Y384-Y388 AromaticContact CE2-CE2 3.88Å; Y384-Y388 HydrophobicContact CE2-CE2 3.88Å; Y384-Y388 HydrophobicContact CE2-CG 4.41Å; Y384-Y388 HydrophobicContact CG-CD2 4.19Å; Y384-Y388 WeakPolarHBondContact O-CD2 3.49Å; Y384-Y388 PolarHBondContact O-N 2.95Å; Y384-Y388 VanDerWaalsContact O-N 3.15Å; L386-Y388 VanDerWaalsContact C-N 3.32Å; L386-Y388 PolarHBondContact O-N 2.87Å; Y388-I390 VanDerWaalsContact C-N 3.26Å; Y388-I390 PolarHBondContact O-N 2.74Å
389	S	89.1	Confident	80.5	Confident	64 Å²	64	47.5 Å²	47.5	45%	0.448	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	45.7	178.5	-55.5	0	0	0	0	113	Y385 L386 P391	Y385-S389 CarbonylContact O-C 3.53Å; Y385-S389 VanDerWaalsContact O-CA 3.31Å; Y385-S389 WeakPolarHBondContact O-CA 3.45Å; Y385-S389 PolarHBondContact O-N 3.49Å; Y385-S389 VanDerWaalsContact O-N 3.1Å; L386-S389 PolarHBondContact O-N 2.91Å; S389-P391 WeakPolarHBondContact O-CD 3.48Å
390	I	90.6	Very high	78.6	Confident	25 Å²	25	48.8 Å²	48.8	13%	0.128	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-73.2	125.1	-175	-54.8	-62.4	0	0	0	109.3	Y384 Y385 Y388 L392	Y384-I390 HydrophobicContact CD1-CG1 4.2Å; Y384-I390 HydrophobicContact CE1-CD1 4.24Å; Y384-I390 HydrophobicContact CE1-CG1 3.67Å; Y385-I390 HydrophobicContact CD1-CB 3.69Å; Y385-I390 HydrophobicContact CD1-CG2 3.83Å; Y385-I390 WeakPolarHBondContact CD1-O 3.16Å; Y385-I390 HydrophobicContact CE1-CB 4.03Å; Y385-I390 HydrophobicContact CE1-CG2 3.6Å; Y385-I390 HydrophobicContact CG-CB 4.01Å; Y385-I390 HydrophobicContact CG-CG2 4.43Å; Y385-I390 PolarHBondContact O-N 2.87Å; Y388-I390 VanDerWaalsContact C-N 3.26Å; Y388-I390 PolarHBondContact O-N 2.74Å; I390-L392 PolarHBondContact O-N 3.07Å
391	P	87	Confident	76.7	Confident	52 Å²	52	58.2 Å²	58.2	34%	0.338	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-69	126.2	-179.6	22.7	-30.4	0	0	0	112.1	K367 S389	K367-P391 WeakPolarHBondContact CE-O 3.31Å; K367-P391 PolarHBondContact NZ-O 2.93Å; S389-P391 WeakPolarHBondContact O-CD 3.48Å
392	L	85.7	Confident	74.6	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-77.7	117.2	164.5	-162.1	70.2	0	0	0	108.8	V338 A340 V351 R353 I366 Y385 I390 G394 S406 V407 F409	V338-L392 HydrophobicContact CG1-CD1 4.49Å; V338-L392 HydrophobicContact CG1-CD2 4.29Å; A340-L392 HydrophobicContact CB-CD2 4.35Å; V351-L392 HydrophobicContact CB-CD2 4.45Å; V351-L392 HydrophobicContact CG1-CD2 3.96Å; V351-L392 HydrophobicContact CG1-CG 4.32Å; R353-L392 HydrophobicContact CB-CD1 4.08Å; R353-L392 HydrophobicContact CB-CD2 4.3Å; R353-L392 HydrophobicContact CG-CD1 3.74Å; R353-L392 HydrophobicContact CG-CD2 3.9Å; R353-L392 HydrophobicContact CG-CG 3.84Å; I366-L392 HydrophobicContact CD1-CD1 4.25Å; I366-L392 HydrophobicContact CG2-CD1 3.83Å; Y385-L392 HydrophobicContact CE1-CD1 4.27Å; I390-L392 PolarHBondContact O-N 3.07Å; L392-G394 PolarHBondContact O-N 3.03Å; L392-S406 WeakPolarHBondContact O-CA 3.27Å; L392-V407 WeakPolarHBondContact CB-O 3.43Å; L392-V407 PolarHBondContact N-O 3.35Å; L392-V407 PolarHBondContact O-N 3.23Å; L392-F409 HydrophobicContact CB-CE1 4.28Å; L392-F409 HydrophobicContact CD1-CZ 4.45Å; L392-F409 HydrophobicContact CD2-CE1 3.95Å; L392-F409 HydrophobicContact CD2-CZ 4.2Å
393	E	73.6	Confident	72.8	Confident	59 Å²	59	70.1 Å²	70.1	28%	0.276	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-62.3	126.3	174.2	-86	166.6	-130.1	0	0	109.5	V351 R353 K367 E400	V351-E393 WeakPolarHBondContact CG1-O 3.25Å; R353-E393 PolarHBondContact NE-O 2.82Å; R353-E393 PolarHBondContact NH2-O 2.61Å; K367-E393 VanDerWaalsContact CE-OE1 3.32Å; K367-E393 WeakPolarHBondContact CE-OE1 3.12Å; K367-E393 IonicContact NZ-OE1 2.71Å; K367-E393 PolarHBondContact NZ-OE1 3.03Å; E393-E400 WeakPolarHBondContact CA-OE1 3.29Å; E393-E400 WeakPolarHBondContact CB-OE1 3.33Å
394	G	63.8	Low	71.2	Confident	0 Å²	0	74 Å²	74	0%	0	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-68.3	165.9	174.8	0	0	0	0	0	115.6	R353 L392 D396 E400	R353-G394 PolarHBondContact NH2-O 2.86Å; L392-G394 PolarHBondContact O-N 3.03Å; G394-D396 PolarHBondContact O-N 3.29Å; G394-E400 WeakPolarHBondContact CA-OE1 3.18Å; G394-E400 PolarHBondContact N-OE1 2.87Å
395	N	62.7	Low	69.9	Low	97 Å²	97	73.2 Å²	73.2	52%	0.519	37%	0.365	S	S	.	.	S	Bend	trans	-55.2	-27.1	-160.3	-65.3	-29.6	0	0	0	116.3	K350 R353	K350-N395 PolarHBondContact O-ND2 3.15Å; R353-N395 PolarHBondContact NH1-OD1 3Å
396	D	59.2	Low	69.1	Low	83 Å²	83	74.6 Å²	74.6	44%	0.444	38%	0.375	S	S	.	.			trans	-126.4	115.8	177.2	-176.3	-4.5	0	0	0	112.1	G394 A398 L399 E400	G394-D396 PolarHBondContact O-N 3.29Å; D396-A398 PolarHBondContact O-N 3.08Å; D396-A398 VanDerWaalsContact O-N 3.16Å; D396-A398 WeakPolarHBondContact OD1-CB 3.49Å; D396-A398 PolarHBondContact OD1-N 3.42Å; D396-L399 HydrophobicContact CB-CB 3.93Å; D396-L399 PolarHBondContact O-N 3.18Å; D396-L399 VanDerWaalsContact O-N 3.07Å; D396-E400 WeakPolarHBondContact O-CG 3.18Å; D396-E400 PolarHBondContact O-N 3.01Å
397	K	57.9	Low	68.8	Low	144 Å²	144	72.5 Å²	72.5	63%	0.626	36%	0.364	S	S	*	.	H	α-helix	trans	-56	-30.8	175.8	-71.3	-172	174.2	-174.1	0	113.6
398	A	52.7	Low	68.9	Low	57 Å²	57	71.9 Å²	71.9	47%	0.471	36%	0.357	S	S	.	.	H	α-helix	trans	-75	-35.7	179.7	0	0	0	0	0	111.7	D396	D396-A398 PolarHBondContact O-N 3.08Å; D396-A398 VanDerWaalsContact O-N 3.16Å; D396-A398 WeakPolarHBondContact OD1-CB 3.49Å; D396-A398 PolarHBondContact OD1-N 3.42Å
399	L	48.3	Very low	68.8	Low	82 Å²	82	65.6 Å²	65.6	43%	0.429	33%	0.332	S	S	.	.	H	α-helix	trans	-72.1	-44.6	175.5	-148.5	76.6	0	0	0	110.4	D396 K401 R402 T403 E405	D396-L399 HydrophobicContact CB-CB 3.93Å; D396-L399 PolarHBondContact O-N 3.18Å; D396-L399 VanDerWaalsContact O-N 3.07Å; L399-K401 PolarHBondContact O-N 3.43Å; L399-R402 WeakPolarHBondContact O-CA 3.3Å; L399-R402 WeakPolarHBondContact O-CB 3.25Å; L399-R402 PolarHBondContact O-N 3.26Å; L399-T403 HydrophobicContact CG-CG2 4.42Å; L399-T403 PolarHBondContact O-N 3.5Å; L399-T403 PolarHBondContact O-OG1 2.89Å; L399-E405 WeakPolarHBondContact CD2-OE1 3.37Å
400	E	52.2	Low	68.8	Low	29 Å²	29	67.6 Å²	67.6	14%	0.136	34%	0.338	C	S	.	.	H	α-helix	trans	-52	-46.5	178.3	-78	174.2	179.3	0	0	114.5	E393 G394 D396 R402 T403 N404	E393-E400 WeakPolarHBondContact CA-OE1 3.29Å; E393-E400 WeakPolarHBondContact CB-OE1 3.33Å; G394-E400 WeakPolarHBondContact CA-OE1 3.18Å; G394-E400 PolarHBondContact N-OE1 2.87Å; D396-E400 WeakPolarHBondContact O-CG 3.18Å; D396-E400 PolarHBondContact O-N 3.01Å; E400-R402 PolarHBondContact O-N 2.75Å; E400-R402 VanDerWaalsContact O-N 3.08Å; E400-T403 PolarHBondContact O-N 2.89Å; E400-N404 PolarHBondContact O-N 2.87Å
401	K	53.9	Low	68.6	Low	201 Å²	201	70.4 Å²	70.4	87%	0.874	35%	0.351	S	S	*	.	H	α-helix	trans	-59.4	-22.6	179.8	-81.7	-171.2	178.6	-177.6	0	112.1	L399	L399-K401 PolarHBondContact O-N 3.43Å
402	R	50.8	Low	68.8	Low	217 Å²	217	70 Å²	70	82%	0.819	35%	0.348	S	S	*	.	H	α-helix	trans	-95.2	-36	179	-58.8	-176.3	-168.4	-174.6	3.5	112.3	L399 E400	L399-R402 WeakPolarHBondContact O-CA 3.3Å; L399-R402 WeakPolarHBondContact O-CB 3.25Å; L399-R402 PolarHBondContact O-N 3.26Å; E400-R402 PolarHBondContact O-N 2.75Å; E400-R402 VanDerWaalsContact O-N 3.08Å
403	T	54.5	Low	69	Low	35 Å²	35	70.6 Å²	70.6	22%	0.215	35%	0.351	C	S	.	.	H	α-helix	trans	-107.2	-11.8	-167.5	56.2	0	0	0	0	114.4	F344 L399 E400 E405	F344-T403 WeakPolarHBondContact CE1-O 3.46Å; F344-T403 WeakPolarHBondContact CZ-O 3.29Å; L399-T403 HydrophobicContact CG-CG2 4.42Å; L399-T403 PolarHBondContact O-N 3.5Å; L399-T403 PolarHBondContact O-OG1 2.89Å; E400-T403 PolarHBondContact O-N 2.89Å; T403-E405 WeakPolarHBondContact CB-OE1 3.21Å; T403-E405 VanDerWaalsContact CG2-OE1 3.28Å; T403-E405 WeakPolarHBondContact CG2-OE1 3.32Å; T403-E405 PolarHBondContact O-N 3.45Å; T403-E405 WeakPolarHBondContact OG1-CG 3.11Å; T403-E405 PolarHBondContact OG1-OE1 3.26Å
404	N	58.6	Low	69.5	Low	112 Å²	112	68.2 Å²	68.2	60%	0.599	34%	0.341	S	S	*	.			trans	52.5	38.6	-173.5	-162.3	24.5	0	0	0	112.4	K342 E400 S406	K342-N404 PolarHBondContact NZ-O 2.83Å; E400-N404 PolarHBondContact O-N 2.87Å; N404-S406 PolarHBondContact O-N 2.91Å
405	E	64.3	Low	70.5	Confident	22 Å²	22	68.9 Å²	68.9	10%	0.103	35%	0.345	C	S	.	.			trans	-65.4	7.1	-178.1	-92.6	163.6	-139.1	0	0	115.3	T349 L399 T403 V407	T349-E405 HydrophobicContact CG2-CG 4.47Å; L399-E405 WeakPolarHBondContact CD2-OE1 3.37Å; T403-E405 WeakPolarHBondContact CB-OE1 3.21Å; T403-E405 VanDerWaalsContact CG2-OE1 3.28Å; T403-E405 WeakPolarHBondContact CG2-OE1 3.32Å; T403-E405 PolarHBondContact O-N 3.45Å; T403-E405 WeakPolarHBondContact OG1-CG 3.11Å; T403-E405 PolarHBondContact OG1-OE1 3.26Å; E405-V407 PolarHBondContact O-N 3.29Å
406	S	76.5	Confident	71.1	Confident	28 Å²	28	69 Å²	69	20%	0.196	35%	0.345	C	S	.	.			trans	-62.2	131.2	-177.7	59.8	0	0	0	0	112.7	K342 L392 N404	K342-S406 WeakPolarHBondContact CD-O 3.2Å; K342-S406 WeakPolarHBondContact CE-O 3.35Å; K342-S406 PolarHBondContact NZ-O 3.05Å; L392-S406 WeakPolarHBondContact O-CA 3.27Å; N404-S406 PolarHBondContact O-N 2.91Å
407	V	85.4	Confident	71.9	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.006	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-99.8	131.6	180	-170	0	0	0	0	109.4	A340 C341 K342 V351 L392 E405	A340-V407 HydrophobicContact CB-CB 4.27Å; A340-V407 HydrophobicContact CB-CG1 3.68Å; C341-V407 WeakPolarHBondContact O-CG1 3.38Å; K342-V407 HydrophobicContact CB-CB 4.39Å; K342-V407 HydrophobicContact CB-CG1 4.18Å; K342-V407 HydrophobicContact CB-CG2 3.67Å; K342-V407 HydrophobicContact CD-CG2 4.34Å; V351-V407 HydrophobicContact CB-CG2 4.36Å; V351-V407 HydrophobicContact CG2-CG2 3.78Å; L392-V407 WeakPolarHBondContact CB-O 3.43Å; L392-V407 PolarHBondContact N-O 3.35Å; L392-V407 PolarHBondContact O-N 3.23Å; E405-V407 PolarHBondContact O-N 3.29Å
408	I	89	Confident	72.7	Confident	66 Å²	66	65.9 Å²	65.9	34%	0.338	33%	0.331	S	S	.	.			trans	-105.7	134.1	173.8	-65.4	173.2	0	0	0	107.5	G323 N410	G323-I408 WeakPolarHBondContact CA-O 3.34Å; I408-N410 PolarHBondContact O-N 2.87Å
409	F	90	Very high	73.7	Confident	3 Å²	3	63.3 Å²	63.3	1%	0.013	31%	0.309	C	S	.	.			trans	-70	128.2	176.1	-59.9	-14.8	0	0	0	109.9	F325 V338 A340 Y385 L386 L392	F325-F409 HydrophobicContact CB-CD1 3.81Å; F325-F409 HydrophobicContact CB-CE1 4.08Å; F325-F409 HydrophobicContact CB-CG 4.26Å; F325-F409 HydrophobicContact CD1-CB 3.72Å; F325-F409 HydrophobicContact CD1-CD1 4.29Å; F325-F409 AromaticContact CD1-CG 3.95Å; F325-F409 HydrophobicContact CD1-CG 3.95Å; F325-F409 HydrophobicContact CD2-CD2 4.41Å; F325-F409 HydrophobicContact CD2-CG 4.49Å; F325-F409 HydrophobicContact CE1-CB 4.03Å; F325-F409 HydrophobicContact CE1-CG 4.49Å; F325-F409 HydrophobicContact CG-CB 4.25Å; F325-F409 HydrophobicContact CG-CD1 4.04Å; F325-F409 HydrophobicContact CG-CD2 4.32Å; F325-F409 AromaticContact CG-CG 3.95Å; F325-F409 HydrophobicContact CG-CG 3.95Å; V338-F409 HydrophobicContact CG1-CZ 4.31Å; V338-F409 HydrophobicContact CG2-CE1 4.06Å; V338-F409 HydrophobicContact CG2-CE2 4.15Å; V338-F409 HydrophobicContact CG2-CZ 3.48Å; V338-F409 VanDerWaalsContact CG2-CZ 3.48Å; A340-F409 HydrophobicContact CB-CD1 4.13Å; A340-F409 HydrophobicContact CB-CE1 3.8Å; Y385-F409 HydrophobicContact CD1-CE2 4.26Å; Y385-F409 HydrophobicContact CG-CE2 4.15Å; L386-F409 HydrophobicContact CD2-CB 3.45Å; L386-F409 VanDerWaalsContact CD2-CB 3.45Å; L386-F409 HydrophobicContact CG-CB 3.95Å; L386-F409 HydrophobicContact CG-CD2 4.46Å; L392-F409 HydrophobicContact CB-CE1 4.28Å; L392-F409 HydrophobicContact CD1-CZ 4.45Å; L392-F409 HydrophobicContact CD2-CE1 3.95Å; L392-F409 HydrophobicContact CD2-CZ 4.2Å
410	N	87.5	Confident	75.1	Confident	107 Å²	107	63.9 Å²	63.9	57%	0.572	31%	0.306	S	S	*	.			trans	-121.4	-52.3	175.9	-68.1	-24.3	0	0	0	110.6	G323 I408	G323-N410 PolarHBondContact O-N 3.48Å; I408-N410 PolarHBondContact O-N 2.87Å
411	E	87.9	Confident	76.6	Confident	83 Å²	83	63.3 Å²	63.3	39%	0.388	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	125.9	-170.9	-168.4	-166.4	179	0	0	111.8	G323 Q324 F325	G323-E411 PolarHBondContact O-N 3.44Å; Q324-E411 VanDerWaalsContact CA-O 3.24Å; Q324-E411 WeakPolarHBondContact CA-O 3.36Å; Q324-E411 HydrophobicContact CG-CB 4.38Å; Q324-E411 PolarHBondContact NE2-OE2 3.48Å; F325-E411 VanDerWaalsContact CD1-O 3.28Å; F325-E411 WeakPolarHBondContact CD1-O 3.44Å; F325-E411 VanDerWaalsContact CE1-C 3.43Å; F325-E411 PolarHBondContact N-O 2.61Å; F325-E411 VanDerWaalsContact N-O 3.07Å
412	P	90.1	Very high	77.9	Confident	43 Å²	43	53.9 Å²	53.9	28%	0.279	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	132.8	173.3	24.3	-28.9	0	0	0	112.2	Y305 F325 V414	Y305-P412 HydrophobicContact CD1-CB 3.53Å; Y305-P412 HydrophobicContact CD1-CG 4.29Å; Y305-P412 HydrophobicContact CE1-CB 4.46Å; Y305-P412 HydrophobicContact CG-CB 3.84Å; F325-P412 HydrophobicContact CE1-CB 3.91Å; F325-P412 HydrophobicContact CE1-CG 4.44Å; F325-P412 VanDerWaalsContact CE1-N 3.3Å; F325-P412 HydrophobicContact CE2-CB 4.23Å; F325-P412 HydrophobicContact CZ-CB 3.61Å; F325-P412 HydrophobicContact CZ-CG 4.3Å; P412-V414 PolarHBondContact O-N 3.06Å; P412-V414 VanDerWaalsContact O-N 3.16Å
413	V	90	Very high	79.7	Confident	13 Å²	13	45.1 Å²	45.1	8%	0.079	23%	0.232	C	C	.	.			trans	-78	102.2	166.2	-175	0	0	0	0	108.9	H307 L318 L319 Q324 F325 L326	H307-V413 PolarHBondContact NE2-O 2.83Å; L318-V413 HydrophobicContact CB-CG1 4.26Å; L319-V413 HydrophobicContact CD2-CG2 3.94Å; Q324-V413 HydrophobicContact CB-CG2 3.83Å; Q324-V413 HydrophobicContact CG-CG2 4.23Å; F325-V413 PolarHBondContact O-N 2.57Å; L326-V413 HydrophobicContact CB-CB 4.2Å; L326-V413 HydrophobicContact CD2-CB 4.26Å; L326-V413 HydrophobicContact CD2-CG1 4.49Å
414	V	84.6	Confident	81.4	Confident	10 Å²	10	44.9 Å²	44.9	6%	0.061	23%	0.229	C	C	.	.			trans	-64.5	132.4	178.3	179.9	0	0	0	0	111.3	L14 A17 P304 P412 L416	L14-V414 HydrophobicContact CD1-CG1 3.51Å; A17-V414 HydrophobicContact CB-CG2 3.84Å; P304-V414 HydrophobicContact CB-CG1 4.5Å; P304-V414 CarbonylContact O-C 3.57Å; P304-V414 WeakPolarHBondContact O-CA 3.26Å; P412-V414 PolarHBondContact O-N 3.06Å; P412-V414 VanDerWaalsContact O-N 3.16Å; V414-L416 PolarHBondContact O-N 2.99Å; V414-L416 VanDerWaalsContact O-N 3.08Å
415	N	85.1	Confident	82.9	Confident	14 Å²	14	41.2 Å²	41.2	8%	0.075	21%	0.208	C	C	.	.			trans	-70.6	98.1	175	-177.7	-4.2	0	0	0	111	P304 Y306 H307 Q417 L418	P304-N415 PolarHBondContact O-N 2.83Å; Y306-N415 PolarHBondContact O-ND2 3.29Å; H307-N415 WeakPolarHBondContact CA-ND2 3.5Å; H307-N415 VanDerWaalsContact CE1-CA 3.41Å; H307-N415 WeakPolarHBondContact CE1-CA 3.46Å; N415-Q417 PolarHBondContact O-N 2.88Å; N415-Q417 WeakPolarHBondContact OD1-CA 3.38Å; N415-Q417 WeakPolarHBondContact OD1-CB 3.36Å; N415-Q417 PolarHBondContact OD1-N 2.73Å; N415-L418 HydrophobicContact CB-CD1 4.15Å; N415-L418 HydrophobicContact CB-CG 4.21Å; N415-L418 WeakPolarHBondContact O-CB 3.47Å; N415-L418 PolarHBondContact O-N 2.85Å; N415-L418 VanDerWaalsContact O-N 3.11Å
416	L	75.1	Confident	83.9	Confident	100 Å²	100	46.8 Å²	46.8	52%	0.524	25%	0.246	S	C	.	.	H	α-helix	trans	-70.4	-12.6	178.4	-62.7	-179.8	0	0	0	113.5	L18 V414 L418 A419 R420	L18-L416 HydrophobicContact CD2-CD2 3.83Å; V414-L416 PolarHBondContact O-N 2.99Å; V414-L416 VanDerWaalsContact O-N 3.08Å; L416-L418 PolarHBondContact O-N 2.62Å; L416-A419 HydrophobicContact CB-CB 4.48Å; L416-A419 HydrophobicContact CD2-CB 4.23Å; L416-A419 WeakPolarHBondContact O-CA 3.38Å; L416-A419 VanDerWaalsContact O-CB 3.24Å; L416-A419 WeakPolarHBondContact O-CB 3.43Å; L416-A419 PolarHBondContact O-N 3.1Å; L416-R420 PolarHBondContact O-N 3.32Å
417	Q	75.1	Confident	84.4	Confident	121 Å²	121	47.9 Å²	47.9	57%	0.565	25%	0.252	S	S	*	.	H	α-helix	trans	-67.1	-25.7	169.6	-59.5	-61	-26.3	0	0	111.4	N415 A419 R420	N415-Q417 PolarHBondContact O-N 2.88Å; N415-Q417 WeakPolarHBondContact OD1-CA 3.38Å; N415-Q417 WeakPolarHBondContact OD1-CB 3.36Å; N415-Q417 PolarHBondContact OD1-N 2.73Å; Q417-A419 VanDerWaalsContact C-N 3.31Å; Q417-R420 VanDerWaalsContact O-CD 3.27Å; Q417-R420 WeakPolarHBondContact O-CD 3.46Å; Q417-R420 WeakPolarHBondContact O-CG 3.49Å; Q417-R420 PolarHBondContact O-NE 3.26Å
418	L	75.1	Confident	84.1	Confident	40 Å²	40	52.7 Å²	52.7	21%	0.209	29%	0.291	C	S	.	.	H	α-helix	trans	-70.7	-32.1	168.1	-59	176.3	0	0	0	111	L14 N415 L416 R420 H421	L14-L418 HydrophobicContact CD2-CB 3.82Å; N415-L418 HydrophobicContact CB-CD1 4.15Å; N415-L418 HydrophobicContact CB-CG 4.21Å; N415-L418 WeakPolarHBondContact O-CB 3.47Å; N415-L418 PolarHBondContact O-N 2.85Å; N415-L418 VanDerWaalsContact O-N 3.11Å; L416-L418 PolarHBondContact O-N 2.62Å; L418-R420 VanDerWaalsContact C-N 3.33Å; L418-R420 PolarHBondContact O-N 2.87Å; L418-H421 PolarHBondContact O-N 2.9Å
419	A	74.5	Confident	83.9	Confident	2 Å²	2	53.9 Å²	53.9	2%	0.017	30%	0.298	C	S	.	.	H	α-helix	trans	-66.5	-30.5	-178.4	0	0	0	0	0	112.9	L18 L416 Q417 H421 V422 L423	L18-A419 HydrophobicContact CD1-CB 3.95Å; L18-A419 HydrophobicContact CD2-CB 3.94Å; L416-A419 HydrophobicContact CB-CB 4.48Å; L416-A419 HydrophobicContact CD2-CB 4.23Å; L416-A419 WeakPolarHBondContact O-CA 3.38Å; L416-A419 VanDerWaalsContact O-CB 3.24Å; L416-A419 WeakPolarHBondContact O-CB 3.43Å; L416-A419 PolarHBondContact O-N 3.1Å; Q417-A419 VanDerWaalsContact C-N 3.31Å; A419-H421 PolarHBondContact O-N 3.26Å; A419-V422 VanDerWaalsContact O-CG2 3.29Å; A419-V422 WeakPolarHBondContact O-CG2 3.43Å; A419-V422 PolarHBondContact O-N 3.46Å; A419-L423 HydrophobicContact CB-CD1 3.98Å; A419-L423 HydrophobicContact CB-CG 4.3Å; A419-L423 VanDerWaalsContact O-CG 3.26Å; A419-L423 WeakPolarHBondContact O-CG 3.27Å; A419-L423 PolarHBondContact O-N 3.11Å
420	R	77.8	Confident	83.7	Confident	94 Å²	94	56.5 Å²	56.5	36%	0.355	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.5	178.1	80.9	-161.4	175.9	141.4	9.4	113.6	L416 Q417 L418 V422 K511 E533	L416-R420 PolarHBondContact O-N 3.32Å; Q417-R420 VanDerWaalsContact O-CD 3.27Å; Q417-R420 WeakPolarHBondContact O-CD 3.46Å; Q417-R420 WeakPolarHBondContact O-CG 3.49Å; Q417-R420 PolarHBondContact O-NE 3.26Å; L418-R420 VanDerWaalsContact C-N 3.33Å; L418-R420 PolarHBondContact O-N 2.87Å; R420-V422 VanDerWaalsContact C-N 3.3Å; R420-K511 PolarHBondContact O-NZ 2.6Å; R420-E533 IonicContact CZ-OE1 3.68Å; R420-E533 IonicContact NH1-OE1 3.57Å; R420-E533 IonicContact NH2-OE1 3.86Å; R420-E533 PolarHBondContact NH2-OE1 2.94Å
421	H	82.7	Confident	83.6	Confident	18 Å²	18	56 Å²	56	8%	0.083	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-17.9	179	-58	-55.5	0	0	0	112.8	L418 A419 K511 R527 A528	L418-H421 PolarHBondContact O-N 2.9Å; A419-H421 PolarHBondContact O-N 3.26Å; H421-K511 VanDerWaalsContact O-CD 3.31Å; H421-K511 WeakPolarHBondContact O-CD 3.39Å; H421-K511 PolarHBondContact O-NZ 3.26Å; H421-R527 WeakPolarHBondContact CE1-CG 3.41Å; H421-A528 PolarHBondContact CE1-O 2.93Å; H421-A528 PolarHBondContact ND1-N 3.3Å; H421-A528 PolarHBondContact ND1-O 2.97Å
422	V	82.5	Confident	83.6	Confident	3 Å²	3	56 Å²	56	2%	0.018	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-27.2	-171.5	-40.7	0	0	0	0	112.3	L11 L14 L18 L28 P29 A419 R420 V515	L11-V422 HydrophobicContact CD2-CB 3.94Å; L11-V422 HydrophobicContact CD2-CG1 3.28Å; L11-V422 HydrophobicContact CG-CG1 4.34Å; L14-V422 HydrophobicContact CD2-CG1 4.01Å; L14-V422 HydrophobicContact CD2-CG2 4.38Å; L18-V422 HydrophobicContact CD1-CG2 3.68Å; L28-V422 HydrophobicContact CD2-CG2 3.84Å; P29-V422 WeakPolarHBondContact CD-O 3.43Å; A419-V422 VanDerWaalsContact O-CG2 3.29Å; A419-V422 WeakPolarHBondContact O-CG2 3.43Å; A419-V422 PolarHBondContact O-N 3.46Å; R420-V422 VanDerWaalsContact C-N 3.3Å; V422-V515 HydrophobicContact CB-CG2 3.65Å; V422-V515 HydrophobicContact CG1-CG2 4.39Å
423	L	87	Confident	83.7	Confident	33 Å²	33	54.1 Å²	54.1	17%	0.173	30%	0.296	C	S	.	.	S	Bend	trans	-77.6	146.1	178.7	-62.2	175.5	0	0	0	111.4	L18 D27 L28 A419 K511	L18-L423 HydrophobicContact CD1-CD2 4.29Å; D27-L423 CarbonylContact O-C 3.39Å; D27-L423 VanDerWaalsContact O-CA 3.25Å; D27-L423 WeakPolarHBondContact O-CA 3.45Å; D27-L423 WeakPolarHBondContact O-CD2 3.44Å; L28-L423 HydrophobicContact CD2-CD2 3.69Å; L28-L423 HydrophobicContact CG-CD2 3.89Å; A419-L423 HydrophobicContact CB-CD1 3.98Å; A419-L423 HydrophobicContact CB-CG 4.3Å; A419-L423 VanDerWaalsContact O-CG 3.26Å; A419-L423 WeakPolarHBondContact O-CG 3.27Å; A419-L423 PolarHBondContact O-N 3.11Å; L423-K511 VanDerWaalsContact O-CE 3.31Å; L423-K511 WeakPolarHBondContact O-CE 3.29Å; L423-K511 PolarHBondContact O-NZ 2.93Å
424	L	90.8	Very high	83.7	Confident	30 Å²	30	58.1 Å²	58.1	16%	0.157	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-70	140.6	170.3	-55.7	178.8	0	0	0	109.8	D27 P29 D507 E508 K511	D27-L424 PolarHBondContact O-N 2.82Å; P29-L424 HydrophobicContact CB-CD2 4.05Å; L424-D507 VanDerWaalsContact CA-OD2 3.25Å; L424-D507 WeakPolarHBondContact CA-OD2 3.49Å; L424-E508 HydrophobicContact CD1-CG 3.71Å; L424-E508 HydrophobicContact CD2-CB 4.3Å; L424-E508 HydrophobicContact CD2-CG 3.86Å; L424-E508 HydrophobicContact CG-CG 4.44Å; L424-K511 HydrophobicContact CD2-CB 3.84Å; L424-K511 HydrophobicContact CD2-CG 4Å
425	E	89.3	Confident	84.1	Confident	35 Å²	35	57.7 Å²	57.7	16%	0.164	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-87.3	130.6	174.3	-67.4	-174.5	-154.7	0	0	109.8	V427 L433 M434 Y435 D507	E425-V427 HydrophobicContact CB-CG1 4.36Å; E425-V427 HydrophobicContact CB-CG2 4.26Å; E425-V427 PolarHBondContact O-N 3.3Å; E425-L433 HydrophobicContact CB-CD2 3.84Å; E425-L433 HydrophobicContact CG-CD2 4.38Å; E425-L433 WeakPolarHBondContact OE2-CA 3.36Å; E425-M434 WeakPolarHBondContact OE2-CB 3.38Å; E425-M434 WeakPolarHBondContact OE2-CG 3.46Å; E425-M434 PolarHBondContact OE2-N 3.12Å; E425-Y435 VanDerWaalsContact OE1-CD1 3.3Å; E425-Y435 WeakPolarHBondContact OE1-CD1 3.41Å; E425-D507 PolarHBondContact N-OD2 2.87Å
426	P	86.2	Confident	84.5	Confident	139 Å²	139	57 Å²	57	90%	0.903	31%	0.309	S	S	*	.			trans	-78.8	59.4	-177.4	34.4	-37.2	0	0	0	111.2
427	V	85.9	Confident	85.3	Confident	51 Å²	51	52.7 Å²	52.7	31%	0.309	29%	0.286	S	S	.	.			trans	-112.4	139.5	-178.5	-62.5	0	0	0	0	111.1	E425 D432 L433	E425-V427 HydrophobicContact CB-CG1 4.36Å; E425-V427 HydrophobicContact CB-CG2 4.26Å; E425-V427 PolarHBondContact O-N 3.3Å; V427-D432 HydrophobicContact CB-CB 3.96Å; V427-D432 HydrophobicContact CG1-CB 4.02Å; V427-L433 HydrophobicContact CG2-CD2 3.35Å; V427-L433 HydrophobicContact CG2-CG 3.82Å
428	A	80.9	Confident	85.8	Confident	101 Å²	101	50.9 Å²	50.9	84%	0.835	29%	0.286	S	S	*	.	S	Bend	trans	-78.1	-31.7	-179.6	0	0	0	0	0	112.4
429	N	84.3	Confident	85.9	Confident	91 Å²	91	53.2 Å²	53.2	49%	0.487	31%	0.306	S	S	.	.	S	Bend	trans	-119	145.3	-179.2	-48.5	-72.9	0	0	0	110.9	Q431 D432	N429-Q431 VanDerWaalsContact C-N 3.27Å; N429-Q431 PolarHBondContact O-N 3.4Å; N429-D432 WeakPolarHBondContact CB-OD2 3.41Å; N429-D432 PolarHBondContact ND2-OD2 3.16Å; N429-D432 VanDerWaalsContact ND2-OD2 3.16Å; N429-D432 WeakPolarHBondContact O-CB 3.11Å; N429-D432 PolarHBondContact O-N 2.84Å; N429-D432 VanDerWaalsContact O-N 3.1Å
430	M	84.6	Confident	86.5	Confident	59 Å²	59	54.5 Å²	54.5	29%	0.291	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-61.9	-31.4	179	177.6	-119.7	-59.7	0	0	113.3	D432 L433 C436 L465 L506	M430-D432 PolarHBondContact O-N 3.13Å; M430-L433 HydrophobicContact CB-CD1 4.45Å; M430-L433 HydrophobicContact CG-CD1 3.99Å; M430-L433 VanDerWaalsContact O-CB 3.32Å; M430-L433 WeakPolarHBondContact O-CB 3.41Å; M430-L433 WeakPolarHBondContact O-CD1 3.39Å; M430-L433 WeakPolarHBondContact O-CG 3.39Å; M430-L433 PolarHBondContact O-N 3.3Å; M430-C436 WeakPolarHBondContact O-CB 3.31Å; M430-L465 HydrophobicContact CE-CD2 3.68Å; M430-L465 HydrophobicContact CG-CD2 4.43Å; M430-L465 HydrophobicContact SD-CD1 3.65Å; M430-L465 HydrophobicContact SD-CD2 3.46Å; M430-L465 WeakPolarHBondContact SD-CD2 3.25Å; M430-L465 HydrophobicContact SD-CG 4.21Å; M430-L506 HydrophobicContact CG-CD2 4.13Å; M430-L506 HydrophobicContact SD-CD2 4.46Å
431	Q	85.8	Confident	87	Confident	95 Å²	95	54 Å²	54	44%	0.444	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-66.1	-24	177.7	-65.1	81	3.4	0	0	112.7	N429 L433 K531	N429-Q431 VanDerWaalsContact C-N 3.27Å; N429-Q431 PolarHBondContact O-N 3.4Å; Q431-L433 VanDerWaalsContact C-N 3.29Å; Q431-K531 PolarHBondContact O-NZ 2.81Å
432	D	89	Confident	87.4	Confident	85 Å²	85	57 Å²	57	46%	0.455	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-80.7	-12.2	-179.7	-60.1	-35.6	0	0	0	112.1	V427 N429 M430 M434	V427-D432 HydrophobicContact CB-CB 3.96Å; V427-D432 HydrophobicContact CG1-CB 4.02Å; N429-D432 WeakPolarHBondContact CB-OD2 3.41Å; N429-D432 PolarHBondContact ND2-OD2 3.16Å; N429-D432 VanDerWaalsContact ND2-OD2 3.16Å; N429-D432 WeakPolarHBondContact O-CB 3.11Å; N429-D432 PolarHBondContact O-N 2.84Å; N429-D432 VanDerWaalsContact O-N 3.1Å; M430-D432 PolarHBondContact O-N 3.13Å; D432-M434 PolarHBondContact O-N 3.14Å
433	L	91.4	Very high	87.7	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.01	36%	0.364	C	S	.	.	S	Bend	trans	-55.7	134.3	174.1	-67	168.4	0	0	0	110.4	E425 V427 M430 Q431 Y435 C436 L457 D507 K531	E425-L433 HydrophobicContact CB-CD2 3.84Å; E425-L433 HydrophobicContact CG-CD2 4.38Å; E425-L433 WeakPolarHBondContact OE2-CA 3.36Å; V427-L433 HydrophobicContact CG2-CD2 3.35Å; V427-L433 HydrophobicContact CG2-CG 3.82Å; M430-L433 HydrophobicContact CB-CD1 4.45Å; M430-L433 HydrophobicContact CG-CD1 3.99Å; M430-L433 VanDerWaalsContact O-CB 3.32Å; M430-L433 WeakPolarHBondContact O-CB 3.41Å; M430-L433 WeakPolarHBondContact O-CD1 3.39Å; M430-L433 WeakPolarHBondContact O-CG 3.39Å; M430-L433 PolarHBondContact O-N 3.3Å; Q431-L433 VanDerWaalsContact C-N 3.29Å; L433-Y435 HydrophobicContact CB-CD1 4.32Å; L433-Y435 HydrophobicContact CB-CE1 4.09Å; L433-Y435 HydrophobicContact CD1-CE1 4.31Å; L433-Y435 HydrophobicContact CD2-CE1 4.01Å; L433-Y435 HydrophobicContact CG-CE1 4.38Å; L433-Y435 PolarHBondContact O-N 2.92Å; L433-Y435 VanDerWaalsContact O-N 3.16Å; L433-C436 HydrophobicContact CB-CB 3.78Å; L433-C436 PolarHBondContact O-N 3.47Å; L433-L457 HydrophobicContact CD1-CD1 3.97Å; L433-D507 HydrophobicContact CD1-CB 4.2Å; L433-D507 HydrophobicContact CD2-CB 3.78Å; L433-K531 PolarHBondContact O-NZ 3.31Å
434	M	90.9	Very high	87.9	Confident	98 Å²	98	64.2 Å²	64.2	48%	0.483	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.9	-176.1	-69	-68.2	176.8	0	0	112.3	E425 D432 T530 K531	E425-M434 WeakPolarHBondContact OE2-CB 3.38Å; E425-M434 WeakPolarHBondContact OE2-CG 3.46Å; E425-M434 PolarHBondContact OE2-N 3.12Å; D432-M434 PolarHBondContact O-N 3.14Å; M434-T530 HydrophobicContact CB-CG2 4.12Å; M434-T530 CarbonylContact O-C 3.54Å; M434-T530 WeakPolarHBondContact O-CA 3.25Å; M434-K531 VanDerWaalsContact O-CG 3.29Å; M434-K531 WeakPolarHBondContact O-CG 3.27Å; M434-K531 PolarHBondContact O-N 2.86Å
435	Y	92.7	Very high	87.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	9.7	177.6	65	-86	0	0	0	113.9	E425 L433 Y437 Y455 L457 D507 V510 A528 I529	E425-Y435 VanDerWaalsContact OE1-CD1 3.3Å; E425-Y435 WeakPolarHBondContact OE1-CD1 3.41Å; L433-Y435 HydrophobicContact CB-CD1 4.32Å; L433-Y435 HydrophobicContact CB-CE1 4.09Å; L433-Y435 HydrophobicContact CD1-CE1 4.31Å; L433-Y435 HydrophobicContact CD2-CE1 4.01Å; L433-Y435 HydrophobicContact CG-CE1 4.38Å; L433-Y435 PolarHBondContact O-N 2.92Å; L433-Y435 VanDerWaalsContact O-N 3.16Å; Y435-Y437 WeakPolarHBondContact O-CD2 3.47Å; Y435-Y455 HydrophobicContact CD2-CD2 4.5Å; Y435-Y455 AromaticContact CD2-CE2 3.8Å; Y435-Y455 HydrophobicContact CD2-CE2 3.8Å; Y435-Y455 AromaticContact CE2-CE2 3.79Å; Y435-Y455 HydrophobicContact CE2-CE2 3.79Å; Y435-L457 HydrophobicContact CD2-CB 4.29Å; Y435-L457 HydrophobicContact CD2-CD1 4.01Å; Y435-L457 HydrophobicContact CD2-CG 3.96Å; Y435-L457 HydrophobicContact CE2-CB 4.43Å; Y435-L457 HydrophobicContact CE2-CD1 3.36Å; Y435-L457 HydrophobicContact CE2-CG 3.65Å; Y435-L457 PolarHBondContact O-N 3.13Å; Y435-D507 PolarHBondContact OH-OD1 3.13Å; Y435-V510 HydrophobicContact CE2-CG1 4.29Å; Y435-A528 HydrophobicContact CD1-CB 4.11Å; Y435-A528 HydrophobicContact CG-CB 3.95Å; Y435-I529 VanDerWaalsContact CA-O 3.3Å; Y435-I529 WeakPolarHBondContact CA-O 3.3Å; Y435-I529 WeakPolarHBondContact CB-O 3.44Å
436	C	93.3	Very high	88.1	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.007	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	108.4	177.5	-175.6	0	0	0	0	112.4	M430 L433 L457 K531	M430-C436 WeakPolarHBondContact O-CB 3.31Å; L433-C436 HydrophobicContact CB-CB 3.78Å; L433-C436 PolarHBondContact O-N 3.47Å; C436-L457 HydrophobicContact CB-CB 3.93Å; C436-L457 HydrophobicContact CB-CD1 4.32Å; C436-K531 WeakPolarHBondContact O-CE 3.24Å; C436-K531 PolarHBondContact O-NZ 3.48Å
437	Y	92.3	Very high	88.4	Confident	9 Å²	9	66.4 Å²	66.4	4%	0.035	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	133.3	-175.7	-65.1	-95.8	0	0	0	111.8	Y435 I440 L456 L457 R458 V459 I529 T530 K531 I534	Y435-Y437 WeakPolarHBondContact O-CD2 3.47Å; Y437-I440 HydrophobicContact CD1-CD1 4.36Å; Y437-I440 HydrophobicContact CD1-CG2 4.22Å; Y437-I440 HydrophobicContact CD2-CD1 4.2Å; Y437-I440 HydrophobicContact CG-CD1 3.84Å; Y437-I440 HydrophobicContact CG-CG1 4.44Å; Y437-I440 HydrophobicContact CG-CG2 4.4Å; Y437-L456 HydrophobicContact CD2-CB 3.91Å; Y437-L456 HydrophobicContact CD2-CD1 4.34Å; Y437-L456 HydrophobicContact CD2-CD2 4.18Å; Y437-L456 HydrophobicContact CD2-CG 4.37Å; Y437-L456 HydrophobicContact CE2-CB 3.76Å; Y437-L456 HydrophobicContact CE2-CD2 3.95Å; Y437-L456 HydrophobicContact CE2-CG 4.38Å; Y437-L457 PolarHBondContact N-O 2.8Å; Y437-R458 WeakPolarHBondContact O-CA 3.35Å; Y437-V459 PolarHBondContact O-N 2.84Å; Y437-I529 WeakPolarHBondContact CE2-O 3.33Å; Y437-I529 PolarHBondContact OH-O 3.27Å; Y437-T530 PolarHBondContact OH-O 2.85Å; Y437-K531 HydrophobicContact CD1-CG 4.09Å; Y437-K531 HydrophobicContact CE1-CB 4.29Å; Y437-K531 HydrophobicContact CE1-CG 3.74Å; Y437-K531 WeakPolarHBondContact OH-CA 3.47Å; Y437-K531 PolarHBondContact OH-N 3.26Å; Y437-I534 HydrophobicContact CD1-CD1 4.1Å; Y437-I534 HydrophobicContact CE1-CD1 3.47Å; Y437-I534 VanDerWaalsContact CE1-CD1 3.47Å; Y437-I534 HydrophobicContact CE1-CG1 4.12Å
438	S	84.7	Confident	88.7	Confident	82 Å²	82	64.7 Å²	64.7	57%	0.573	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	123.4	168.4	-51.6	0	0	0	0	109.6	I440	S438-I440 PolarHBondContact O-N 2.83Å
439	S	77	Confident	89.3	Confident	89 Å²	89	60 Å²	60	62%	0.622	31%	0.312	S	S	*	.	S	Bend	trans	57.9	35.2	163.5	-51	0	0	0	0	116.6	V459	S439-V459 PolarHBondContact N-O 2.85Å; S439-V459 VanDerWaalsContact N-O 3.16Å
440	I	87.7	Confident	89.6	Confident	29 Å²	29	62.8 Å²	62.8	15%	0.149	32%	0.316	C	S	.	.			trans	-83	140.1	167	63.6	168.7	0	0	0	110.8	Y437 S438 T444 A445 L456 R458	Y437-I440 HydrophobicContact CD1-CD1 4.36Å; Y437-I440 HydrophobicContact CD1-CG2 4.22Å; Y437-I440 HydrophobicContact CD2-CD1 4.2Å; Y437-I440 HydrophobicContact CG-CD1 3.84Å; Y437-I440 HydrophobicContact CG-CG1 4.44Å; Y437-I440 HydrophobicContact CG-CG2 4.4Å; S438-I440 PolarHBondContact O-N 2.83Å; I440-T444 HydrophobicContact CB-CG2 4.46Å; I440-A445 HydrophobicContact CD1-CB 4.32Å; I440-L456 HydrophobicContact CD1-CD1 3.77Å; I440-L456 HydrophobicContact CD1-CD2 3.96Å; I440-R458 HydrophobicContact CD1-CG 3.83Å; I440-R458 HydrophobicContact CG1-CG 3.61Å; I440-R458 VanDerWaalsContact O-CZ 3.3Å; I440-R458 PolarHBondContact O-NE 2.93Å; I440-R458 PolarHBondContact O-NH2 2.88Å
441	D	88.4	Confident	89.9	Confident	84 Å²	84	64.8 Å²	64.8	45%	0.449	33%	0.325	S	S	.	.			trans	-79.7	171.5	175.8	62	21.3	0	0	0	112.3	E443 T444 A445	D441-E443 VanDerWaalsContact C-N 3.3Å; D441-E443 PolarHBondContact O-N 2.86Å; D441-E443 PolarHBondContact OD1-N 2.89Å; D441-T444 WeakPolarHBondContact OD1-CB 3.47Å; D441-T444 PolarHBondContact OD1-N 3.2Å; D441-T444 PolarHBondContact OD1-OG1 2.79Å; D441-A445 PolarHBondContact O-N 3.28Å; D441-A445 VanDerWaalsContact O-N 3.08Å
442	D	89.6	Confident	90.1	Very high	81 Å²	81	63 Å²	63	43%	0.433	32%	0.316	S	S	.	.	H	α-helix	trans	-65.9	-33.5	-179	-67.7	-17.3	0	0	0	112.2	A445 N446 R458	D442-A445 PolarHBondContact O-N 3.3Å; D442-N446 WeakPolarHBondContact O-CB 3.21Å; D442-N446 PolarHBondContact O-N 3.44Å; D442-N446 PolarHBondContact O-ND2 3.04Å; D442-R458 IonicContact OD1-CZ 3.21Å; D442-R458 IonicContact OD1-NH1 3.38Å; D442-R458 PolarHBondContact OD1-NH1 3.3Å; D442-R458 IonicContact OD1-NH2 3.78Å; D442-R458 PolarHBondContact OD1-NH2 2.83Å
443	E	90.5	Very high	90.2	Very high	141 Å²	141	59 Å²	59	66%	0.659	30%	0.295	S	S	*	.	H	α-helix	trans	-67.1	-44.2	179.8	-171.5	175.5	176.9	0	0	111.5	D441 N446 R447	D441-E443 VanDerWaalsContact C-N 3.3Å; D441-E443 PolarHBondContact O-N 2.86Å; D441-E443 PolarHBondContact OD1-N 2.89Å; E443-N446 PolarHBondContact O-N 2.8Å; E443-R447 WeakPolarHBondContact O-CG 3.34Å; E443-R447 PolarHBondContact O-N 3.13Å; E443-R447 VanDerWaalsContact O-N 3.09Å
444	T	91	Very high	90.3	Very high	47 Å²	47	59 Å²	59	29%	0.288	30%	0.295	S	S	.	.	H	α-helix	trans	-64.4	-44.4	175.1	-56.5	0	0	0	0	110.7	I440 D441 N446 R447 L448	I440-T444 HydrophobicContact CB-CG2 4.46Å; D441-T444 WeakPolarHBondContact OD1-CB 3.47Å; D441-T444 PolarHBondContact OD1-N 3.2Å; D441-T444 PolarHBondContact OD1-OG1 2.79Å; T444-N446 VanDerWaalsContact C-N 3.33Å; T444-N446 PolarHBondContact O-N 3.32Å; T444-R447 PolarHBondContact O-N 2.89Å; T444-L448 HydrophobicContact CG2-CD1 4.13Å; T444-L448 WeakPolarHBondContact O-CG 3.38Å; T444-L448 PolarHBondContact O-N 3.23Å; T444-L448 VanDerWaalsContact O-N 3.11Å
445	A	91.3	Very high	90.5	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-58.1	-45.6	174.8	0	0	0	0	0	111.4	I440 D441 D442 R447 L448 L449	I440-A445 HydrophobicContact CD1-CB 4.32Å; D441-A445 PolarHBondContact O-N 3.28Å; D441-A445 VanDerWaalsContact O-N 3.08Å; D442-A445 PolarHBondContact O-N 3.3Å; A445-R447 VanDerWaalsContact C-N 3.27Å; A445-R447 PolarHBondContact O-N 3Å; A445-L448 PolarHBondContact O-N 3.12Å; A445-L448 VanDerWaalsContact O-N 3.14Å; A445-L449 WeakPolarHBondContact O-CB 3.39Å; A445-L449 VanDerWaalsContact O-CG 3.26Å; A445-L449 WeakPolarHBondContact O-CG 3.35Å; A445-L449 PolarHBondContact O-N 2.86Å
446	N	92.2	Very high	90.7	Very high	87 Å²	87	54.3 Å²	54.3	47%	0.465	27%	0.272	S	S	.	.	H	α-helix	trans	-59.6	-34.6	177.3	-73.5	-20.7	0	0	0	113.5	D442 E443 T444 V475	D442-N446 WeakPolarHBondContact O-CB 3.21Å; D442-N446 PolarHBondContact O-N 3.44Å; D442-N446 PolarHBondContact O-ND2 3.04Å; E443-N446 PolarHBondContact O-N 2.8Å; T444-N446 VanDerWaalsContact C-N 3.33Å; T444-N446 PolarHBondContact O-N 3.32Å; N446-V475 WeakPolarHBondContact OD1-CB 3.32Å; N446-V475 WeakPolarHBondContact OD1-CG1 3.33Å; N446-V475 WeakPolarHBondContact OD1-CG2 3.35Å
447	R	91.9	Very high	90.8	Very high	162 Å²	162	54.3 Å²	54.3	61%	0.611	27%	0.271	S	S	*	.	H	α-helix	trans	-73.5	-32.7	177	-72.9	176.9	59.5	-155.6	-5.9	113.2	E443 T444 A445 R450	E443-R447 WeakPolarHBondContact O-CG 3.34Å; E443-R447 PolarHBondContact O-N 3.13Å; E443-R447 VanDerWaalsContact O-N 3.09Å; T444-R447 PolarHBondContact O-N 2.89Å; A445-R447 VanDerWaalsContact C-N 3.27Å; A445-R447 PolarHBondContact O-N 3Å; R447-R450 PolarHBondContact O-NE 2.94Å
448	L	92.8	Very high	90.8	Very high	16 Å²	16	54.5 Å²	54.5	8%	0.084	27%	0.272	C	S	.	.	H	α-helix	trans	-79.4	-39.5	-179.3	-69.4	175.4	0	0	0	112.1	T444 A445 R450 L456 I529 I534	T444-L448 HydrophobicContact CG2-CD1 4.13Å; T444-L448 WeakPolarHBondContact O-CG 3.38Å; T444-L448 PolarHBondContact O-N 3.23Å; T444-L448 VanDerWaalsContact O-N 3.11Å; A445-L448 PolarHBondContact O-N 3.12Å; A445-L448 VanDerWaalsContact O-N 3.14Å; L448-R450 PolarHBondContact O-N 3.04Å; L448-R450 VanDerWaalsContact O-N 3.14Å; L448-L456 HydrophobicContact CB-CD2 4.21Å; L448-L456 HydrophobicContact CD1-CD2 4.08Å; L448-I529 HydrophobicContact CB-CG2 4.26Å; L448-I534 HydrophobicContact CD1-CD1 4.37Å; L448-I534 HydrophobicContact CD1-CG1 4.31Å; L448-I534 HydrophobicContact CD2-CG1 4.07Å
449	L	94.5	Very high	91.1	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.005	25%	0.254	C	S	.	.			trans	-80.5	94.3	-179.6	-58	178.6	0	0	0	110.2	A445 D454 L456 K470 V475 I529	A445-L449 WeakPolarHBondContact O-CB 3.39Å; A445-L449 VanDerWaalsContact O-CG 3.26Å; A445-L449 WeakPolarHBondContact O-CG 3.35Å; A445-L449 PolarHBondContact O-N 2.86Å; L449-D454 HydrophobicContact CB-CB 4.31Å; L449-D454 HydrophobicContact CD2-CB 3.87Å; L449-D454 WeakPolarHBondContact CD2-O 3.36Å; L449-L456 HydrophobicContact CD2-CD2 4Å; L449-L456 HydrophobicContact CD2-CG 3.97Å; L449-L456 HydrophobicContact CG-CD2 4.3Å; L449-L456 HydrophobicContact CG-CG 4.46Å; L449-K470 HydrophobicContact CB-CB 3.88Å; L449-K470 WeakPolarHBondContact O-CD 3.38Å; L449-V475 HydrophobicContact CB-CG2 4.17Å; L449-V475 HydrophobicContact CD1-CG1 3.73Å; L449-V475 HydrophobicContact CD1-CG2 4.01Å; L449-I529 HydrophobicContact CD2-CG1 3.88Å
450	R	90.4	Very high	91.5	Very high	150 Å²	150	50.9 Å²	50.9	57%	0.566	24%	0.239	S	C	*	.			trans	-99	-38.4	-169.8	-68.7	179.8	-178.5	175.8	1	113.1	R447 L448 D454 K470 C537	R447-R450 PolarHBondContact O-NE 2.94Å; L448-R450 PolarHBondContact O-N 3.04Å; L448-R450 VanDerWaalsContact O-N 3.14Å; R450-D454 PolarHBondContact N-OD2 2.87Å; R450-K470 WeakPolarHBondContact O-CE 3.25Å; R450-K470 PolarHBondContact O-NZ 2.87Å; R450-C537 PolarHBondContact NH2-SG 3.02Å
451	Q	89.5	Confident	91.2	Very high	102 Å²	102	55.8 Å²	55.8	48%	0.477	27%	0.274	S	S	.	.	S	Bend	trans	-110.6	160.4	-174.8	-60.3	-178.2	1.2	0	0	112	G453 D454 R527	Q451-G453 PolarHBondContact O-N 3.25Å; Q451-D454 PolarHBondContact N-OD2 3.31Å; Q451-D454 VanDerWaalsContact O-CB 3.27Å; Q451-D454 WeakPolarHBondContact O-CB 3.34Å; Q451-D454 PolarHBondContact O-N 2.84Å; Q451-D454 VanDerWaalsContact O-N 3.07Å; Q451-R527 VanDerWaalsContact OE1-NH1 3.07Å
452	E	90.4	Very high	90.8	Very high	58 Å²	58	57.1 Å²	57.1	27%	0.271	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	122	176.5	-67.4	-64.8	136.1	0	0	111.3	P241 D454 W471 D472 G473	P241-E452 HydrophobicContact CG-CB 4.27Å; E452-D454 VanDerWaalsContact C-N 3.33Å; E452-W471 VanDerWaalsContact OE2-CA 3.22Å; E452-W471 WeakPolarHBondContact OE2-CA 3.3Å; E452-D472 PolarHBondContact OE1-N 2.89Å; E452-D472 PolarHBondContact OE2-N 2.94Å; E452-G473 PolarHBondContact OE1-N 2.58Å
453	G	91.4	Very high	90.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.4	4.1	-176.1	0	0	0	0	0	114.8	Q451 Y455 K470 V524 R526 R527	Q451-G453 PolarHBondContact O-N 3.25Å; G453-Y455 PolarHBondContact O-N 2.86Å; G453-K470 PolarHBondContact N-O 2.55Å; G453-V524 VanDerWaalsContact CA-O 3.29Å; G453-V524 WeakPolarHBondContact CA-O 3.4Å; G453-R526 PolarHBondContact O-N 3.41Å; G453-R527 PolarHBondContact O-N 2.93Å
454	D	93.8	Very high	90.4	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.011	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	132.5	163.6	-75.6	-7.6	0	0	0	108.6	L449 R450 Q451 E452 V469 K470 R527 I529	L449-D454 HydrophobicContact CB-CB 4.31Å; L449-D454 HydrophobicContact CD2-CB 3.87Å; L449-D454 WeakPolarHBondContact CD2-O 3.36Å; R450-D454 PolarHBondContact N-OD2 2.87Å; Q451-D454 PolarHBondContact N-OD2 3.31Å; Q451-D454 VanDerWaalsContact O-CB 3.27Å; Q451-D454 WeakPolarHBondContact O-CB 3.34Å; Q451-D454 PolarHBondContact O-N 2.84Å; Q451-D454 VanDerWaalsContact O-N 3.07Å; E452-D454 VanDerWaalsContact C-N 3.33Å; D454-V469 CarbonylContact O-C 3.56Å; D454-V469 VanDerWaalsContact O-CA 3.25Å; D454-V469 WeakPolarHBondContact O-CA 3.33Å; D454-V469 WeakPolarHBondContact O-CG2 3.37Å; D454-K470 PolarHBondContact O-N 3.34Å; D454-R527 WeakPolarHBondContact CA-O 3.45Å; D454-R527 IonicContact OD1-CZ 2.61Å; D454-R527 IonicContact OD1-NE 3.58Å; D454-R527 PolarHBondContact OD1-NE 3.2Å; D454-R527 IonicContact OD1-NH2 3.71Å; D454-R527 PolarHBondContact OD1-NH2 3.11Å; D454-R527 IonicContact OD2-CZ 3.83Å; D454-R527 IonicContact OD2-NE 3.67Å; D454-R527 IonicContact OD2-NH2 2.84Å; D454-R527 PolarHBondContact OD2-NH2 2.85Å; D454-I529 HydrophobicContact CB-CD1 4.05Å; D454-I529 HydrophobicContact CB-CG1 3.98Å
455	Y	95.9	Very high	90.4	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	159.5	178.9	78.1	-84.7	0	0	0	112.6	Y435 G453 I467 S468 V510 V514 L525 R527 A528 I529	Y435-Y455 HydrophobicContact CD2-CD2 4.5Å; Y435-Y455 AromaticContact CD2-CE2 3.8Å; Y435-Y455 HydrophobicContact CD2-CE2 3.8Å; Y435-Y455 AromaticContact CE2-CE2 3.79Å; Y435-Y455 HydrophobicContact CE2-CE2 3.79Å; G453-Y455 PolarHBondContact O-N 2.86Å; Y455-I467 HydrophobicContact CD2-CG2 4.44Å; Y455-S468 CarbonylContact C-O 3.38Å; Y455-S468 WeakPolarHBondContact CA-O 3.12Å; Y455-S468 WeakPolarHBondContact CB-O 3.48Å; Y455-V510 HydrophobicContact CD2-CG1 4.41Å; Y455-V510 HydrophobicContact CE2-CG1 3.51Å; Y455-V514 HydrophobicContact CD1-CG2 4.35Å; Y455-V514 HydrophobicContact CE1-CG2 3.41Å; Y455-V514 VanDerWaalsContact CE1-CG2 3.41Å; Y455-V514 WeakPolarHBondContact OH-CG2 3.21Å; Y455-L525 HydrophobicContact CD1-CB 3.83Å; Y455-L525 HydrophobicContact CD1-CD2 4.47Å; Y455-L525 HydrophobicContact CD2-CD1 4.41Å; Y455-L525 HydrophobicContact CE1-CB 4.1Å; Y455-L525 HydrophobicContact CG-CB 4.22Å; Y455-L525 HydrophobicContact CG-CD2 4.06Å; Y455-L525 HydrophobicContact CG-CG 4.49Å; Y455-R527 VanDerWaalsContact CD1-C 3.46Å; Y455-R527 VanDerWaalsContact CD1-O 3.29Å; Y455-R527 WeakPolarHBondContact CD1-O 3.5Å; Y455-R527 VanDerWaalsContact CE1-C 3.44Å; Y455-R527 PolarHBondContact N-O 3.19Å; Y455-A528 HydrophobicContact CE1-CB 3.93Å; Y455-A528 VanDerWaalsContact CE1-N 3.25Å; Y455-A528 HydrophobicContact CE2-CB 4.25Å; Y455-A528 WeakPolarHBondContact OH-CB 3.21Å; Y455-I529 PolarHBondContact O-N 3.1Å
456	L	95.7	Very high	90.5	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	159.1	172	54.9	77.5	0	0	0	110.7	Y437 I440 L448 L449 R458 S468 I529	Y437-L456 HydrophobicContact CD2-CB 3.91Å; Y437-L456 HydrophobicContact CD2-CD1 4.34Å; Y437-L456 HydrophobicContact CD2-CD2 4.18Å; Y437-L456 HydrophobicContact CD2-CG 4.37Å; Y437-L456 HydrophobicContact CE2-CB 3.76Å; Y437-L456 HydrophobicContact CE2-CD2 3.95Å; Y437-L456 HydrophobicContact CE2-CG 4.38Å; I440-L456 HydrophobicContact CD1-CD1 3.77Å; I440-L456 HydrophobicContact CD1-CD2 3.96Å; L448-L456 HydrophobicContact CB-CD2 4.21Å; L448-L456 HydrophobicContact CD1-CD2 4.08Å; L449-L456 HydrophobicContact CD2-CD2 4Å; L449-L456 HydrophobicContact CD2-CG 3.97Å; L449-L456 HydrophobicContact CG-CD2 4.3Å; L449-L456 HydrophobicContact CG-CG 4.46Å; L456-R458 HydrophobicContact CD1-CG 3.35Å; L456-S468 PolarHBondContact N-O 3.04Å; L456-S468 PolarHBondContact O-N 2.83Å; L456-I529 HydrophobicContact CB-CB 4.5Å
457	L	95.2	Very high	90.6	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	142.2	172.2	-78	174.6	0	0	0	110	L433 Y435 C436 Y437 L465 L466 I467 L506	L433-L457 HydrophobicContact CD1-CD1 3.97Å; Y435-L457 HydrophobicContact CD2-CB 4.29Å; Y435-L457 HydrophobicContact CD2-CD1 4.01Å; Y435-L457 HydrophobicContact CD2-CG 3.96Å; Y435-L457 HydrophobicContact CE2-CB 4.43Å; Y435-L457 HydrophobicContact CE2-CD1 3.36Å; Y435-L457 HydrophobicContact CE2-CG 3.65Å; Y435-L457 PolarHBondContact O-N 3.13Å; C436-L457 HydrophobicContact CB-CB 3.93Å; C436-L457 HydrophobicContact CB-CD1 4.32Å; Y437-L457 PolarHBondContact N-O 2.8Å; L457-L465 HydrophobicContact CB-CD1 4.4Å; L457-L465 HydrophobicContact CD2-CD1 4.29Å; L457-L465 HydrophobicContact CD2-CD2 4.09Å; L457-L465 HydrophobicContact CD2-CG 4.1Å; L457-L466 CarbonylContact C-O 3.56Å; L457-L466 WeakPolarHBondContact CA-O 3.29Å; L457-I467 HydrophobicContact CD2-CB 4.44Å; L457-I467 HydrophobicContact CD2-CD1 4.26Å; L457-I467 HydrophobicContact CD2-CG1 3.33Å; L457-L506 HydrophobicContact CD1-CD2 4.08Å; L457-L506 HydrophobicContact CD2-CD2 4.24Å
458	R	93.1	Very high	90.8	Very high	13 Å²	13	40.2 Å²	40.2	5%	0.049	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	123.9	179.4	-71.4	173	57.6	-163	-2.7	111.1	Y437 I440 D442 L456 L465 L466 S468	Y437-R458 WeakPolarHBondContact O-CA 3.35Å; I440-R458 HydrophobicContact CD1-CG 3.83Å; I440-R458 HydrophobicContact CG1-CG 3.61Å; I440-R458 VanDerWaalsContact O-CZ 3.3Å; I440-R458 PolarHBondContact O-NE 2.93Å; I440-R458 PolarHBondContact O-NH2 2.88Å; D442-R458 IonicContact OD1-CZ 3.21Å; D442-R458 IonicContact OD1-NH1 3.38Å; D442-R458 PolarHBondContact OD1-NH1 3.3Å; D442-R458 IonicContact OD1-NH2 3.78Å; D442-R458 PolarHBondContact OD1-NH2 2.83Å; L456-R458 HydrophobicContact CD1-CG 3.35Å; R458-L465 WeakPolarHBondContact O-CA 3.27Å; R458-L466 HydrophobicContact CB-CB 4.43Å; R458-L466 PolarHBondContact N-O 3.3Å; R458-L466 PolarHBondContact O-N 3.26Å; R458-S468 WeakPolarHBondContact CD-OG 3.47Å; R458-S468 PolarHBondContact NH1-OG 2.99Å
459	V	90.6	Very high	91	Very high	32 Å²	32	39.4 Å²	39.4	19%	0.194	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	112.9	168.1	-172.5	0	0	0	0	108.1	Y437 S439 L465	Y437-V459 PolarHBondContact O-N 2.84Å; S439-V459 PolarHBondContact N-O 2.85Å; S439-V459 VanDerWaalsContact N-O 3.16Å; V459-L465 HydrophobicContact CG2-CD1 3.83Å
460	Q	86.2	Confident	91.1	Very high	64 Å²	64	41.8 Å²	41.8	30%	0.299	22%	0.222	S	C	.	.			trans	-73	164.8	174.3	-67.6	-162.4	-41	0	0	111.6	N462 G463 Q464 L466	Q460-N462 WeakPolarHBondContact CB-OD1 2.79Å; Q460-N462 PolarHBondContact O-N 2.81Å; Q460-G463 WeakPolarHBondContact O-CA 3.35Å; Q460-G463 PolarHBondContact O-N 2.86Å; Q460-Q464 HydrophobicContact CB-CB 4.41Å; Q460-Q464 WeakPolarHBondContact CB-O 3.37Å; Q460-Q464 PolarHBondContact N-O 2.95Å; Q460-L466 VanDerWaalsContact CD-CD1 3.43Å; Q460-L466 HydrophobicContact CG-CD1 3.83Å; Q460-L466 HydrophobicContact CG-CG 4.13Å
461	C	79.8	Confident	91.3	Very high	131 Å²	131	34.9 Å²	34.9	89%	0.885	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-26.7	-178	-56.7	0	0	0	0	113.9
462	N	82	Confident	91.4	Very high	112 Å²	112	33.5 Å²	33.5	60%	0.599	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.7	0.2	174.1	64.5	-9	0	0	0	113.1	Q460 Q464	Q460-N462 WeakPolarHBondContact CB-OD1 2.79Å; Q460-N462 PolarHBondContact O-N 2.81Å; N462-Q464 VanDerWaalsContact C-N 3.31Å; N462-Q464 PolarHBondContact ND2-OE1 3.4Å; N462-Q464 WeakPolarHBondContact OD1-CB 3.39Å; N462-Q464 PolarHBondContact OD1-N 3.12Å
463	G	82.3	Confident	91.3	Very high	55 Å²	55	33.3 Å²	33.3	57%	0.567	21%	0.205	S	C	*	.	S	Bend	trans	84.5	-4.5	-174.8	0	0	0	0	0	114.7	Q460	Q460-G463 WeakPolarHBondContact O-CA 3.35Å; Q460-G463 PolarHBondContact O-N 2.86Å
464	Q	87.6	Confident	91.4	Very high	76 Å²	76	39.4 Å²	39.4	36%	0.355	23%	0.234	S	C	.	.			trans	-64.7	137.1	176	-176.2	177.1	-1	0	0	110.2	Q460 N462 D479	Q460-Q464 HydrophobicContact CB-CB 4.41Å; Q460-Q464 WeakPolarHBondContact CB-O 3.37Å; Q460-Q464 PolarHBondContact N-O 2.95Å; N462-Q464 VanDerWaalsContact C-N 3.31Å; N462-Q464 PolarHBondContact ND2-OE1 3.4Å; N462-Q464 WeakPolarHBondContact OD1-CB 3.39Å; N462-Q464 PolarHBondContact OD1-N 3.12Å; Q464-D479 PolarHBondContact NE2-OD1 2.75Å
465	L	90.9	Very high	91.5	Very high	21 Å²	21	41.2 Å²	41.2	11%	0.11	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.1	178.5	-170	71.3	0	0	0	110.5	M430 L457 R458 V459 A480 L506	M430-L465 HydrophobicContact CE-CD2 3.68Å; M430-L465 HydrophobicContact CG-CD2 4.43Å; M430-L465 HydrophobicContact SD-CD1 3.65Å; M430-L465 HydrophobicContact SD-CD2 3.46Å; M430-L465 WeakPolarHBondContact SD-CD2 3.25Å; M430-L465 HydrophobicContact SD-CG 4.21Å; L457-L465 HydrophobicContact CB-CD1 4.4Å; L457-L465 HydrophobicContact CD2-CD1 4.29Å; L457-L465 HydrophobicContact CD2-CD2 4.09Å; L457-L465 HydrophobicContact CD2-CG 4.1Å; R458-L465 WeakPolarHBondContact O-CA 3.27Å; V459-L465 HydrophobicContact CG2-CD1 3.83Å; L465-A480 HydrophobicContact CB-CB 3.79Å; L465-A480 HydrophobicContact CD2-CB 3.67Å; L465-A480 HydrophobicContact CG-CB 3.84Å; L465-A480 WeakPolarHBondContact O-CB 3.4Å; L465-A480 PolarHBondContact O-N 3.27Å; L465-L506 HydrophobicContact CD2-CD2 3.06Å; L465-L506 HydrophobicContact CG-CD2 4.43Å
466	L	93.4	Very high	91.4	Very high	11 Å²	11	44 Å²	44	6%	0.058	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	146.1	175.8	-65.3	-179	0	0	0	111.1	L457 R458 Q460 N477 L478	L457-L466 CarbonylContact C-O 3.56Å; L457-L466 WeakPolarHBondContact CA-O 3.29Å; R458-L466 HydrophobicContact CB-CB 4.43Å; R458-L466 PolarHBondContact N-O 3.3Å; R458-L466 PolarHBondContact O-N 3.26Å; Q460-L466 VanDerWaalsContact CD-CD1 3.43Å; Q460-L466 HydrophobicContact CG-CD1 3.83Å; Q460-L466 HydrophobicContact CG-CG 4.13Å; L466-N477 HydrophobicContact CD1-CB 4.39Å; L466-L478 CarbonylContact C-O 3.05Å; L466-L478 VanDerWaalsContact CA-O 3.3Å; L466-L478 WeakPolarHBondContact CA-O 3.18Å
467	I	95.2	Very high	91.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	110.4	165.7	-63.4	159	0	0	0	106.9	Y455 L457 L478 V510 W520 L525	Y455-I467 HydrophobicContact CD2-CG2 4.44Å; L457-I467 HydrophobicContact CD2-CB 4.44Å; L457-I467 HydrophobicContact CD2-CD1 4.26Å; L457-I467 HydrophobicContact CD2-CG1 3.33Å; I467-L478 HydrophobicContact CB-CB 4.34Å; I467-L478 PolarHBondContact N-O 3.42Å; I467-L478 PolarHBondContact O-N 2.79Å; I467-V510 HydrophobicContact CD1-CG2 4.2Å; I467-W520 HydrophobicContact CD1-CE3 4.1Å; I467-W520 HydrophobicContact CD1-CH2 3.06Å; I467-W520 HydrophobicContact CD1-CZ2 3.84Å; I467-W520 HydrophobicContact CD1-CZ3 3.21Å; I467-L525 HydrophobicContact CG2-CD1 4.26Å; I467-L525 HydrophobicContact CG2-CD2 3.94Å
468	S	96.3	Very high	91.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	128.1	170.9	-64	0	0	0	0	108.9	Y455 L456 R458 H476 N477	Y455-S468 CarbonylContact C-O 3.38Å; Y455-S468 WeakPolarHBondContact CA-O 3.12Å; Y455-S468 WeakPolarHBondContact CB-O 3.48Å; L456-S468 PolarHBondContact N-O 3.04Å; L456-S468 PolarHBondContact O-N 2.83Å; R458-S468 WeakPolarHBondContact CD-OG 3.47Å; R458-S468 PolarHBondContact NH1-OG 2.99Å; S468-H476 CarbonylContact C-O 3.56Å; S468-H476 WeakPolarHBondContact CA-O 3.49Å; S468-N477 WeakPolarHBondContact CB-OD1 3.26Å; S468-N477 PolarHBondContact OG-OD1 2.75Å
469	V	96.7	Very high	91.3	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	137.3	-178.6	53.2	0	0	0	0	110.9	D454 V475 H476 L478 V523 L525	D454-V469 CarbonylContact O-C 3.56Å; D454-V469 VanDerWaalsContact O-CA 3.25Å; D454-V469 WeakPolarHBondContact O-CA 3.33Å; D454-V469 WeakPolarHBondContact O-CG2 3.37Å; V469-V475 CarbonylContact O-C 3.56Å; V469-V475 WeakPolarHBondContact O-CA 3.49Å; V469-H476 HydrophobicContact CG1-CB 4.25Å; V469-H476 PolarHBondContact N-O 3.03Å; V469-H476 PolarHBondContact O-N 2.7Å; V469-L478 HydrophobicContact CG1-CD1 4.29Å; V469-V523 HydrophobicContact CG1-CB 4.22Å; V469-V523 HydrophobicContact CG1-CG2 3.47Å; V469-V523 VanDerWaalsContact CG1-CG2 3.47Å; V469-L525 HydrophobicContact CB-CD2 3.79Å; V469-L525 HydrophobicContact CG1-CD2 4.08Å; V469-L525 HydrophobicContact CG2-CD2 3.77Å
470	K	95.9	Very high	91.2	Very high	50 Å²	50	49.6 Å²	49.6	22%	0.217	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	121.7	170.5	179.1	163.2	-177	176.5	0	110.7	L449 R450 G453 D454 Q474 V475	L449-K470 HydrophobicContact CB-CB 3.88Å; L449-K470 WeakPolarHBondContact O-CD 3.38Å; R450-K470 WeakPolarHBondContact O-CE 3.25Å; R450-K470 PolarHBondContact O-NZ 2.87Å; G453-K470 PolarHBondContact N-O 2.55Å; D454-K470 PolarHBondContact O-N 3.34Å; K470-Q474 CarbonylContact C-O 3.53Å; K470-Q474 VanDerWaalsContact CA-O 3.32Å; K470-Q474 WeakPolarHBondContact CA-O 3.42Å; K470-V475 HydrophobicContact CB-CG2 4.18Å
471	W	94.9	Very high	91.5	Very high	5 Å²	5	47.8 Å²	47.8	2%	0.019	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	136.6	177.7	-165.2	-101.4	0	0	0	111.8	W193 P241 G244 L246 E452 G473 Q474 H476 G522 V523 V524	W193-W471 AromaticContact CZ2-CZ2 3.91Å; W193-W471 HydrophobicContact CZ2-CZ2 3.91Å; P241-W471 HydrophobicContact CB-CH2 3.85Å; P241-W471 HydrophobicContact CB-CZ2 4.39Å; P241-W471 HydrophobicContact CB-CZ3 4.26Å; P241-W471 HydrophobicContact CG-CH2 3.61Å; P241-W471 HydrophobicContact CG-CZ3 3.75Å; G244-W471 PolarHBondContact O-NE1 2.8Å; L246-W471 HydrophobicContact CD2-CH2 4.15Å; L246-W471 HydrophobicContact CG-CH2 4.16Å; L246-W471 HydrophobicContact CG-CZ2 4.49Å; E452-W471 VanDerWaalsContact OE2-CA 3.22Å; E452-W471 WeakPolarHBondContact OE2-CA 3.3Å; W471-G473 PolarHBondContact O-N 2.8Å; W471-Q474 PolarHBondContact N-O 3.07Å; W471-Q474 PolarHBondContact O-N 2.94Å; W471-Q474 VanDerWaalsContact O-N 3.13Å; W471-H476 PolarHBondContact O-CD2 3.21Å; W471-H476 PolarHBondContact O-NE2 3.04Å; W471-G522 PolarHBondContact NE1-O 2.65Å; W471-V523 HydrophobicContact CB-CB 3.79Å; W471-V523 HydrophobicContact CB-CG1 3.77Å; W471-V523 HydrophobicContact CD2-CB 4.34Å; W471-V523 HydrophobicContact CG-CB 3.76Å; W471-V523 HydrophobicContact CG-CG1 3.92Å; W471-V524 HydrophobicContact CE3-CB 4.33Å; W471-V524 HydrophobicContact CH2-CB 3.65Å; W471-V524 HydrophobicContact CH2-CG2 3.88Å; W471-V524 HydrophobicContact CZ2-CB 4.24Å; W471-V524 HydrophobicContact CZ2-CG2 4.05Å; W471-V524 HydrophobicContact CZ3-CB 3.72Å; W471-V524 HydrophobicContact CZ3-CG2 4.42Å
472	D	91.2	Very high	92	Very high	73 Å²	73	50 Å²	50	39%	0.39	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.7	41.4	-176.2	-149.9	9.1	0	0	0	112.3	R198 E452 Q474	R198-D472 IonicContact NH1-OD2 3.86Å; R198-D472 PolarHBondContact NH1-OD2 3.29Å; R198-D472 VanDerWaalsContact NH1-OD2 3.16Å; E452-D472 PolarHBondContact OE1-N 2.89Å; E452-D472 PolarHBondContact OE2-N 2.94Å; D472-Q474 PolarHBondContact O-N 2.66Å
473	G	89.9	Confident	92.4	Very high	54 Å²	54	47.8 Å²	47.8	56%	0.557	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.1	-2.1	-179.1	0	0	0	0	0	115.6	E452 W471	E452-G473 PolarHBondContact OE1-N 2.58Å; W471-G473 PolarHBondContact O-N 2.8Å
474	Q	93.2	Very high	92.9	Very high	129 Å²	129	47.1 Å²	47.1	60%	0.603	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	154.6	-177.6	-61.1	-177	6.8	0	0	111.2	K470 W471 D472 H476	K470-Q474 CarbonylContact C-O 3.53Å; K470-Q474 VanDerWaalsContact CA-O 3.32Å; K470-Q474 WeakPolarHBondContact CA-O 3.42Å; W471-Q474 PolarHBondContact N-O 3.07Å; W471-Q474 PolarHBondContact O-N 2.94Å; W471-Q474 VanDerWaalsContact O-N 3.13Å; D472-Q474 PolarHBondContact O-N 2.66Å; Q474-H476 PolarHBondContact O-CD2 2.85Å
475	V	95	Very high	93	Very high	39 Å²	39	51.9 Å²	51.9	24%	0.236	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	127.4	171	174.3	0	0	0	0	109.3	N446 L449 V469 K470	N446-V475 WeakPolarHBondContact OD1-CB 3.32Å; N446-V475 WeakPolarHBondContact OD1-CG1 3.33Å; N446-V475 WeakPolarHBondContact OD1-CG2 3.35Å; L449-V475 HydrophobicContact CB-CG2 4.17Å; L449-V475 HydrophobicContact CD1-CG1 3.73Å; L449-V475 HydrophobicContact CD1-CG2 4.01Å; V469-V475 CarbonylContact O-C 3.56Å; V469-V475 WeakPolarHBondContact O-CA 3.49Å; K470-V475 HydrophobicContact CB-CG2 4.18Å
476	H	95.2	Very high	92.9	Very high	59 Å²	59	55.1 Å²	55.1	27%	0.273	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.5	177.5	-57.8	-93	0	0	0	108.6	S468 V469 W471 Q474 V523	S468-H476 CarbonylContact C-O 3.56Å; S468-H476 WeakPolarHBondContact CA-O 3.49Å; V469-H476 HydrophobicContact CG1-CB 4.25Å; V469-H476 PolarHBondContact N-O 3.03Å; V469-H476 PolarHBondContact O-N 2.7Å; W471-H476 PolarHBondContact O-CD2 3.21Å; W471-H476 PolarHBondContact O-NE2 3.04Å; Q474-H476 PolarHBondContact O-CD2 2.85Å; H476-V523 HydrophobicContact CB-CG1 4.23Å
477	N	93.9	Very high	92.8	Very high	69 Å²	69	56.7 Å²	56.7	37%	0.369	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	116.7	173	-68.7	-33.6	0	0	0	108.2	L466 S468	L466-N477 HydrophobicContact CD1-CB 4.39Å; S468-N477 WeakPolarHBondContact CB-OD1 3.26Å; S468-N477 PolarHBondContact OG-OD1 2.75Å
478	L	94.2	Very high	92.7	Very high	12 Å²	12	58.2 Å²	58.2	6%	0.063	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	142.8	178.7	-52.9	178.8	0	0	0	109.8	L466 I467 V469 W520 R521 V523	L466-L478 CarbonylContact C-O 3.05Å; L466-L478 VanDerWaalsContact CA-O 3.3Å; L466-L478 WeakPolarHBondContact CA-O 3.18Å; I467-L478 HydrophobicContact CB-CB 4.34Å; I467-L478 PolarHBondContact N-O 3.42Å; I467-L478 PolarHBondContact O-N 2.79Å; V469-L478 HydrophobicContact CG1-CD1 4.29Å; L478-W520 HydrophobicContact CD1-CB 4.21Å; L478-W520 HydrophobicContact CD1-CD2 4.14Å; L478-W520 HydrophobicContact CD1-CG 3.86Å; L478-R521 HydrophobicContact CD2-CB 4.2Å; L478-V523 HydrophobicContact CD1-CG2 3.63Å; L478-V523 HydrophobicContact CG-CG2 4.48Å
479	D	92.3	Very high	92.7	Very high	61 Å²	61	60.3 Å²	60.3	33%	0.326	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	136.9	167.5	-50.2	-63.7	0	0	0	109.6	Q464 W520 R521	Q464-D479 PolarHBondContact NE2-OD1 2.75Å; D479-W520 WeakPolarHBondContact O-CZ2 3.45Å; D479-R521 IonicContact OD2-CZ 2.83Å; D479-R521 IonicContact OD2-NH1 2.85Å; D479-R521 PolarHBondContact OD2-NH1 2.84Å; D479-R521 IonicContact OD2-NH2 3.11Å
480	A	90	Very high	92.6	Very high	20 Å²	20	63.1 Å²	63.1	17%	0.165	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-59.5	152.7	167.1	0	0	0	0	0	110.3	L465	L465-A480 HydrophobicContact CB-CB 3.79Å; L465-A480 HydrophobicContact CD2-CB 3.67Å; L465-A480 HydrophobicContact CG-CB 3.84Å; L465-A480 WeakPolarHBondContact O-CB 3.4Å; L465-A480 PolarHBondContact O-N 3.27Å
481	P	91.3	Very high	92.5	Very high	27 Å²	27	61 Å²	61	18%	0.175	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-69.5	147.6	178.4	23.6	-8.9	0	0	0	109	Y489 L506 Y509 W520	P481-Y489 HydrophobicContact CB-CD1 4.13Å; P481-Y489 HydrophobicContact CG-CD1 3.88Å; P481-Y489 HydrophobicContact CG-CE1 4.33Å; P481-Y489 VanDerWaalsContact O-CE1 3.29Å; P481-Y489 WeakPolarHBondContact O-CE1 3.36Å; P481-L506 HydrophobicContact CG-CD1 3.59Å; P481-Y509 HydrophobicContact CB-CD1 4.47Å; P481-Y509 HydrophobicContact CB-CE1 4.16Å; P481-Y509 HydrophobicContact CB-CE2 4.3Å; P481-Y509 HydrophobicContact CG-CD1 3.54Å; P481-Y509 HydrophobicContact CG-CD2 4.29Å; P481-Y509 HydrophobicContact CG-CE1 3.6Å; P481-Y509 HydrophobicContact CG-CE2 4.3Å; P481-Y509 HydrophobicContact CG-CG 3.91Å; P481-W520 HydrophobicContact CB-CH2 4.42Å; P481-W520 HydrophobicContact CB-CZ2 4.3Å; P481-W520 HydrophobicContact CG-CH2 3.7Å; P481-W520 HydrophobicContact CG-CZ2 4.06Å
482	E	90.2	Very high	92.4	Very high	178 Å²	178	62.6 Å²	62.6	83%	0.832	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-85.5	146.2	173.2	-65.7	179.6	175.4	0	0	109.8
483	S	91	Very high	92.3	Very high	65 Å²	65	64.2 Å²	64.2	46%	0.455	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-72.5	143.1	169.8	57.2	0	0	0	0	110.1	M488	S483-M488 CarbonylContact C-O 3.54Å; S483-M488 VanDerWaalsContact CA-O 3.24Å; S483-M488 WeakPolarHBondContact CA-O 3.49Å
484	N	92.3	Very high	92.1	Very high	40 Å²	40	65 Å²	65	21%	0.214	35%	0.354	C	S	.	.			trans	-75.3	-177.3	173.2	65.9	28.4	0	0	0	111.9	L486 G487 M488 T490	N484-L486 PolarHBondContact O-N 3.33Å; N484-L486 WeakPolarHBondContact OD1-CA 3.32Å; N484-L486 WeakPolarHBondContact OD1-CB 3.4Å; N484-L486 PolarHBondContact OD1-N 2.74Å; N484-G487 PolarHBondContact O-N 3.4Å; N484-G487 PolarHBondContact OD1-N 3.08Å; N484-M488 PolarHBondContact N-O 3.13Å; N484-M488 PolarHBondContact ND2-O 2.99Å; N484-M488 PolarHBondContact OD1-N 3.47Å; N484-M488 VanDerWaalsContact OD1-N 3.13Å; N484-M488 PolarHBondContact OD1-O 2.78Å; N484-T490 PolarHBondContact ND2-OG1 2.74Å; N484-T490 VanDerWaalsContact ND2-OG1 3.08Å
485	D	89.7	Confident	91.7	Very high	176 Å²	176	62.4 Å²	62.4	94%	0.941	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-19.2	-178.2	-60.5	-24.5	0	0	0	114	G487	D485-G487 VanDerWaalsContact C-N 3.3Å
486	L	88.9	Confident	91.5	Very high	89 Å²	89	64.5 Å²	64.5	47%	0.466	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	1	175.4	-58	170	0	0	0	112.6	C91 N484 M488	C91-L486 WeakPolarHBondContact O-CD1 3.48Å; N484-L486 PolarHBondContact O-N 3.33Å; N484-L486 WeakPolarHBondContact OD1-CA 3.32Å; N484-L486 WeakPolarHBondContact OD1-CB 3.4Å; N484-L486 PolarHBondContact OD1-N 2.74Å; L486-M488 HydrophobicContact CB-CG 4.04Å; L486-M488 PolarHBondContact O-N 2.58Å
487	G	90.7	Very high	91.2	Very high	44 Å²	44	63.7 Å²	63.7	45%	0.454	37%	0.367	S	S	.	.	S	Bend	trans	74.5	13.3	-173.2	0	0	0	0	0	113.7	N484 D485	N484-G487 PolarHBondContact O-N 3.4Å; N484-G487 PolarHBondContact OD1-N 3.08Å; D485-G487 VanDerWaalsContact C-N 3.3Å
488	M	93.9	Very high	91.2	Very high	33 Å²	33	61.6 Å²	61.6	16%	0.163	35%	0.354	C	S	.	.			trans	-107	160.8	-175.5	-55	-59.4	-133.8	0	0	111.5	R106 S483 N484 L486 E502	R106-M488 HydrophobicContact CG-CE 4.34Å; S483-M488 CarbonylContact C-O 3.54Å; S483-M488 VanDerWaalsContact CA-O 3.24Å; S483-M488 WeakPolarHBondContact CA-O 3.49Å; N484-M488 PolarHBondContact N-O 3.13Å; N484-M488 PolarHBondContact ND2-O 2.99Å; N484-M488 PolarHBondContact OD1-N 3.47Å; N484-M488 VanDerWaalsContact OD1-N 3.13Å; N484-M488 PolarHBondContact OD1-O 2.78Å; L486-M488 HydrophobicContact CB-CG 4.04Å; L486-M488 PolarHBondContact O-N 2.58Å; M488-E502 HydrophobicContact CB-CB 3.92Å; M488-E502 HydrophobicContact CB-CG 4.4Å
489	Y	95.4	Very high	91.1	Very high	44 Å²	44	61.8 Å²	61.8	17%	0.173	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	118.3	175	-60.3	-91.2	0	0	0	110.1	P481 L491 E502 V503 N505 L506	P481-Y489 HydrophobicContact CB-CD1 4.13Å; P481-Y489 HydrophobicContact CG-CD1 3.88Å; P481-Y489 HydrophobicContact CG-CE1 4.33Å; P481-Y489 VanDerWaalsContact O-CE1 3.29Å; P481-Y489 WeakPolarHBondContact O-CE1 3.36Å; Y489-L491 PolarHBondContact O-N 3.23Å; Y489-E502 CarbonylContact O-C 3.48Å; Y489-E502 WeakPolarHBondContact O-CA 3.42Å; Y489-V503 PolarHBondContact N-O 3.36Å; Y489-V503 PolarHBondContact O-N 2.93Å; Y489-N505 VanDerWaalsContact CD2-C 3.43Å; Y489-N505 VanDerWaalsContact CE2-C 3.49Å; Y489-L506 HydrophobicContact CD1-CD1 4.46Å; Y489-L506 HydrophobicContact CE1-CB 4.46Å; Y489-L506 HydrophobicContact CE1-CD1 4.16Å; Y489-L506 HydrophobicContact CE2-CB 4.24Å
490	T	95.4	Very high	91.3	Very high	58 Å²	58	60.6 Å²	60.6	36%	0.356	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	118.5	179	-54.6	0	0	0	0	110.5	N484 E501 Y509	N484-T490 PolarHBondContact ND2-OG1 2.74Å; N484-T490 VanDerWaalsContact ND2-OG1 3.08Å; T490-E501 CarbonylContact C-O 3.51Å; T490-Y509 VanDerWaalsContact O-CE2 3.32Å; T490-Y509 WeakPolarHBondContact O-CE2 3.44Å
491	L	94.6	Very high	91.6	Very high	5 Å²	5	60 Å²	60	3%	0.026	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-62.5	145.2	175.7	-68.2	170.5	0	0	0	111.1	P30 P32 Y489 E501 V503 Y509 M513	P30-L491 HydrophobicContact CG-CD1 4.2Å; P32-L491 HydrophobicContact CG-CB 4.32Å; P32-L491 HydrophobicContact CG-CD1 4.16Å; Y489-L491 PolarHBondContact O-N 3.23Å; L491-E501 HydrophobicContact CB-CB 4.4Å; L491-E501 HydrophobicContact CD1-CB 3.98Å; L491-E501 PolarHBondContact N-O 3.11Å; L491-V503 HydrophobicContact CD1-CG1 3.9Å; L491-V503 HydrophobicContact CD2-CG1 4.04Å; L491-V503 HydrophobicContact CD2-CG2 4.31Å; L491-V503 HydrophobicContact CG-CG1 4.03Å; L491-Y509 HydrophobicContact CD2-CD2 4.16Å; L491-M513 HydrophobicContact CD2-CE 4Å
492	P	91.3	Very high	91.8	Very high	40 Å²	40	59.1 Å²	59.1	26%	0.26	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-67.5	148.7	178.9	29.7	-35.9	0	0	0	111.5	M513 I518	P492-M513 HydrophobicContact CG-CE 3.45Å; P492-M513 VanDerWaalsContact CG-CE 3.45Å; P492-M513 HydrophobicContact CG-SD 3.61Å; P492-I518 HydrophobicContact CG-CD1 4.25Å; P492-I518 HydrophobicContact CG-CG2 3.81Å
493	R	90.3	Very high	92	Very high	107 Å²	107	50.7 Å²	50.7	40%	0.404	30%	0.3	S	S	.	.			trans	-137.9	137.5	173.7	56.7	-176	174.2	175.9	-0	110.1	E34 D495 A496 Y498	E34-R493 WeakPolarHBondContact OE1-CA 3.35Å; R493-D495 VanDerWaalsContact C-N 3.3Å; R493-D495 WeakPolarHBondContact CD-O 3.48Å; R493-A496 PolarHBondContact NH1-O 2.96Å; R493-Y498 VanDerWaalsContact CD-O 3.31Å; R493-Y498 WeakPolarHBondContact CD-O 3.45Å; R493-Y498 PolarHBondContact NH1-O 3.21Å
494	S	84.7	Confident	92	Very high	69 Å²	69	50.6 Å²	50.6	48%	0.483	30%	0.299	S	S	.	.	S	Bend	trans	-74.2	-21.1	179.2	66.4	0	0	0	0	113.8	E34	E34-S494 VanDerWaalsContact CD-N 3.33Å; E34-S494 PolarHBondContact OE1-N 3.23Å; E34-S494 WeakPolarHBondContact OE2-CB 3.27Å; E34-S494 PolarHBondContact OE2-N 2.95Å; E34-S494 PolarHBondContact OE2-OG 3.24Å
495	D	86	Confident	92	Very high	75 Å²	75	51.5 Å²	51.5	40%	0.401	30%	0.304	S	S	.	.	S	Bend	trans	-131.3	135.4	-179.8	-164.6	-51.8	0	0	0	110	R493 S497 Y498	R493-D495 VanDerWaalsContact C-N 3.3Å; R493-D495 WeakPolarHBondContact CD-O 3.48Å; D495-S497 PolarHBondContact O-N 3.07Å; D495-S497 VanDerWaalsContact OD1-CB 3.29Å; D495-S497 WeakPolarHBondContact OD1-CB 3.32Å; D495-S497 PolarHBondContact OD1-N 2.94Å; D495-S497 PolarHBondContact OD1-OG 3.44Å; D495-Y498 HydrophobicContact CB-CD1 3.97Å; D495-Y498 HydrophobicContact CB-CD2 4.07Å; D495-Y498 HydrophobicContact CB-CE1 4.03Å; D495-Y498 HydrophobicContact CB-CE2 4.12Å; D495-Y498 HydrophobicContact CB-CG 4.03Å; D495-Y498 WeakPolarHBondContact O-CB 3.4Å; D495-Y498 PolarHBondContact O-N 2.86Å; D495-Y498 VanDerWaalsContact O-N 3.14Å
496	A	89.6	Confident	92.1	Very high	83 Å²	83	43.4 Å²	43.4	69%	0.686	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-21	179.9	0	0	0	0	0	113.1	R493 Y498	R493-A496 PolarHBondContact NH1-O 2.96Å; A496-Y498 PolarHBondContact O-N 3.33Å
497	S	89.7	Confident	92.4	Very high	42 Å²	42	39.5 Å²	39.5	29%	0.294	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-18.1	173.7	64.1	0	0	0	0	113.5	D495	D495-S497 PolarHBondContact O-N 3.07Å; D495-S497 VanDerWaalsContact OD1-CB 3.29Å; D495-S497 WeakPolarHBondContact OD1-CB 3.32Å; D495-S497 PolarHBondContact OD1-N 2.94Å; D495-S497 PolarHBondContact OD1-OG 3.44Å
498	Y	93.1	Very high	92.5	Very high	26 Å²	26	39 Å²	39	10%	0.102	23%	0.226	C	C	.	.	S	Bend	trans	-73.3	141.6	177.6	-66.2	-3.7	0	0	0	110	E34 F39 L62 R493 D495 A496	E34-Y498 HydrophobicContact CB-CD2 3.58Å; E34-Y498 HydrophobicContact CB-CE2 3.5Å; E34-Y498 VanDerWaalsContact CB-CE2 3.5Å; E34-Y498 HydrophobicContact CG-CD2 4.41Å; E34-Y498 WeakPolarHBondContact OE2-CD2 3.46Å; E34-Y498 WeakPolarHBondContact OE2-CE2 3.2Å; F39-Y498 HydrophobicContact CE1-CE1 4.37Å; F39-Y498 HydrophobicContact CE1-CE2 4.32Å; F39-Y498 HydrophobicContact CZ-CE1 4.29Å; L62-Y498 HydrophobicContact CD1-CD1 3.38Å; L62-Y498 HydrophobicContact CD1-CE1 3.85Å; L62-Y498 HydrophobicContact CD1-CG 4.37Å; R493-Y498 VanDerWaalsContact CD-O 3.31Å; R493-Y498 WeakPolarHBondContact CD-O 3.45Å; R493-Y498 PolarHBondContact NH1-O 3.21Å; D495-Y498 HydrophobicContact CB-CD1 3.97Å; D495-Y498 HydrophobicContact CB-CD2 4.07Å; D495-Y498 HydrophobicContact CB-CE1 4.03Å; D495-Y498 HydrophobicContact CB-CE2 4.12Å; D495-Y498 HydrophobicContact CB-CG 4.03Å; D495-Y498 WeakPolarHBondContact O-CB 3.4Å; D495-Y498 PolarHBondContact O-N 2.86Å; D495-Y498 VanDerWaalsContact O-N 3.14Å; A496-Y498 PolarHBondContact O-N 3.33Å
499	P	93.4	Very high	92.5	Very high	15 Å²	15	38.5 Å²	38.5	10%	0.097	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-61.9	138.8	-174.3	30.2	-39.6	0	0	0	110.9	V33 P70 Y94 I108 E501	V33-P499 HydrophobicContact CG1-CG 3.83Å; P70-P499 HydrophobicContact CB-CG 4.41Å; P70-P499 HydrophobicContact CG-CB 3.69Å; P70-P499 HydrophobicContact CG-CG 3.61Å; Y94-P499 HydrophobicContact CE1-CB 4.22Å; Y94-P499 WeakPolarHBondContact OH-CB 3.17Å; I108-P499 HydrophobicContact CD1-CB 4.38Å; I108-P499 HydrophobicContact CD1-CG 3.65Å; P499-E501 PolarHBondContact O-N 3.49Å
500	P	95	Very high	92.5	Very high	36 Å²	36	36.4 Å²	36.4	23%	0.234	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-74.1	124.1	-179.6	29.2	-32.1	0	0	0	110.5	Y94	Y94-P500 VanDerWaalsContact OH-C 3.32Å; Y94-P500 PolarHBondContact OH-O 3.37Å
501	E	96.3	Very high	92.3	Very high	7 Å²	7	33.6 Å²	33.6	3%	0.033	20%	0.197	C	C	.	.			trans	-113.8	145.9	179.1	-64.7	176.2	99.8	0	0	110.2	P32 V33 Y94 S107 I108 T490 L491 P499	P32-E501 VanDerWaalsContact CA-OE2 3.29Å; P32-E501 WeakPolarHBondContact CA-OE2 3.44Å; V33-E501 WeakPolarHBondContact CB-OE2 3.17Å; V33-E501 PolarHBondContact N-OE2 2.95Å; Y94-E501 HydrophobicContact CE2-CG 4.15Å; S107-E501 WeakPolarHBondContact CA-OE1 3.28Å; S107-E501 WeakPolarHBondContact CB-OE1 3.44Å; S107-E501 PolarHBondContact OG-OE1 2.83Å; I108-E501 PolarHBondContact N-OE1 3.34Å; T490-E501 CarbonylContact C-O 3.51Å; L491-E501 HydrophobicContact CB-CB 4.4Å; L491-E501 HydrophobicContact CD1-CB 3.98Å; L491-E501 PolarHBondContact N-O 3.11Å; P499-E501 PolarHBondContact O-N 3.49Å
502	E	96.1	Very high	92.2	Very high	9 Å²	9	33.4 Å²	33.4	4%	0.042	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	156.6	-175.2	-55.8	88.5	-177	0	0	112.4	R88 R106 M488 Y489	R88-E502 IonicContact CZ-OE1 3.55Å; R88-E502 IonicContact NH2-OE1 3.67Å; R88-E502 PolarHBondContact NH2-OE1 2.8Å; R88-E502 IonicContact NH2-OE2 3.78Å; R106-E502 HydrophobicContact CB-CB 4.36Å; R106-E502 WeakPolarHBondContact CB-O 3.49Å; R106-E502 PolarHBondContact O-N 2.72Å; M488-E502 HydrophobicContact CB-CB 3.92Å; M488-E502 HydrophobicContact CB-CG 4.4Å; Y489-E502 CarbonylContact O-C 3.48Å; Y489-E502 WeakPolarHBondContact O-CA 3.42Å
503	V	94.9	Very high	92.3	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	153.8	173.2	-64.8	0	0	0	0	111.6	P30 Y489 L491 E508 Y509	P30-V503 HydrophobicContact CG-CG1 3.32Å; Y489-V503 PolarHBondContact N-O 3.36Å; Y489-V503 PolarHBondContact O-N 2.93Å; L491-V503 HydrophobicContact CD1-CG1 3.9Å; L491-V503 HydrophobicContact CD2-CG1 4.04Å; L491-V503 HydrophobicContact CD2-CG2 4.31Å; L491-V503 HydrophobicContact CG-CG1 4.03Å; V503-E508 HydrophobicContact CB-CB 3.64Å; V503-E508 HydrophobicContact CG1-CB 4.06Å; V503-E508 HydrophobicContact CG2-CB 3.94Å; V503-Y509 HydrophobicContact CG2-CD2 4.39Å
504	S	91.2	Very high	92.3	Very high	62 Å²	62	26.5 Å²	26.5	43%	0.434	17%	0.165	S	C	.	.	S	Bend	trans	-78	-24.1	-166.7	78.5	0	0	0	0	114.5	E508	S504-E508 PolarHBondContact OG-OE1 2.85Å
505	N	91.9	Very high	92.4	Very high	59 Å²	59	23.3 Å²	23.3	32%	0.316	14%	0.142	S	C	.	.	S	Bend	trans	-148.1	168.3	-174.7	63.4	69.2	0	0	0	111.5	Y489 D507 E508 Y509	Y489-N505 VanDerWaalsContact CD2-C 3.43Å; Y489-N505 VanDerWaalsContact CE2-C 3.49Å; N505-D507 PolarHBondContact O-N 3.21Å; N505-D507 WeakPolarHBondContact OD1-CB 3.34Å; N505-D507 PolarHBondContact OD1-N 3.06Å; N505-D507 VanDerWaalsContact OD1-N 3.09Å; N505-E508 PolarHBondContact ND2-OE1 3.2Å; N505-E508 PolarHBondContact O-N 2.99Å; N505-E508 PolarHBondContact OD1-N 3.06Å; N505-Y509 PolarHBondContact O-N 3.1Å
506	L	91.8	Very high	92.5	Very high	6 Å²	6	20.4 Å²	20.4	3%	0.031	13%	0.126	C	C	.	.	H	α-helix	trans	-68.7	-32.1	-176.9	-177.9	63.8	0	0	0	113.4	M430 L457 L465 P481 Y489 Y509 V510	M430-L506 HydrophobicContact CG-CD2 4.13Å; M430-L506 HydrophobicContact SD-CD2 4.46Å; L457-L506 HydrophobicContact CD1-CD2 4.08Å; L457-L506 HydrophobicContact CD2-CD2 4.24Å; L465-L506 HydrophobicContact CD2-CD2 3.06Å; L465-L506 HydrophobicContact CG-CD2 4.43Å; P481-L506 HydrophobicContact CG-CD1 3.59Å; Y489-L506 HydrophobicContact CD1-CD1 4.46Å; Y489-L506 HydrophobicContact CE1-CB 4.46Å; Y489-L506 HydrophobicContact CE1-CD1 4.16Å; Y489-L506 HydrophobicContact CE2-CB 4.24Å; L506-Y509 PolarHBondContact O-N 2.86Å; L506-V510 HydrophobicContact CD1-CG2 3.92Å; L506-V510 HydrophobicContact CG-CG2 4.03Å; L506-V510 WeakPolarHBondContact O-CB 3.29Å; L506-V510 WeakPolarHBondContact O-CG2 3.49Å; L506-V510 PolarHBondContact O-N 3.01Å
507	D	94.2	Very high	92.4	Very high	7 Å²	7	16.5 Å²	16.5	4%	0.037	9%	0.094	C	C	.	.	H	α-helix	trans	-63.7	-46.5	178	-178.6	44.9	0	0	0	110	L424 E425 L433 Y435 N505 Y509 V510 K511	L424-D507 VanDerWaalsContact CA-OD2 3.25Å; L424-D507 WeakPolarHBondContact CA-OD2 3.49Å; E425-D507 PolarHBondContact N-OD2 2.87Å; L433-D507 HydrophobicContact CD1-CB 4.2Å; L433-D507 HydrophobicContact CD2-CB 3.78Å; Y435-D507 PolarHBondContact OH-OD1 3.13Å; N505-D507 PolarHBondContact O-N 3.21Å; N505-D507 WeakPolarHBondContact OD1-CB 3.34Å; N505-D507 PolarHBondContact OD1-N 3.06Å; N505-D507 VanDerWaalsContact OD1-N 3.09Å; D507-Y509 VanDerWaalsContact C-N 3.28Å; D507-Y509 PolarHBondContact O-N 3.45Å; D507-V510 PolarHBondContact O-N 3.31Å; D507-K511 WeakPolarHBondContact O-CB 3.22Å; D507-K511 WeakPolarHBondContact O-CG 3.46Å; D507-K511 PolarHBondContact O-N 3.36Å; D507-K511 WeakPolarHBondContact OD1-CE 3.35Å; D507-K511 WeakPolarHBondContact OD1-CG 3.3Å
508	E	93.6	Very high	92.4	Very high	35 Å²	35	14.7 Å²	14.7	16%	0.164	8%	0.081	C	C	.	.	H	α-helix	trans	-54.6	-44.3	172.2	-75.2	-178	-117.4	0	0	112.4	L424 V503 S504 N505 S512	L424-E508 HydrophobicContact CD1-CG 3.71Å; L424-E508 HydrophobicContact CD2-CB 4.3Å; L424-E508 HydrophobicContact CD2-CG 3.86Å; L424-E508 HydrophobicContact CG-CG 4.44Å; V503-E508 HydrophobicContact CB-CB 3.64Å; V503-E508 HydrophobicContact CG1-CB 4.06Å; V503-E508 HydrophobicContact CG2-CB 3.94Å; S504-E508 PolarHBondContact OG-OE1 2.85Å; N505-E508 PolarHBondContact ND2-OE1 3.2Å; N505-E508 PolarHBondContact O-N 2.99Å; N505-E508 PolarHBondContact OD1-N 3.06Å; E508-S512 VanDerWaalsContact O-CB 3.32Å; E508-S512 WeakPolarHBondContact O-CB 3.32Å; E508-S512 PolarHBondContact O-N 3.25Å; E508-S512 PolarHBondContact O-OG 3.05Å
509	Y	94.4	Very high	92.3	Very high	21 Å²	21	14.7 Å²	14.7	8%	0.082	8%	0.084	C	C	.	.	H	α-helix	trans	-63.1	-53.7	178.4	-176.6	-80.3	0	0	0	111.2	P481 T490 L491 V503 N505 L506 D507 K511 S512 M513 W520	P481-Y509 HydrophobicContact CB-CD1 4.47Å; P481-Y509 HydrophobicContact CB-CE1 4.16Å; P481-Y509 HydrophobicContact CB-CE2 4.3Å; P481-Y509 HydrophobicContact CG-CD1 3.54Å; P481-Y509 HydrophobicContact CG-CD2 4.29Å; P481-Y509 HydrophobicContact CG-CE1 3.6Å; P481-Y509 HydrophobicContact CG-CE2 4.3Å; P481-Y509 HydrophobicContact CG-CG 3.91Å; T490-Y509 VanDerWaalsContact O-CE2 3.32Å; T490-Y509 WeakPolarHBondContact O-CE2 3.44Å; L491-Y509 HydrophobicContact CD2-CD2 4.16Å; V503-Y509 HydrophobicContact CG2-CD2 4.39Å; N505-Y509 PolarHBondContact O-N 3.1Å; L506-Y509 PolarHBondContact O-N 2.86Å; D507-Y509 VanDerWaalsContact C-N 3.28Å; D507-Y509 PolarHBondContact O-N 3.45Å; Y509-K511 VanDerWaalsContact C-N 3.35Å; Y509-K511 PolarHBondContact O-N 2.51Å; Y509-S512 WeakPolarHBondContact O-CB 3.16Å; Y509-S512 PolarHBondContact O-N 2.68Å; Y509-M513 HydrophobicContact CD1-CG 4.1Å; Y509-M513 HydrophobicContact CE1-CE 4.18Å; Y509-M513 HydrophobicContact CE1-CG 3.74Å; Y509-M513 HydrophobicContact CE1-SD 4.13Å; Y509-M513 HydrophobicContact CE2-CE 4.33Å; Y509-M513 WeakPolarHBondContact O-CG 3.24Å; Y509-M513 PolarHBondContact O-N 3.3Å; Y509-W520 AromaticContact CD1-CH2 3.94Å; Y509-W520 HydrophobicContact CD1-CH2 3.94Å; Y509-W520 AromaticContact CD1-CZ3 3.93Å; Y509-W520 HydrophobicContact CD1-CZ3 3.93Å; Y509-W520 HydrophobicContact CE1-CE3 4.08Å; Y509-W520 AromaticContact CE1-CH2 3.4Å; Y509-W520 HydrophobicContact CE1-CH2 3.4Å; Y509-W520 VanDerWaalsContact CE1-CH2 3.4Å; Y509-W520 HydrophobicContact CE1-CZ2 4.05Å; Y509-W520 AromaticContact CE1-CZ3 3.44Å; Y509-W520 HydrophobicContact CE1-CZ3 3.44Å; Y509-W520 VanDerWaalsContact CE1-CZ3 3.44Å
510	V	94.4	Very high	92.2	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-62.3	-43.7	-177.2	169.4	0	0	0	0	110.5	Y435 Y455 I467 L506 D507 S512 M513 V514 W520 L525	Y435-V510 HydrophobicContact CE2-CG1 4.29Å; Y455-V510 HydrophobicContact CD2-CG1 4.41Å; Y455-V510 HydrophobicContact CE2-CG1 3.51Å; I467-V510 HydrophobicContact CD1-CG2 4.2Å; L506-V510 HydrophobicContact CD1-CG2 3.92Å; L506-V510 HydrophobicContact CG-CG2 4.03Å; L506-V510 WeakPolarHBondContact O-CB 3.29Å; L506-V510 WeakPolarHBondContact O-CG2 3.49Å; L506-V510 PolarHBondContact O-N 3.01Å; D507-V510 PolarHBondContact O-N 3.31Å; V510-S512 VanDerWaalsContact C-N 3.35Å; V510-M513 WeakPolarHBondContact O-CB 3.18Å; V510-M513 PolarHBondContact O-N 3.05Å; V510-M513 VanDerWaalsContact O-N 3.12Å; V510-V514 WeakPolarHBondContact O-CG2 3.43Å; V510-V514 PolarHBondContact O-N 3.43Å; V510-W520 HydrophobicContact CG2-CZ3 4.45Å; V510-L525 HydrophobicContact CG1-CD1 4Å
511	K	92.5	Very high	91.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-67.5	-35.3	177.8	-64.3	-77.2	-179.9	149.3	0	111	P29 R420 H421 L423 L424 D507 Y509 M513 V514 V515	P29-K511 HydrophobicContact CB-CB 3.93Å; P29-K511 HydrophobicContact CG-CB 3.75Å; R420-K511 PolarHBondContact O-NZ 2.6Å; H421-K511 VanDerWaalsContact O-CD 3.31Å; H421-K511 WeakPolarHBondContact O-CD 3.39Å; H421-K511 PolarHBondContact O-NZ 3.26Å; L423-K511 VanDerWaalsContact O-CE 3.31Å; L423-K511 WeakPolarHBondContact O-CE 3.29Å; L423-K511 PolarHBondContact O-NZ 2.93Å; L424-K511 HydrophobicContact CD2-CB 3.84Å; L424-K511 HydrophobicContact CD2-CG 4Å; D507-K511 WeakPolarHBondContact O-CB 3.22Å; D507-K511 WeakPolarHBondContact O-CG 3.46Å; D507-K511 PolarHBondContact O-N 3.36Å; D507-K511 WeakPolarHBondContact OD1-CE 3.35Å; D507-K511 WeakPolarHBondContact OD1-CG 3.3Å; Y509-K511 VanDerWaalsContact C-N 3.35Å; Y509-K511 PolarHBondContact O-N 2.51Å; K511-M513 VanDerWaalsContact C-N 3.27Å; K511-M513 PolarHBondContact O-N 2.98Å; K511-V514 PolarHBondContact O-N 3.47Å; K511-V515 WeakPolarHBondContact O-CB 3.41Å; K511-V515 VanDerWaalsContact O-CG2 3.23Å; K511-V515 WeakPolarHBondContact O-CG2 3.39Å; K511-V515 PolarHBondContact O-N 3.12Å
512	S	91.9	Very high	91.5	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-57.7	-43.5	170.1	-58.3	0	0	0	0	110.9	P29 P30 E508 Y509 V510 V514 H516	P29-S512 WeakPolarHBondContact CB-OG 3.06Å; P30-S512 PolarHBondContact O-OG 2.97Å; E508-S512 VanDerWaalsContact O-CB 3.32Å; E508-S512 WeakPolarHBondContact O-CB 3.32Å; E508-S512 PolarHBondContact O-N 3.25Å; E508-S512 PolarHBondContact O-OG 3.05Å; Y509-S512 WeakPolarHBondContact O-CB 3.16Å; Y509-S512 PolarHBondContact O-N 2.68Å; V510-S512 VanDerWaalsContact C-N 3.35Å; S512-V514 PolarHBondContact O-N 3.14Å; S512-H516 PolarHBondContact O-CD2 3.4Å; S512-H516 VanDerWaalsContact O-CD2 3.25Å; S512-H516 PolarHBondContact O-N 3.48Å; S512-H516 VanDerWaalsContact O-N 3.08Å
513	M	92.7	Very high	91.4	Very high	2 Å²	2	20.5 Å²	20.5	1%	0.01	10%	0.102	C	C	.	.	H	α-helix	trans	-63.5	-42.9	176.9	-58.8	-53	106.1	0	0	111.5	L491 P492 Y509 V510 K511 Q517 I518 W520 L525	L491-M513 HydrophobicContact CD2-CE 4Å; P492-M513 HydrophobicContact CG-CE 3.45Å; P492-M513 VanDerWaalsContact CG-CE 3.45Å; P492-M513 HydrophobicContact CG-SD 3.61Å; Y509-M513 HydrophobicContact CD1-CG 4.1Å; Y509-M513 HydrophobicContact CE1-CE 4.18Å; Y509-M513 HydrophobicContact CE1-CG 3.74Å; Y509-M513 HydrophobicContact CE1-SD 4.13Å; Y509-M513 HydrophobicContact CE2-CE 4.33Å; Y509-M513 WeakPolarHBondContact O-CG 3.24Å; Y509-M513 PolarHBondContact O-N 3.3Å; V510-M513 WeakPolarHBondContact O-CB 3.18Å; V510-M513 PolarHBondContact O-N 3.05Å; V510-M513 VanDerWaalsContact O-N 3.12Å; K511-M513 VanDerWaalsContact C-N 3.27Å; K511-M513 PolarHBondContact O-N 2.98Å; M513-Q517 CarbonylContact O-C 3.57Å; M513-Q517 WeakPolarHBondContact O-CA 3.41Å; M513-Q517 PolarHBondContact O-N 3.08Å; M513-I518 HydrophobicContact CE-CD1 3.76Å; M513-I518 PolarHBondContact O-N 3.07Å; M513-I518 HydrophobicContact SD-CB 3.71Å; M513-I518 HydrophobicContact SD-CD1 4.04Å; M513-I518 HydrophobicContact SD-CG1 4.42Å; M513-I518 HydrophobicContact SD-CG2 3.84Å; M513-W520 HydrophobicContact CG-CE3 3.92Å; M513-W520 HydrophobicContact CG-CZ3 4.15Å; M513-L525 HydrophobicContact CB-CD1 4.3Å
514	V	91.3	Very high	91.3	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-64	-53.6	177.7	173	0	0	0	0	111	L11 Y455 V510 K511 S512 H516 Q517 L525 R526	L11-V514 WeakPolarHBondContact CD1-O 3.44Å; Y455-V514 HydrophobicContact CD1-CG2 4.35Å; Y455-V514 HydrophobicContact CE1-CG2 3.41Å; Y455-V514 VanDerWaalsContact CE1-CG2 3.41Å; Y455-V514 WeakPolarHBondContact OH-CG2 3.21Å; V510-V514 WeakPolarHBondContact O-CG2 3.43Å; V510-V514 PolarHBondContact O-N 3.43Å; K511-V514 PolarHBondContact O-N 3.47Å; S512-V514 PolarHBondContact O-N 3.14Å; V514-H516 VanDerWaalsContact C-N 3.34Å; V514-H516 PolarHBondContact O-N 3.27Å; V514-Q517 PolarHBondContact O-N 3.49Å; V514-Q517 VanDerWaalsContact O-N 3.14Å; V514-Q517 PolarHBondContact O-NE2 3.43Å; V514-L525 WeakPolarHBondContact CA-O 3.38Å; V514-L525 HydrophobicContact CG2-CB 3.55Å; V514-R526 WeakPolarHBondContact CG1-O 3.32Å
515	V	87.4	Confident	91.4	Very high	2 Å²	2	17.5 Å²	17.5	1%	0.012	8%	0.081	C	C	.	.	H	α-helix	trans	-62.9	-43.6	-172.1	172.4	0	0	0	0	111.6	L11 V15 P29 V422 K511 Q517	L11-V515 VanDerWaalsContact CB-O 3.26Å; L11-V515 WeakPolarHBondContact CB-O 3.46Å; L11-V515 HydrophobicContact CD2-CB 4.07Å; L11-V515 HydrophobicContact CD2-CG1 3.98Å; L11-V515 HydrophobicContact CD2-CG2 3.99Å; V15-V515 HydrophobicContact CG2-CG1 3.85Å; P29-V515 HydrophobicContact CG-CB 4.03Å; P29-V515 HydrophobicContact CG-CG2 3.56Å; V422-V515 HydrophobicContact CB-CG2 3.65Å; V422-V515 HydrophobicContact CG1-CG2 4.39Å; K511-V515 WeakPolarHBondContact O-CB 3.41Å; K511-V515 VanDerWaalsContact O-CG2 3.23Å; K511-V515 WeakPolarHBondContact O-CG2 3.39Å; K511-V515 PolarHBondContact O-N 3.12Å; V515-Q517 VanDerWaalsContact C-N 3.31Å
516	H	86.6	Confident	91.3	Very high	14 Å²	14	17 Å²	17	7%	0.065	7%	0.074	C	C	.	.	H	α-helix	trans	-93.3	2.9	-178.5	-56	-62.9	0	0	0	112.6	R9 C31 S512 V514 I518	R9-H516 PolarHBondContact NH1-O 3.08Å; C31-H516 VanDerWaalsContact CA-NE2 3.27Å; C31-H516 WeakPolarHBondContact CA-NE2 3.09Å; C31-H516 WeakPolarHBondContact CB-CE1 3.31Å; C31-H516 WeakPolarHBondContact CB-NE2 3.4Å; C31-H516 PolarHBondContact SG-CE1 3.39Å; C31-H516 PolarHBondContact SG-ND1 3.2Å; C31-H516 VanDerWaalsContact SG-ND1 3.42Å; S512-H516 PolarHBondContact O-CD2 3.4Å; S512-H516 VanDerWaalsContact O-CD2 3.25Å; S512-H516 PolarHBondContact O-N 3.48Å; S512-H516 VanDerWaalsContact O-N 3.08Å; V514-H516 VanDerWaalsContact C-N 3.34Å; V514-H516 PolarHBondContact O-N 3.27Å; H516-I518 HydrophobicContact CB-CD1 3.89Å; H516-I518 HydrophobicContact CB-CG1 3.74Å; H516-I518 PolarHBondContact O-N 2.66Å
517	Q	88.8	Confident	91.2	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.009	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	35.9	-179.6	-65.9	-74.5	-62.8	0	0	111.8	L11 Q239 L246 R248 M513 V514 V515 V524 L525	L11-Q517 HydrophobicContact CD1-CG 4.02Å; Q239-Q517 HydrophobicContact CB-CG 4.29Å; Q239-Q517 HydrophobicContact CG-CG 4.5Å; L246-Q517 HydrophobicContact CD1-CB 4.2Å; R248-Q517 PolarHBondContact NH2-O 2.86Å; M513-Q517 CarbonylContact O-C 3.57Å; M513-Q517 WeakPolarHBondContact O-CA 3.41Å; M513-Q517 PolarHBondContact O-N 3.08Å; V514-Q517 PolarHBondContact O-N 3.49Å; V514-Q517 VanDerWaalsContact O-N 3.14Å; V514-Q517 PolarHBondContact O-NE2 3.43Å; V515-Q517 VanDerWaalsContact C-N 3.31Å; Q517-V524 HydrophobicContact CB-CG1 3.89Å; Q517-V524 HydrophobicContact CG-CG1 4.43Å; Q517-L525 PolarHBondContact NE2-O 2.96Å; Q517-L525 VanDerWaalsContact NE2-O 3.11Å
518	I	89.9	Confident	91.1	Very high	3 Å²	3	19.6 Å²	19.6	2%	0.015	8%	0.084	C	C	.	.			trans	-69.6	126.6	-170.7	-58.9	171.5	0	0	0	109.1	P32 Y35 P492 M513 H516 W520	P32-I518 HydrophobicContact CG-CD1 3.82Å; Y35-I518 HydrophobicContact CD2-CD1 3.65Å; Y35-I518 HydrophobicContact CD2-CG1 3.94Å; Y35-I518 HydrophobicContact CE2-CB 4.43Å; Y35-I518 HydrophobicContact CE2-CD1 3.44Å; Y35-I518 VanDerWaalsContact CE2-CD1 3.44Å; Y35-I518 HydrophobicContact CE2-CG1 3.49Å; Y35-I518 VanDerWaalsContact CE2-CG1 3.49Å; Y35-I518 HydrophobicContact CE2-CG2 4.16Å; P492-I518 HydrophobicContact CG-CD1 4.25Å; P492-I518 HydrophobicContact CG-CG2 3.81Å; M513-I518 HydrophobicContact CE-CD1 3.76Å; M513-I518 PolarHBondContact O-N 3.07Å; M513-I518 HydrophobicContact SD-CB 3.71Å; M513-I518 HydrophobicContact SD-CD1 4.04Å; M513-I518 HydrophobicContact SD-CG1 4.42Å; M513-I518 HydrophobicContact SD-CG2 3.84Å; H516-I518 HydrophobicContact CB-CD1 3.89Å; H516-I518 HydrophobicContact CB-CG1 3.74Å; H516-I518 PolarHBondContact O-N 2.66Å; I518-W520 PolarHBondContact O-N 2.83Å
519	P	90.6	Very high	91.1	Very high	27 Å²	27	18.2 Å²	18.2	18%	0.175	8%	0.077	C	C	.	.			trans	-63.3	125.5	176.9	-20.3	32.9	0	0	0	111	D172 W193 V523	D172-P519 HydrophobicContact CB-CG 4.22Å; W193-P519 HydrophobicContact CH2-CB 4.2Å; W193-P519 HydrophobicContact CH2-CG 3.8Å; W193-P519 HydrophobicContact CZ2-CB 4.34Å; W193-P519 HydrophobicContact CZ2-CG 4.42Å; W193-P519 HydrophobicContact CZ3-CG 4.18Å; P519-V523 CarbonylContact C-O 3.48Å; P519-V523 WeakPolarHBondContact CA-O 3.41Å
520	W	89.9	Confident	90.8	Very high	25 Å²	25	17.9 Å²	17.9	10%	0.095	8%	0.077	C	C	.	.	B	Isolated β-bridge	trans	-110.7	106.6	174.7	-169.4	-21.1	0	0	0	108.7	I467 L478 D479 P481 Y509 V510 M513 I518 G522 V523 L525	I467-W520 HydrophobicContact CD1-CE3 4.1Å; I467-W520 HydrophobicContact CD1-CH2 3.06Å; I467-W520 HydrophobicContact CD1-CZ2 3.84Å; I467-W520 HydrophobicContact CD1-CZ3 3.21Å; L478-W520 HydrophobicContact CD1-CB 4.21Å; L478-W520 HydrophobicContact CD1-CD2 4.14Å; L478-W520 HydrophobicContact CD1-CG 3.86Å; D479-W520 WeakPolarHBondContact O-CZ2 3.45Å; P481-W520 HydrophobicContact CB-CH2 4.42Å; P481-W520 HydrophobicContact CB-CZ2 4.3Å; P481-W520 HydrophobicContact CG-CH2 3.7Å; P481-W520 HydrophobicContact CG-CZ2 4.06Å; Y509-W520 AromaticContact CD1-CH2 3.94Å; Y509-W520 HydrophobicContact CD1-CH2 3.94Å; Y509-W520 AromaticContact CD1-CZ3 3.93Å; Y509-W520 HydrophobicContact CD1-CZ3 3.93Å; Y509-W520 HydrophobicContact CE1-CE3 4.08Å; Y509-W520 AromaticContact CE1-CH2 3.4Å; Y509-W520 HydrophobicContact CE1-CH2 3.4Å; Y509-W520 VanDerWaalsContact CE1-CH2 3.4Å; Y509-W520 HydrophobicContact CE1-CZ2 4.05Å; Y509-W520 AromaticContact CE1-CZ3 3.44Å; Y509-W520 HydrophobicContact CE1-CZ3 3.44Å; Y509-W520 VanDerWaalsContact CE1-CZ3 3.44Å; V510-W520 HydrophobicContact CG2-CZ3 4.45Å; M513-W520 HydrophobicContact CG-CE3 3.92Å; M513-W520 HydrophobicContact CG-CZ3 4.15Å; I518-W520 PolarHBondContact O-N 2.83Å; W520-G522 PolarHBondContact O-N 2.76Å; W520-G522 VanDerWaalsContact O-N 3.08Å; W520-V523 PolarHBondContact N-O 3.11Å; W520-V523 WeakPolarHBondContact O-CG2 2.95Å; W520-V523 PolarHBondContact O-N 2.94Å; W520-V523 VanDerWaalsContact O-N 3.12Å; W520-L525 HydrophobicContact CE3-CD1 4.05Å; W520-L525 HydrophobicContact CZ3-CD1 4.23Å
521	R	87.9	Confident	90.3	Very high	152 Å²	152	21.2 Å²	21.2	57%	0.574	9%	0.092	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.9	35.2	-176.5	-67.7	175.4	-179.1	179.9	4.8	112.6	L478 D479	L478-R521 HydrophobicContact CD2-CB 4.2Å; D479-R521 IonicContact OD2-CZ 2.83Å; D479-R521 IonicContact OD2-NH1 2.85Å; D479-R521 PolarHBondContact OD2-NH1 2.84Å; D479-R521 IonicContact OD2-NH2 3.11Å
522	G	89.7	Confident	89.1	Confident	7 Å²	7	25.6 Å²	25.6	7%	0.072	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	3.3	176.7	0	0	0	0	0	116.5	W193 W471 W520	W193-G522 PolarHBondContact NE1-O 3.25Å; W471-G522 PolarHBondContact NE1-O 2.65Å; W520-G522 PolarHBondContact O-N 2.76Å; W520-G522 VanDerWaalsContact O-N 3.08Å
523	V	94.2	Very high	87.6	Confident	5 Å²	5	27.6 Å²	27.6	3%	0.03	13%	0.128	C	C	.	.	B	Isolated β-bridge	trans	-115.9	162	172.7	-47	0	0	0	0	110.8	V469 W471 H476 L478 P519 W520	V469-V523 HydrophobicContact CG1-CB 4.22Å; V469-V523 HydrophobicContact CG1-CG2 3.47Å; V469-V523 VanDerWaalsContact CG1-CG2 3.47Å; W471-V523 HydrophobicContact CB-CB 3.79Å; W471-V523 HydrophobicContact CB-CG1 3.77Å; W471-V523 HydrophobicContact CD2-CB 4.34Å; W471-V523 HydrophobicContact CG-CB 3.76Å; W471-V523 HydrophobicContact CG-CG1 3.92Å; H476-V523 HydrophobicContact CB-CG1 4.23Å; L478-V523 HydrophobicContact CD1-CG2 3.63Å; L478-V523 HydrophobicContact CG-CG2 4.48Å; P519-V523 CarbonylContact C-O 3.48Å; P519-V523 WeakPolarHBondContact CA-O 3.41Å; W520-V523 PolarHBondContact N-O 3.11Å; W520-V523 WeakPolarHBondContact O-CG2 2.95Å; W520-V523 PolarHBondContact O-N 2.94Å; W520-V523 VanDerWaalsContact O-N 3.12Å
524	V	93.2	Very high	85.8	Confident	0 Å²	0	31 Å²	31	0%	0	15%	0.145	C	C	.	.			trans	-127.6	128.8	179.9	-178.4	0	0	0	0	110.5	W193 L246 G453 W471 Q517 R526	W193-V524 HydrophobicContact CH2-CG2 3.67Å; W193-V524 HydrophobicContact CZ2-CG2 3.8Å; L246-V524 HydrophobicContact CD1-CB 4.29Å; L246-V524 HydrophobicContact CD1-CG1 4.08Å; L246-V524 HydrophobicContact CD1-CG2 3.72Å; L246-V524 HydrophobicContact CG-CG2 4.3Å; G453-V524 VanDerWaalsContact CA-O 3.29Å; G453-V524 WeakPolarHBondContact CA-O 3.4Å; W471-V524 HydrophobicContact CE3-CB 4.33Å; W471-V524 HydrophobicContact CH2-CB 3.65Å; W471-V524 HydrophobicContact CH2-CG2 3.88Å; W471-V524 HydrophobicContact CZ2-CB 4.24Å; W471-V524 HydrophobicContact CZ2-CG2 4.05Å; W471-V524 HydrophobicContact CZ3-CB 3.72Å; W471-V524 HydrophobicContact CZ3-CG2 4.42Å; Q517-V524 HydrophobicContact CB-CG1 3.89Å; Q517-V524 HydrophobicContact CG-CG1 4.43Å; V524-R526 HydrophobicContact CG1-CG 4.24Å
525	L	93.3	Very high	83.6	Confident	1 Å²	1	37 Å²	37	1%	0.005	18%	0.182	C	C	.	.			trans	-81.1	135.2	174.8	-48.7	-174.9	0	0	0	109.3	Y455 I467 V469 V510 M513 V514 Q517 W520	Y455-L525 HydrophobicContact CD1-CB 3.83Å; Y455-L525 HydrophobicContact CD1-CD2 4.47Å; Y455-L525 HydrophobicContact CD2-CD1 4.41Å; Y455-L525 HydrophobicContact CE1-CB 4.1Å; Y455-L525 HydrophobicContact CG-CB 4.22Å; Y455-L525 HydrophobicContact CG-CD2 4.06Å; Y455-L525 HydrophobicContact CG-CG 4.49Å; I467-L525 HydrophobicContact CG2-CD1 4.26Å; I467-L525 HydrophobicContact CG2-CD2 3.94Å; V469-L525 HydrophobicContact CB-CD2 3.79Å; V469-L525 HydrophobicContact CG1-CD2 4.08Å; V469-L525 HydrophobicContact CG2-CD2 3.77Å; V510-L525 HydrophobicContact CG1-CD1 4Å; M513-L525 HydrophobicContact CB-CD1 4.3Å; V514-L525 WeakPolarHBondContact CA-O 3.38Å; V514-L525 HydrophobicContact CG2-CB 3.55Å; Q517-L525 PolarHBondContact NE2-O 2.96Å; Q517-L525 VanDerWaalsContact NE2-O 3.11Å; W520-L525 HydrophobicContact CE3-CD1 4.05Å; W520-L525 HydrophobicContact CZ3-CD1 4.23Å
526	R	89.7	Confident	81.1	Confident	47 Å²	47	42.8 Å²	42.8	18%	0.177	22%	0.217	C	C	.	.			trans	-133.9	-46.3	-177	-55	-172.5	75.5	-151.6	2.9	112.8	Q239 P241 G453 V514 V524	Q239-R526 PolarHBondContact O-NH2 3.41Å; P241-R526 VanDerWaalsContact CD-NH1 3.31Å; G453-R526 PolarHBondContact O-N 3.41Å; V514-R526 WeakPolarHBondContact CG1-O 3.32Å; V524-R526 HydrophobicContact CG1-CG 4.24Å
527	R	89.5	Confident	78.6	Confident	67 Å²	67	46.5 Å²	46.5	25%	0.253	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	113.9	-172	-169.4	174	64	179.1	2.5	111.3	H421 Q451 G453 D454 Y455 I529	H421-R527 WeakPolarHBondContact CE1-CG 3.41Å; Q451-R527 VanDerWaalsContact OE1-NH1 3.07Å; G453-R527 PolarHBondContact O-N 2.93Å; D454-R527 WeakPolarHBondContact CA-O 3.45Å; D454-R527 IonicContact OD1-CZ 2.61Å; D454-R527 IonicContact OD1-NE 3.58Å; D454-R527 PolarHBondContact OD1-NE 3.2Å; D454-R527 IonicContact OD1-NH2 3.71Å; D454-R527 PolarHBondContact OD1-NH2 3.11Å; D454-R527 IonicContact OD2-CZ 3.83Å; D454-R527 IonicContact OD2-NE 3.67Å; D454-R527 IonicContact OD2-NH2 2.84Å; D454-R527 PolarHBondContact OD2-NH2 2.85Å; Y455-R527 VanDerWaalsContact CD1-C 3.46Å; Y455-R527 VanDerWaalsContact CD1-O 3.29Å; Y455-R527 WeakPolarHBondContact CD1-O 3.5Å; Y455-R527 VanDerWaalsContact CE1-C 3.44Å; Y455-R527 PolarHBondContact N-O 3.19Å; R527-I529 PolarHBondContact O-N 3.34Å
528	A	91.9	Very high	78.1	Confident	2 Å²	2	48.8 Å²	48.8	2%	0.017	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	124	172.9	0	0	0	0	0	109.9	H421 Y435 Y455	H421-A528 PolarHBondContact CE1-O 2.93Å; H421-A528 PolarHBondContact ND1-N 3.3Å; H421-A528 PolarHBondContact ND1-O 2.97Å; Y435-A528 HydrophobicContact CD1-CB 4.11Å; Y435-A528 HydrophobicContact CG-CB 3.95Å; Y455-A528 HydrophobicContact CE1-CB 3.93Å; Y455-A528 VanDerWaalsContact CE1-N 3.25Å; Y455-A528 HydrophobicContact CE2-CB 4.25Å; Y455-A528 WeakPolarHBondContact OH-CB 3.21Å
529	I	93.1	Very high	77.5	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.026	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-87.6	122.3	172.1	-58.6	-52.1	0	0	0	108.5	Y435 Y437 L448 L449 D454 Y455 L456 R527 E533	Y435-I529 VanDerWaalsContact CA-O 3.3Å; Y435-I529 WeakPolarHBondContact CA-O 3.3Å; Y435-I529 WeakPolarHBondContact CB-O 3.44Å; Y437-I529 WeakPolarHBondContact CE2-O 3.33Å; Y437-I529 PolarHBondContact OH-O 3.27Å; L448-I529 HydrophobicContact CB-CG2 4.26Å; L449-I529 HydrophobicContact CD2-CG1 3.88Å; D454-I529 HydrophobicContact CB-CD1 4.05Å; D454-I529 HydrophobicContact CB-CG1 3.98Å; Y455-I529 PolarHBondContact O-N 3.1Å; L456-I529 HydrophobicContact CB-CB 4.5Å; R527-I529 PolarHBondContact O-N 3.34Å; I529-E533 WeakPolarHBondContact CG2-OE2 3.29Å
530	T	89	Confident	76.7	Confident	14 Å²	14	52.5 Å²	52.5	9%	0.086	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-102.8	150.8	-169.4	60.4	0	0	0	0	112	M434 Y437 T532 E533	M434-T530 HydrophobicContact CB-CG2 4.12Å; M434-T530 CarbonylContact O-C 3.54Å; M434-T530 WeakPolarHBondContact O-CA 3.25Å; Y437-T530 PolarHBondContact OH-O 2.85Å; T530-T532 PolarHBondContact O-N 2.98Å; T530-T532 PolarHBondContact OG1-OG1 3.39Å; T530-T532 VanDerWaalsContact OG1-OG1 3.05Å; T530-E533 PolarHBondContact N-OE2 2.63Å; T530-E533 WeakPolarHBondContact O-CB 3.26Å; T530-E533 PolarHBondContact O-N 3.15Å
531	K	83	Confident	76	Confident	71 Å²	71	54.1 Å²	54.1	31%	0.309	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-50	-32.9	180	-73.2	159.6	-179.1	161.8	0	113.2	Q431 L433 M434 C436 Y437 E533 I534	Q431-K531 PolarHBondContact O-NZ 2.81Å; L433-K531 PolarHBondContact O-NZ 3.31Å; M434-K531 VanDerWaalsContact O-CG 3.29Å; M434-K531 WeakPolarHBondContact O-CG 3.27Å; M434-K531 PolarHBondContact O-N 2.86Å; C436-K531 WeakPolarHBondContact O-CE 3.24Å; C436-K531 PolarHBondContact O-NZ 3.48Å; Y437-K531 HydrophobicContact CD1-CG 4.09Å; Y437-K531 HydrophobicContact CE1-CB 4.29Å; Y437-K531 HydrophobicContact CE1-CG 3.74Å; Y437-K531 WeakPolarHBondContact OH-CA 3.47Å; Y437-K531 PolarHBondContact OH-N 3.26Å; K531-E533 VanDerWaalsContact C-N 3.28Å; K531-E533 PolarHBondContact O-N 3.18Å; K531-I534 WeakPolarHBondContact O-CB 3.17Å; K531-I534 PolarHBondContact O-N 3.48Å
532	T	68.1	Low	75.2	Confident	91 Å²	91	48 Å²	48	56%	0.558	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-66.2	-25.7	177.7	45.5	0	0	0	0	113.9	T530 I534 V535	T530-T532 PolarHBondContact O-N 2.98Å; T530-T532 PolarHBondContact OG1-OG1 3.39Å; T530-T532 VanDerWaalsContact OG1-OG1 3.05Å; T532-I534 PolarHBondContact O-N 3.31Å; T532-V535 PolarHBondContact O-N 2.84Å
533	E	59.7	Low	74.3	Confident	43 Å²	43	50.7 Å²	50.7	20%	0.201	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-74.2	-12.2	-179.9	-67.7	172.5	173.5	0	0	112.7	R420 I529 T530 K531 V535 T536 C537	R420-E533 IonicContact CZ-OE1 3.68Å; R420-E533 IonicContact NH1-OE1 3.57Å; R420-E533 IonicContact NH2-OE1 3.86Å; R420-E533 PolarHBondContact NH2-OE1 2.94Å; I529-E533 WeakPolarHBondContact CG2-OE2 3.29Å; T530-E533 PolarHBondContact N-OE2 2.63Å; T530-E533 WeakPolarHBondContact O-CB 3.26Å; T530-E533 PolarHBondContact O-N 3.15Å; K531-E533 VanDerWaalsContact C-N 3.28Å; K531-E533 PolarHBondContact O-N 3.18Å; E533-V535 VanDerWaalsContact C-N 3.33Å; E533-T536 PolarHBondContact O-OG1 3.3Å; E533-C537 PolarHBondContact O-SG 2.85Å
534	I	55.8	Low	72.8	Confident	72 Å²	72	54 Å²	54	37%	0.369	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-65.7	-36	169.7	-64.9	-173.5	0	0	0	111	Y437 L448 K531 T532 T536 C537	Y437-I534 HydrophobicContact CD1-CD1 4.1Å; Y437-I534 HydrophobicContact CE1-CD1 3.47Å; Y437-I534 VanDerWaalsContact CE1-CD1 3.47Å; Y437-I534 HydrophobicContact CE1-CG1 4.12Å; L448-I534 HydrophobicContact CD1-CD1 4.37Å; L448-I534 HydrophobicContact CD1-CG1 4.31Å; L448-I534 HydrophobicContact CD2-CG1 4.07Å; K531-I534 WeakPolarHBondContact O-CB 3.17Å; K531-I534 PolarHBondContact O-N 3.48Å; T532-I534 PolarHBondContact O-N 3.31Å; I534-T536 PolarHBondContact O-N 3.33Å; I534-T536 VanDerWaalsContact O-N 3.14Å; I534-C537 PolarHBondContact O-N 3.21Å; I534-C537 VanDerWaalsContact O-N 3.13Å
535	V	43.3	Very low	71.3	Confident	128 Å²	128	58.2 Å²	58.2	78%	0.776	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-68.7	-17.9	-173.7	-171.7	0	0	0	0	111.9	T532 E533	T532-V535 PolarHBondContact O-N 2.84Å; E533-V535 VanDerWaalsContact C-N 3.33Å
536	T	36.8	Very low	69.4	Low	122 Å²	122	62.9 Å²	62.9	75%	0.748	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-100.1	1.7	177.7	45	0	0	0	0	114.6	E533 I534	E533-T536 PolarHBondContact O-OG1 3.3Å; I534-T536 PolarHBondContact O-N 3.33Å; I534-T536 VanDerWaalsContact O-N 3.14Å
537	C	33.3	Very low	67.6	Low	93 Å²	93	64.4 Å²	64.4	63%	0.628	36%	0.361	S	S	*	.			trans	-108.4	0	177.4	-63.7	0	0	0	0	111.1	R450 E533 I534	R450-C537 PolarHBondContact NH2-SG 3.02Å; E533-C537 PolarHBondContact O-SG 2.85Å; I534-C537 PolarHBondContact O-N 3.21Å; I534-C537 VanDerWaalsContact O-N 3.13Å

Retrieved 537 of 537 residues in 1549.9 ms (Link to these results)

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