A0A3Q0KH87_SCHMA Loading...

Putative zinc finger protein

AlphaFold DB , UniProt , Accession A0A3Q0KH87, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 541 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	37.3	Very low	37.4	Very low	200 Å²	200	126.8 Å²	126.8	99%	0.985	62%	0.62	S	S	*	*				0	-56.6	0	-72.6	-75.1	-137.3	0	0	112	T4 Y5	M1-T4 PolarHBondContact O-OG1 3.48Å; M1-Y5 PolarHBondContact O-N 3.48Å
2	Q	28.8	Very low	37.9	Very low	173 Å²	173	126 Å²	126	81%	0.808	61%	0.607	S	S	*	*	H	α-helix	trans	-64.5	-41.9	178.3	-84.3	170.6	-31.5	0	0	114.3	T4 Y5 S6	Q2-T4 VanDerWaalsContact C-N 3.33Å; Q2-T4 PolarHBondContact O-N 3.39Å; Q2-Y5 PolarHBondContact O-N 3.2Å; Q2-S6 PolarHBondContact O-N 3.5Å; Q2-S6 VanDerWaalsContact O-N 3.16Å
3	N	33.3	Very low	38.2	Very low	144 Å²	144	118.4 Å²	118.4	77%	0.77	57%	0.571	S	S	*	*	H	α-helix	trans	-66.5	-30.8	-179	-71.2	-5.1	0	0	0	114	S7	N3-S7 PolarHBondContact O-N 2.91Å
4	T	38.1	Very low	38.6	Very low	95 Å²	95	123.3 Å²	123.3	58%	0.583	58%	0.58	S	S	*	*	H	α-helix	trans	-76	-35.1	178.1	38.7	0	0	0	0	112.4	M1 Q2 Y8	M1-T4 PolarHBondContact O-OG1 3.48Å; Q2-T4 VanDerWaalsContact C-N 3.33Å; Q2-T4 PolarHBondContact O-N 3.39Å; T4-Y8 PolarHBondContact O-N 3.28Å
5	Y	32.8	Very low	38.9	Very low	186 Å²	186	119.5 Å²	119.5	73%	0.729	57%	0.572	S	S	*	*	H	α-helix	trans	-67.6	-39.5	174.4	-114.9	-89.2	0	0	0	111.9	M1 Q2 Y8 Y9	M1-Y5 PolarHBondContact O-N 3.48Å; Q2-Y5 PolarHBondContact O-N 3.2Å; Y5-Y8 PolarHBondContact O-N 3.37Å; Y5-Y9 PolarHBondContact O-N 3.26Å; Y5-Y9 VanDerWaalsContact O-N 3.11Å
6	S	37.1	Very low	39.2	Very low	59 Å²	59	118.8 Å²	118.8	41%	0.413	57%	0.566	S	S	.	*	H	α-helix	trans	-62.9	-43.4	175.9	-177.6	0	0	0	0	112	Q2 Y8 Y9 N10	Q2-S6 PolarHBondContact O-N 3.5Å; Q2-S6 VanDerWaalsContact O-N 3.16Å; S6-Y8 PolarHBondContact O-N 3.33Å; S6-Y9 PolarHBondContact O-N 3.23Å; S6-N10 VanDerWaalsContact O-CB 3.31Å; S6-N10 WeakPolarHBondContact O-CB 3.2Å; S6-N10 PolarHBondContact O-N 3.35Å; S6-N10 PolarHBondContact O-ND2 3.4Å; S6-N10 PolarHBondContact OG-ND2 3.38Å
7	S	38.1	Very low	39.4	Very low	72 Å²	72	113.2 Å²	113.2	50%	0.503	54%	0.54	S	S	.	.	H	α-helix	trans	-58.7	-48.1	176.3	-176.9	0	0	0	0	112.6	N3 Y9 N10 E11	N3-S7 PolarHBondContact O-N 2.91Å; S7-Y9 PolarHBondContact O-N 3.26Å; S7-N10 PolarHBondContact O-N 2.97Å; S7-E11 PolarHBondContact O-N 3.45Å
8	Y	36.6	Very low	39.6	Very low	164 Å²	164	113.7 Å²	113.7	64%	0.643	54%	0.542	S	S	*	.	H	α-helix	trans	-65.8	-38.6	-177.7	-145.9	-91.3	0	0	0	112.4	T4 Y5 S6 Y12	T4-Y8 PolarHBondContact O-N 3.28Å; Y5-Y8 PolarHBondContact O-N 3.37Å; S6-Y8 PolarHBondContact O-N 3.33Å; Y8-Y12 PolarHBondContact O-N 3.29Å; Y8-Y12 VanDerWaalsContact O-N 3.13Å
9	Y	38.4	Very low	39.7	Very low	99 Å²	99	109.8 Å²	109.8	39%	0.388	53%	0.526	S	S	.	.	H	α-helix	trans	-74	-33.5	177.7	-162.2	-83.9	0	0	0	112.3	Y5 S6 S7 Y12 L13 Y146	Y5-Y9 PolarHBondContact O-N 3.26Å; Y5-Y9 VanDerWaalsContact O-N 3.11Å; S6-Y9 PolarHBondContact O-N 3.23Å; S7-Y9 PolarHBondContact O-N 3.26Å; Y9-Y12 WeakPolarHBondContact O-CB 3.38Å; Y9-Y12 PolarHBondContact O-N 2.83Å; Y9-L13 HydrophobicContact CD1-CD1 3.65Å; Y9-L13 HydrophobicContact CD1-CG 3.87Å; Y9-L13 HydrophobicContact CE1-CD1 3.6Å; Y9-L13 HydrophobicContact CE1-CD2 4.22Å; Y9-L13 HydrophobicContact CE1-CG 3.7Å; Y9-L13 WeakPolarHBondContact O-CB 3.15Å; Y9-L13 PolarHBondContact O-N 3.36Å; Y9-Y146 HydrophobicContact CD1-CE2 4.36Å; Y9-Y146 WeakPolarHBondContact CD1-OH 3.43Å; Y9-Y146 AromaticContact CE1-CE2 3.82Å; Y9-Y146 HydrophobicContact CE1-CE2 3.82Å; Y9-Y146 AromaticContact CE1-CZ 3.93Å; Y9-Y146 WeakPolarHBondContact CE1-OH 3.41Å
10	N	43	Very low	39.7	Very low	70 Å²	70	106.9 Å²	106.9	37%	0.374	52%	0.515	S	S	.	.	H	α-helix	trans	-65.3	-37.8	173.1	-77.3	-41.8	0	0	0	112.4	S6 S7 R14	S6-N10 VanDerWaalsContact O-CB 3.31Å; S6-N10 WeakPolarHBondContact O-CB 3.2Å; S6-N10 PolarHBondContact O-N 3.35Å; S6-N10 PolarHBondContact O-ND2 3.4Å; S6-N10 PolarHBondContact OG-ND2 3.38Å; S7-N10 PolarHBondContact O-N 2.97Å; N10-R14 PolarHBondContact O-N 3.41Å
11	E	48.4	Very low	39.8	Very low	133 Å²	133	102.7 Å²	102.7	62%	0.621	50%	0.496	S	S	*	.	H	α-helix	trans	-65.5	-40.9	171.1	-80.7	-162.4	151.2	0	0	112.3	S7 R14 S15	S7-E11 PolarHBondContact O-N 3.45Å; E11-R14 PolarHBondContact O-N 3.06Å; E11-S15 WeakPolarHBondContact O-CB 3.32Å; E11-S15 PolarHBondContact O-N 2.75Å
12	Y	43.5	Very low	40	Very low	117 Å²	117	98.7 Å²	98.7	46%	0.459	48%	0.475	S	S	.	.	H	α-helix	trans	-61	-45.9	174.8	-179.5	-97.2	0	0	0	111.8	Y8 Y9 S15 F16	Y8-Y12 PolarHBondContact O-N 3.29Å; Y8-Y12 VanDerWaalsContact O-N 3.13Å; Y9-Y12 WeakPolarHBondContact O-CB 3.38Å; Y9-Y12 PolarHBondContact O-N 2.83Å; Y12-S15 PolarHBondContact O-N 2.93Å; Y12-F16 WeakPolarHBondContact O-CB 3.36Å; Y12-F16 PolarHBondContact O-N 2.9Å
13	L	40.8	Very low	40.4	Very low	27 Å²	27	95 Å²	95	14%	0.141	45%	0.454	C	S	.	.	H	α-helix	trans	-61.1	-44.6	174.6	-81.9	172	0	0	0	111.8	Y9 S15 F16 I17 I154	Y9-L13 HydrophobicContact CD1-CD1 3.65Å; Y9-L13 HydrophobicContact CD1-CG 3.87Å; Y9-L13 HydrophobicContact CE1-CD1 3.6Å; Y9-L13 HydrophobicContact CE1-CD2 4.22Å; Y9-L13 HydrophobicContact CE1-CG 3.7Å; Y9-L13 WeakPolarHBondContact O-CB 3.15Å; Y9-L13 PolarHBondContact O-N 3.36Å; L13-S15 PolarHBondContact O-N 3.32Å; L13-F16 PolarHBondContact O-N 3.31Å; L13-I17 VanDerWaalsContact O-CG1 3.23Å; L13-I17 WeakPolarHBondContact O-CG1 3.47Å; L13-I17 PolarHBondContact O-N 3.01Å; L13-I154 HydrophobicContact CD1-CD1 4.29Å
14	R	45	Very low	40.7	Very low	187 Å²	187	92 Å²	92	71%	0.706	44%	0.438	S	S	*	.	H	α-helix	trans	-58	-48.1	174.9	-92.5	-172	177.3	178	-0.4	111.7	N10 E11 F16 I17 E18	N10-R14 PolarHBondContact O-N 3.41Å; E11-R14 PolarHBondContact O-N 3.06Å; R14-F16 VanDerWaalsContact C-N 3.29Å; R14-F16 PolarHBondContact O-N 3.22Å; R14-I17 PolarHBondContact O-N 3.07Å; R14-E18 WeakPolarHBondContact O-CB 3.5Å; R14-E18 WeakPolarHBondContact O-CG 3.36Å; R14-E18 PolarHBondContact O-N 2.9Å
15	S	42.7	Very low	40.7	Very low	66 Å²	66	90 Å²	90	46%	0.462	42%	0.423	S	S	.	.	H	α-helix	trans	-62.7	-37.4	178.1	-174	0	0	0	0	112.1	E11 Y12 L13 T19	E11-S15 WeakPolarHBondContact O-CB 3.32Å; E11-S15 PolarHBondContact O-N 2.75Å; Y12-S15 PolarHBondContact O-N 2.93Å; L13-S15 PolarHBondContact O-N 3.32Å; S15-T19 WeakPolarHBondContact O-CG2 3.28Å; S15-T19 PolarHBondContact O-N 3.39Å; S15-T19 PolarHBondContact O-OG1 2.78Å
16	F	43.9	Very low	41	Very low	108 Å²	108	84.1 Å²	84.1	47%	0.474	40%	0.4	S	S	.	.	H	α-helix	trans	-65.8	-44	174.7	-177	-98	0	0	0	112.2	Y12 L13 R14 T19 V20	Y12-F16 WeakPolarHBondContact O-CB 3.36Å; Y12-F16 PolarHBondContact O-N 2.9Å; L13-F16 PolarHBondContact O-N 3.31Å; R14-F16 VanDerWaalsContact C-N 3.29Å; R14-F16 PolarHBondContact O-N 3.22Å; F16-T19 WeakPolarHBondContact CA-OG1 3.29Å; F16-T19 PolarHBondContact O-N 3.37Å; F16-T19 PolarHBondContact O-OG1 3.04Å; F16-V20 HydrophobicContact CD1-CG2 4.3Å; F16-V20 HydrophobicContact CE1-CG2 3.89Å; F16-V20 HydrophobicContact CE2-CG2 4.46Å; F16-V20 HydrophobicContact CZ-CG2 3.98Å; F16-V20 WeakPolarHBondContact O-CG2 3.33Å; F16-V20 PolarHBondContact O-N 3.5Å
17	I	41.9	Very low	41.1	Very low	24 Å²	24	83.7 Å²	83.7	12%	0.123	40%	0.4	C	S	.	.	H	α-helix	trans	-65.9	-44.6	178.5	-66.4	172.2	0	0	0	110.7	L13 R14 T19 V20 T21 L158 L161	L13-I17 VanDerWaalsContact O-CG1 3.23Å; L13-I17 WeakPolarHBondContact O-CG1 3.47Å; L13-I17 PolarHBondContact O-N 3.01Å; R14-I17 PolarHBondContact O-N 3.07Å; I17-T19 VanDerWaalsContact C-N 3.28Å; I17-T19 PolarHBondContact O-N 3.4Å; I17-V20 PolarHBondContact O-N 2.84Å; I17-T21 HydrophobicContact CG2-CG2 4.35Å; I17-T21 WeakPolarHBondContact O-CG2 3.44Å; I17-T21 PolarHBondContact O-N 3.19Å; I17-T21 PolarHBondContact O-OG1 3.06Å; I17-T21 VanDerWaalsContact O-OG1 3.11Å; I17-L158 HydrophobicContact CB-CD2 4.38Å; I17-L158 HydrophobicContact CD1-CD2 3.71Å; I17-L158 HydrophobicContact CD1-CG 4.07Å; I17-L158 HydrophobicContact CG1-CD2 3.75Å; I17-L158 HydrophobicContact CG2-CD2 3.74Å; I17-L161 HydrophobicContact CG2-CD1 3.75Å
18	E	43.7	Very low	41.2	Very low	122 Å²	122	84.5 Å²	84.5	57%	0.57	40%	0.396	S	S	*	.	H	α-helix	trans	-58.8	-40	175	-76.3	174.7	-177.5	0	0	111.9	R14 T21 Q22	R14-E18 WeakPolarHBondContact O-CB 3.5Å; R14-E18 WeakPolarHBondContact O-CG 3.36Å; R14-E18 PolarHBondContact O-N 2.9Å; E18-T21 WeakPolarHBondContact CA-OG1 3.32Å; E18-T21 PolarHBondContact O-OG1 2.81Å; E18-T21 VanDerWaalsContact O-OG1 3.05Å; E18-Q22 VanDerWaalsContact O-CB 3.32Å; E18-Q22 WeakPolarHBondContact O-CB 3.34Å; E18-Q22 WeakPolarHBondContact O-CG 3.42Å; E18-Q22 PolarHBondContact O-N 2.65Å
19	T	40.3	Very low	41.2	Very low	40 Å²	40	80.4 Å²	80.4	25%	0.245	39%	0.385	C	S	.	.	H	α-helix	trans	-68.7	-39.2	176.9	43.4	0	0	0	0	111.9	S15 F16 I17 R23 F53	S15-T19 WeakPolarHBondContact O-CG2 3.28Å; S15-T19 PolarHBondContact O-N 3.39Å; S15-T19 PolarHBondContact O-OG1 2.78Å; F16-T19 WeakPolarHBondContact CA-OG1 3.29Å; F16-T19 PolarHBondContact O-N 3.37Å; F16-T19 PolarHBondContact O-OG1 3.04Å; I17-T19 VanDerWaalsContact C-N 3.28Å; I17-T19 PolarHBondContact O-N 3.4Å; T19-R23 VanDerWaalsContact O-CG 3.3Å; T19-R23 WeakPolarHBondContact O-CG 3.42Å; T19-R23 PolarHBondContact O-N 3.41Å; T19-F53 HydrophobicContact CG2-CD1 4.17Å; T19-F53 HydrophobicContact CG2-CE1 3.64Å
20	V	39.9	Very low	41.1	Very low	51 Å²	51	77.4 Å²	77.4	31%	0.309	38%	0.376	S	S	.	.	H	α-helix	trans	-67.8	-42.1	175.9	173.7	0	0	0	0	112.5	F16 I17 R23 N24	F16-V20 HydrophobicContact CD1-CG2 4.3Å; F16-V20 HydrophobicContact CE1-CG2 3.89Å; F16-V20 HydrophobicContact CE2-CG2 4.46Å; F16-V20 HydrophobicContact CZ-CG2 3.98Å; F16-V20 WeakPolarHBondContact O-CG2 3.33Å; F16-V20 PolarHBondContact O-N 3.5Å; I17-V20 PolarHBondContact O-N 2.84Å; V20-R23 WeakPolarHBondContact O-CB 3.41Å; V20-R23 PolarHBondContact O-N 2.79Å; V20-R23 VanDerWaalsContact O-N 3.14Å; V20-N24 PolarHBondContact O-N 3.25Å
21	T	41.4	Very low	41	Very low	19 Å²	19	82 Å²	82	12%	0.117	39%	0.392	C	S	.	.	H	α-helix	trans	-64.7	-41.6	176.9	51.2	0	0	0	0	111.4	I17 E18 R23 N24 I25	I17-T21 HydrophobicContact CG2-CG2 4.35Å; I17-T21 WeakPolarHBondContact O-CG2 3.44Å; I17-T21 PolarHBondContact O-N 3.19Å; I17-T21 PolarHBondContact O-OG1 3.06Å; I17-T21 VanDerWaalsContact O-OG1 3.11Å; E18-T21 WeakPolarHBondContact CA-OG1 3.32Å; E18-T21 PolarHBondContact O-OG1 2.81Å; E18-T21 VanDerWaalsContact O-OG1 3.05Å; T21-R23 VanDerWaalsContact C-N 3.28Å; T21-R23 PolarHBondContact O-N 2.93Å; T21-N24 PolarHBondContact O-N 2.88Å; T21-I25 WeakPolarHBondContact O-CG1 3.42Å; T21-I25 PolarHBondContact O-N 3.29Å
22	Q	41.3	Very low	40.3	Very low	116 Å²	116	80 Å²	80	54%	0.542	39%	0.385	S	S	.	.	H	α-helix	trans	-63.2	-34.5	172.8	-68.7	-69.6	-29.5	0	0	112	E18 Y26	E18-Q22 VanDerWaalsContact O-CB 3.32Å; E18-Q22 WeakPolarHBondContact O-CB 3.34Å; E18-Q22 WeakPolarHBondContact O-CG 3.42Å; E18-Q22 PolarHBondContact O-N 2.65Å; Q22-Y26 WeakPolarHBondContact O-CB 3.25Å; Q22-Y26 PolarHBondContact O-N 3.4Å; Q22-Y26 VanDerWaalsContact O-N 3.11Å
23	R	37.9	Very low	39.9	Very low	97 Å²	97	77.1 Å²	77.1	37%	0.366	38%	0.38	S	S	.	.	H	α-helix	trans	-62.3	-44.9	172.5	-76	-168	141.1	139.7	-7.4	111.9	T19 V20 T21 Y26 A27 W49 F53	T19-R23 VanDerWaalsContact O-CG 3.3Å; T19-R23 WeakPolarHBondContact O-CG 3.42Å; T19-R23 PolarHBondContact O-N 3.41Å; V20-R23 WeakPolarHBondContact O-CB 3.41Å; V20-R23 PolarHBondContact O-N 2.79Å; V20-R23 VanDerWaalsContact O-N 3.14Å; T21-R23 VanDerWaalsContact C-N 3.28Å; T21-R23 PolarHBondContact O-N 2.93Å; R23-Y26 PolarHBondContact O-N 2.91Å; R23-A27 WeakPolarHBondContact O-CB 3.49Å; R23-A27 PolarHBondContact O-N 3.3Å; R23-W49 HydrophobicContact CB-CH2 3.64Å; R23-W49 HydrophobicContact CB-CZ2 3.51Å; R23-W49 HydrophobicContact CG-CH2 3.27Å; R23-W49 HydrophobicContact CG-CZ2 3.29Å; R23-W49 HydrophobicContact CG-CZ3 4.17Å; R23-F53 HydrophobicContact CG-CE2 4.39Å; R23-F53 HydrophobicContact CG-CZ 4.45Å
24	N	40.2	Very low	39.6	Very low	81 Å²	81	78.8 Å²	78.8	43%	0.433	39%	0.394	S	S	.	.	H	α-helix	trans	-67.9	-45.1	-178.1	-70.6	-13.8	0	0	0	112	V20 T21 Y26 A27 E28	V20-N24 PolarHBondContact O-N 3.25Å; T21-N24 PolarHBondContact O-N 2.88Å; N24-Y26 VanDerWaalsContact C-N 3.26Å; N24-Y26 PolarHBondContact O-N 3.45Å; N24-A27 PolarHBondContact O-N 3.49Å; N24-A27 VanDerWaalsContact O-N 3.17Å; N24-E28 PolarHBondContact O-N 2.9Å
25	I	38.6	Very low	39.1	Very low	52 Å²	52	77.7 Å²	77.7	27%	0.267	40%	0.397	S	S	.	.	H	α-helix	trans	-59	-40.8	175.8	-65.7	164.9	0	0	0	110.4	T21 N29 N165	T21-I25 WeakPolarHBondContact O-CG1 3.42Å; T21-I25 PolarHBondContact O-N 3.29Å; I25-N29 PolarHBondContact O-N 2.93Å; I25-N29 PolarHBondContact O-ND2 3.5Å; I25-N165 HydrophobicContact CD1-CB 4.38Å
26	Y	37.5	Very low	38.6	Very low	62 Å²	62	82.4 Å²	82.4	24%	0.243	41%	0.411	C	S	.	.	H	α-helix	trans	-73	-35.1	178.2	-167.4	-102.6	0	0	0	112.8	Q22 R23 N24 E28 N29 L30 W49	Q22-Y26 WeakPolarHBondContact O-CB 3.25Å; Q22-Y26 PolarHBondContact O-N 3.4Å; Q22-Y26 VanDerWaalsContact O-N 3.11Å; R23-Y26 PolarHBondContact O-N 2.91Å; N24-Y26 VanDerWaalsContact C-N 3.26Å; N24-Y26 PolarHBondContact O-N 3.45Å; Y26-E28 VanDerWaalsContact C-N 3.33Å; Y26-E28 PolarHBondContact O-N 3.17Å; Y26-N29 CarbonylContact O-C 3.6Å; Y26-N29 PolarHBondContact O-N 3.11Å; Y26-L30 HydrophobicContact CD1-CD1 4.23Å; Y26-L30 HydrophobicContact CE1-CD1 3.47Å; Y26-L30 VanDerWaalsContact CE1-CD1 3.47Å; Y26-L30 WeakPolarHBondContact O-CB 3.3Å; Y26-L30 PolarHBondContact O-N 3.18Å; Y26-W49 AromaticContact CD1-CD1 3.49Å; Y26-W49 VanDerWaalsContact CD1-CD1 3.49Å; Y26-W49 HydrophobicContact CD1-CG 4.44Å; Y26-W49 AromaticContact CD1-NE1 3.26Å; Y26-W49 VanDerWaalsContact CD1-NE1 3.26Å; Y26-W49 AromaticContact CE1-CD1 3.63Å; Y26-W49 HydrophobicContact CE1-CG 4.45Å; Y26-W49 AromaticContact CE1-NE1 3.91Å; Y26-W49 AromaticContact CG-NE1 3.77Å
27	A	40.9	Very low	37.8	Very low	51 Å²	51	80 Å²	80	42%	0.421	40%	0.404	S	S	.	.	H	α-helix	trans	-63.5	-38.2	174.9	0	0	0	0	0	112.1	R23 N24 L30 K31	R23-A27 WeakPolarHBondContact O-CB 3.49Å; R23-A27 PolarHBondContact O-N 3.3Å; N24-A27 PolarHBondContact O-N 3.49Å; N24-A27 VanDerWaalsContact O-N 3.17Å; A27-L30 PolarHBondContact O-N 2.93Å; A27-K31 PolarHBondContact O-N 3.42Å; A27-K31 VanDerWaalsContact O-N 3.07Å
28	E	39.4	Very low	37.1	Very low	89 Å²	89	85.2 Å²	85.2	42%	0.416	43%	0.432	S	S	.	.	H	α-helix	trans	-65.3	-43.9	170.8	-80.9	-179.1	155.6	0	0	111.9	N24 Y26 L30 K31 L32	N24-E28 PolarHBondContact O-N 2.9Å; Y26-E28 VanDerWaalsContact C-N 3.33Å; Y26-E28 PolarHBondContact O-N 3.17Å; E28-L30 VanDerWaalsContact C-N 3.29Å; E28-L30 PolarHBondContact O-N 2.92Å; E28-K31 WeakPolarHBondContact O-CB 3.43Å; E28-K31 PolarHBondContact O-N 3.33Å; E28-L32 PolarHBondContact O-N 3.41Å
29	N	35.8	Very low	36.4	Very low	77 Å²	77	83 Å²	83	41%	0.412	43%	0.43	S	S	.	.	H	α-helix	trans	-64.1	-32	174.5	-73.9	-51.5	0	0	0	112.9	I25 Y26 L32 T33	I25-N29 PolarHBondContact O-N 2.93Å; I25-N29 PolarHBondContact O-ND2 3.5Å; Y26-N29 CarbonylContact O-C 3.6Å; Y26-N29 PolarHBondContact O-N 3.11Å; N29-L32 PolarHBondContact O-N 3.21Å; N29-T33 WeakPolarHBondContact O-CB 3.45Å; N29-T33 WeakPolarHBondContact O-CG2 3.4Å; N29-T33 PolarHBondContact O-N 3.49Å; N29-T33 PolarHBondContact O-OG1 2.98Å
30	L	37.4	Very low	35.8	Very low	36 Å²	36	86.7 Å²	86.7	19%	0.188	45%	0.448	C	S	.	.	H	α-helix	trans	-71.6	-35.7	176.1	-144.5	94	0	0	0	111.4	Y26 A27 E28 T33 S34 L42 N45 L46	Y26-L30 HydrophobicContact CD1-CD1 4.23Å; Y26-L30 HydrophobicContact CE1-CD1 3.47Å; Y26-L30 VanDerWaalsContact CE1-CD1 3.47Å; Y26-L30 WeakPolarHBondContact O-CB 3.3Å; Y26-L30 PolarHBondContact O-N 3.18Å; A27-L30 PolarHBondContact O-N 2.93Å; E28-L30 VanDerWaalsContact C-N 3.29Å; E28-L30 PolarHBondContact O-N 2.92Å; L30-T33 WeakPolarHBondContact CA-OG1 3.4Å; L30-T33 PolarHBondContact O-N 3.41Å; L30-T33 PolarHBondContact O-OG1 3.4Å; L30-S34 VanDerWaalsContact O-CB 3.28Å; L30-S34 WeakPolarHBondContact O-CB 3.4Å; L30-S34 PolarHBondContact O-N 3.27Å; L30-L42 HydrophobicContact CD2-CD2 3.73Å; L30-L42 HydrophobicContact CG-CD2 4.09Å; L30-N45 HydrophobicContact CD1-CB 4.34Å; L30-L46 HydrophobicContact CD2-CD1 4.05Å
31	K	39.9	Very low	35.4	Very low	166 Å²	166	85.8 Å²	85.8	72%	0.722	44%	0.444	S	S	*	.	H	α-helix	trans	-61.6	-47.5	170.8	-78.8	-178.3	175.3	-176.8	0	110.8	A27 E28 T33 S34	A27-K31 PolarHBondContact O-N 3.42Å; A27-K31 VanDerWaalsContact O-N 3.07Å; E28-K31 WeakPolarHBondContact O-CB 3.43Å; E28-K31 PolarHBondContact O-N 3.33Å; K31-T33 VanDerWaalsContact C-N 3.29Å; K31-T33 PolarHBondContact O-N 3.31Å; K31-S34 PolarHBondContact O-N 2.87Å; K31-S34 PolarHBondContact O-OG 3.26Å
32	L	35.1	Very low	34.8	Very low	91 Å²	91	87 Å²	87	48%	0.476	45%	0.449	S	S	.	.	H	α-helix	trans	-62.4	-32	177.2	-74.1	161.8	0	0	0	113.5	E28 N29	E28-L32 PolarHBondContact O-N 3.41Å; N29-L32 PolarHBondContact O-N 3.21Å
33	T	33.3	Very low	34.3	Very low	57 Å²	57	85.3 Å²	85.3	35%	0.35	44%	0.444	S	S	.	.	H	α-helix	trans	-93.4	-14.6	-178.8	53.3	0	0	0	0	113.9	N29 L30 K31 E35 H36 L37	N29-T33 WeakPolarHBondContact O-CB 3.45Å; N29-T33 WeakPolarHBondContact O-CG2 3.4Å; N29-T33 PolarHBondContact O-N 3.49Å; N29-T33 PolarHBondContact O-OG1 2.98Å; L30-T33 WeakPolarHBondContact CA-OG1 3.4Å; L30-T33 PolarHBondContact O-N 3.41Å; L30-T33 PolarHBondContact O-OG1 3.4Å; K31-T33 VanDerWaalsContact C-N 3.29Å; K31-T33 PolarHBondContact O-N 3.31Å; T33-E35 PolarHBondContact O-N 3.35Å; T33-H36 PolarHBondContact O-N 3.32Å; T33-L37 WeakPolarHBondContact O-CB 3.42Å; T33-L37 VanDerWaalsContact O-CG 3.32Å; T33-L37 WeakPolarHBondContact O-CG 3.33Å; T33-L37 PolarHBondContact O-N 3.18Å
34	S	35.5	Very low	34	Very low	62 Å²	62	85.9 Å²	85.9	43%	0.434	45%	0.454	S	S	.	.	H	α-helix	trans	-64.7	-22.1	178.7	69.8	0	0	0	0	113.9	L30 K31 H36	L30-S34 VanDerWaalsContact O-CB 3.28Å; L30-S34 WeakPolarHBondContact O-CB 3.4Å; L30-S34 PolarHBondContact O-N 3.27Å; K31-S34 PolarHBondContact O-N 2.87Å; K31-S34 PolarHBondContact O-OG 3.26Å; S34-H36 VanDerWaalsContact C-N 3.25Å; S34-H36 PolarHBondContact O-N 2.94Å
35	E	33.7	Very low	33.6	Very low	165 Å²	165	83.7 Å²	83.7	77%	0.771	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-16.1	173.9	-67.5	-175	164.4	0	0	113.3	T33	T33-E35 PolarHBondContact O-N 3.35Å
36	H	32.2	Very low	33.3	Very low	164 Å²	164	85.2 Å²	85.2	76%	0.759	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.2	2.2	-172.9	-71.9	-64.4	0	0	0	114.7	T33 S34	T33-H36 PolarHBondContact O-N 3.32Å; S34-H36 VanDerWaalsContact C-N 3.25Å; S34-H36 PolarHBondContact O-N 2.94Å
37	L	27.7	Very low	33	Very low	59 Å²	59	84.4 Å²	84.4	31%	0.309	46%	0.456	S	S	.	.			trans	-118.7	113.9	-168	-79.9	179.8	0	0	0	112.4	T33 S41	T33-L37 WeakPolarHBondContact O-CB 3.42Å; T33-L37 VanDerWaalsContact O-CG 3.32Å; T33-L37 WeakPolarHBondContact O-CG 3.33Å; T33-L37 PolarHBondContact O-N 3.18Å; L37-S41 VanDerWaalsContact CB-OG 3.25Å; L37-S41 WeakPolarHBondContact CB-OG 3.42Å; L37-S41 WeakPolarHBondContact CD2-OG 3.4Å
38	N	28.4	Very low	32.6	Very low	133 Å²	133	84.6 Å²	84.6	71%	0.711	45%	0.45	S	S	*	.			trans	-52.8	140.5	173.2	-145.8	-4.2	0	0	0	110.4	N40 S41	N38-N40 PolarHBondContact O-N 3.05Å; N38-S41 WeakPolarHBondContact O-CB 3.44Å; N38-S41 PolarHBondContact O-N 3.06Å; N38-S41 PolarHBondContact O-OG 3.41Å
39	S	28.7	Very low	32.1	Very low	76 Å²	76	83.4 Å²	83.4	53%	0.531	44%	0.442	S	S	.	.	H	α-helix	trans	-48.7	-31.6	-169	49.8	0	0	0	0	115.8	S41 L43	S39-S41 PolarHBondContact O-N 3.38Å; S39-L43 PolarHBondContact O-N 3.21Å
40	N	27.5	Very low	31.9	Very low	116 Å²	116	83.7 Å²	83.7	62%	0.62	44%	0.443	S	S	*	.	H	α-helix	trans	-69.8	-26.7	176.3	-75.9	-34.4	0	0	0	114.6	N38 N44	N38-N40 PolarHBondContact O-N 3.05Å; N40-N44 PolarHBondContact O-N 3Å; N40-N44 PolarHBondContact O-ND2 3.28Å
41	S	31.4	Very low	31.7	Very low	33 Å²	33	85.5 Å²	85.5	23%	0.231	45%	0.453	C	S	.	.	H	α-helix	trans	-78.4	-34.5	177.6	68.7	0	0	0	0	111.9	L37 N38 S39 N44 N45	L37-S41 VanDerWaalsContact CB-OG 3.25Å; L37-S41 WeakPolarHBondContact CB-OG 3.42Å; L37-S41 WeakPolarHBondContact CD2-OG 3.4Å; N38-S41 WeakPolarHBondContact O-CB 3.44Å; N38-S41 PolarHBondContact O-N 3.06Å; N38-S41 PolarHBondContact O-OG 3.41Å; S39-S41 PolarHBondContact O-N 3.38Å; S41-N44 PolarHBondContact O-N 3.5Å; S41-N45 WeakPolarHBondContact O-CB 3.33Å; S41-N45 VanDerWaalsContact O-CG 3.3Å; S41-N45 PolarHBondContact O-N 2.95Å; S41-N45 PolarHBondContact O-ND2 2.86Å
42	L	28.6	Very low	31.2	Very low	43 Å²	43	83 Å²	83	23%	0.225	44%	0.442	C	S	.	.	H	α-helix	trans	-64	-44.2	172.4	-93.7	159.8	0	0	0	112.1	L30 N45 L46	L30-L42 HydrophobicContact CD2-CD2 3.73Å; L30-L42 HydrophobicContact CG-CD2 4.09Å; L42-N45 PolarHBondContact O-N 3.41Å; L42-L46 HydrophobicContact CD2-CD1 4.47Å; L42-L46 WeakPolarHBondContact O-CD1 3.37Å; L42-L46 PolarHBondContact O-N 3.11Å
43	L	29.7	Very low	31.1	Very low	82 Å²	82	80.6 Å²	80.6	43%	0.429	43%	0.428	S	S	.	.	H	α-helix	trans	-62	-42.3	174.9	-94.4	156.8	0	0	0	112.4	S39 A47 L101	S39-L43 PolarHBondContact O-N 3.21Å; L43-A47 VanDerWaalsContact O-CB 3.25Å; L43-A47 WeakPolarHBondContact O-CB 3.28Å; L43-A47 PolarHBondContact O-N 3.38Å; L43-L101 HydrophobicContact CD2-CD2 4.31Å
44	N	31.7	Very low	31	Very low	109 Å²	109	83.6 Å²	83.6	58%	0.583	44%	0.442	S	S	*	.	H	α-helix	trans	-65.1	-39.8	174.7	-86.2	-36.1	0	0	0	111.9	N40 S41 L48	N40-N44 PolarHBondContact O-N 3Å; N40-N44 PolarHBondContact O-ND2 3.28Å; S41-N44 PolarHBondContact O-N 3.5Å; N44-L48 VanDerWaalsContact O-CB 3.28Å; N44-L48 WeakPolarHBondContact O-CB 3.19Å; N44-L48 WeakPolarHBondContact O-CD1 3.44Å; N44-L48 WeakPolarHBondContact O-CG 3.45Å; N44-L48 PolarHBondContact O-N 2.91Å
45	N	32.2	Very low	30.7	Very low	35 Å²	35	83.8 Å²	83.8	19%	0.187	45%	0.454	C	S	.	.	H	α-helix	trans	-69.4	-39.6	177.6	-75.1	-29.7	0	0	0	112.8	L30 S41 L42 L48 W49	L30-N45 HydrophobicContact CD1-CB 4.34Å; S41-N45 WeakPolarHBondContact O-CB 3.33Å; S41-N45 VanDerWaalsContact O-CG 3.3Å; S41-N45 PolarHBondContact O-N 2.95Å; S41-N45 PolarHBondContact O-ND2 2.86Å; L42-N45 PolarHBondContact O-N 3.41Å; N45-L48 WeakPolarHBondContact O-CB 3.49Å; N45-L48 PolarHBondContact O-N 3.34Å; N45-W49 PolarHBondContact O-N 2.99Å; N45-W49 VanDerWaalsContact O-N 3.12Å
46	L	32.6	Very low	30.3	Very low	84 Å²	84	80.9 Å²	80.9	44%	0.44	45%	0.45	S	S	.	.	H	α-helix	trans	-66.5	-42	172.7	-99.7	103.8	0	0	0	112.6	L30 L42 L48 W49 N50	L30-L46 HydrophobicContact CD2-CD1 4.05Å; L42-L46 HydrophobicContact CD2-CD1 4.47Å; L42-L46 WeakPolarHBondContact O-CD1 3.37Å; L42-L46 PolarHBondContact O-N 3.11Å; L46-L48 VanDerWaalsContact C-N 3.25Å; L46-L48 PolarHBondContact O-N 3.34Å; L46-W49 WeakPolarHBondContact O-CB 3.49Å; L46-W49 PolarHBondContact O-N 3.33Å; L46-W49 VanDerWaalsContact O-N 3.11Å; L46-N50 PolarHBondContact O-N 3.41Å
47	A	30.5	Very low	30	Very low	44 Å²	44	78.5 Å²	78.5	36%	0.364	45%	0.452	S	S	.	.	H	α-helix	trans	-69	-25.7	173.9	0	0	0	0	0	112.3	L43 W49 R466	L43-A47 VanDerWaalsContact O-CB 3.25Å; L43-A47 WeakPolarHBondContact O-CB 3.28Å; L43-A47 PolarHBondContact O-N 3.38Å; A47-W49 VanDerWaalsContact C-N 3.29Å; A47-R466 PolarHBondContact O-NH1 2.72Å; A47-R466 PolarHBondContact O-NH2 3.23Å
48	L	33.5	Very low	29.9	Very low	55 Å²	55	81.7 Å²	81.7	29%	0.288	47%	0.474	S	S	.	.	H	α-helix	trans	-65.8	-36.7	170.1	-80.1	167.4	0	0	0	110.8	N44 N45 L46 F52 R466	N44-L48 VanDerWaalsContact O-CB 3.28Å; N44-L48 WeakPolarHBondContact O-CB 3.19Å; N44-L48 WeakPolarHBondContact O-CD1 3.44Å; N44-L48 WeakPolarHBondContact O-CG 3.45Å; N44-L48 PolarHBondContact O-N 2.91Å; N45-L48 WeakPolarHBondContact O-CB 3.49Å; N45-L48 PolarHBondContact O-N 3.34Å; L46-L48 VanDerWaalsContact C-N 3.25Å; L46-L48 PolarHBondContact O-N 3.34Å; L48-F52 WeakPolarHBondContact O-CB 3.4Å; L48-F52 PolarHBondContact O-N 2.88Å; L48-F52 VanDerWaalsContact O-N 3.15Å; L48-R466 VanDerWaalsContact CA-NH2 3.26Å; L48-R466 PolarHBondContact O-NH2 3.14Å
49	W	29.2	Very low	29.8	Very low	65 Å²	65	82.1 Å²	82.1	25%	0.246	48%	0.476	C	S	.	.	H	α-helix	trans	-79.3	-44.1	-175.8	-146.2	81.4	0	0	0	115	R23 Y26 N45 L46 A47 L51 F52 F53	R23-W49 HydrophobicContact CB-CH2 3.64Å; R23-W49 HydrophobicContact CB-CZ2 3.51Å; R23-W49 HydrophobicContact CG-CH2 3.27Å; R23-W49 HydrophobicContact CG-CZ2 3.29Å; R23-W49 HydrophobicContact CG-CZ3 4.17Å; Y26-W49 AromaticContact CD1-CD1 3.49Å; Y26-W49 VanDerWaalsContact CD1-CD1 3.49Å; Y26-W49 HydrophobicContact CD1-CG 4.44Å; Y26-W49 AromaticContact CD1-NE1 3.26Å; Y26-W49 VanDerWaalsContact CD1-NE1 3.26Å; Y26-W49 AromaticContact CE1-CD1 3.63Å; Y26-W49 HydrophobicContact CE1-CG 4.45Å; Y26-W49 AromaticContact CE1-NE1 3.91Å; Y26-W49 AromaticContact CG-NE1 3.77Å; N45-W49 PolarHBondContact O-N 2.99Å; N45-W49 VanDerWaalsContact O-N 3.12Å; L46-W49 WeakPolarHBondContact O-CB 3.49Å; L46-W49 PolarHBondContact O-N 3.33Å; L46-W49 VanDerWaalsContact O-N 3.11Å; A47-W49 VanDerWaalsContact C-N 3.29Å; W49-L51 VanDerWaalsContact C-N 3.27Å; W49-L51 PolarHBondContact O-N 2.86Å; W49-F52 WeakPolarHBondContact O-CA 3.5Å; W49-F52 WeakPolarHBondContact O-CB 3.36Å; W49-F52 PolarHBondContact O-N 2.89Å; W49-F53 AromaticContact CD2-CD2 4Å; W49-F53 HydrophobicContact CD2-CD2 4Å; W49-F53 HydrophobicContact CD2-CE2 4.17Å; W49-F53 AromaticContact CE2-CE2 3.91Å; W49-F53 HydrophobicContact CE3-CD2 4.34Å; W49-F53 HydrophobicContact CG-CD2 4.36Å; W49-F53 HydrophobicContact CG-CE2 4.45Å; W49-F53 AromaticContact NE1-CE2 3.81Å; W49-F53 PolarHBondContact O-N 3.38Å; W49-F53 VanDerWaalsContact O-N 3.14Å
50	N	32.1	Very low	29.7	Very low	83 Å²	83	83.4 Å²	83.4	44%	0.444	49%	0.486	S	S	.	.	H	α-helix	trans	-58.1	-43.8	175.7	-76.9	-19.3	0	0	0	110.8	L46 F52 F53 D54	L46-N50 PolarHBondContact O-N 3.41Å; N50-F52 VanDerWaalsContact C-N 3.3Å; N50-F52 PolarHBondContact O-N 3.11Å; N50-F53 PolarHBondContact O-N 3.2Å; N50-D54 WeakPolarHBondContact O-CA 3.5Å; N50-D54 WeakPolarHBondContact O-CB 3.3Å; N50-D54 PolarHBondContact O-N 2.94Å
51	L	31.4	Very low	29.7	Very low	74 Å²	74	86.2 Å²	86.2	39%	0.387	50%	0.499	S	S	.	.	H	α-helix	trans	-79	-6.5	175.9	-86.3	155.3	0	0	0	114.3	W49 R466 R470	W49-L51 VanDerWaalsContact C-N 3.27Å; W49-L51 PolarHBondContact O-N 2.86Å; L51-R466 VanDerWaalsContact CB-NE 3.32Å; L51-R470 PolarHBondContact O-NH2 3.06Å
52	F	30.7	Very low	29.4	Very low	113 Å²	113	88.2 Å²	88.2	50%	0.496	53%	0.526	S	S	.	.	H	α-helix	trans	-83	-30.7	169.7	-141.5	-94.6	0	0	0	111.2	L48 W49 N50 M473	L48-F52 WeakPolarHBondContact O-CB 3.4Å; L48-F52 PolarHBondContact O-N 2.88Å; L48-F52 VanDerWaalsContact O-N 3.15Å; W49-F52 WeakPolarHBondContact O-CA 3.5Å; W49-F52 WeakPolarHBondContact O-CB 3.36Å; W49-F52 PolarHBondContact O-N 2.89Å; N50-F52 VanDerWaalsContact C-N 3.3Å; N50-F52 PolarHBondContact O-N 3.11Å; F52-M473 HydrophobicContact CE2-CG 4.39Å
53	F	33.4	Very low	29.3	Very low	40 Å²	40	94 Å²	94	18%	0.175	55%	0.551	C	S	.	*	H	α-helix	trans	-114	-8.6	-176.2	-69	-74.5	0	0	0	115.8	T19 R23 W49 N50 G55 C56	T19-F53 HydrophobicContact CG2-CD1 4.17Å; T19-F53 HydrophobicContact CG2-CE1 3.64Å; R23-F53 HydrophobicContact CG-CE2 4.39Å; R23-F53 HydrophobicContact CG-CZ 4.45Å; W49-F53 AromaticContact CD2-CD2 4Å; W49-F53 HydrophobicContact CD2-CD2 4Å; W49-F53 HydrophobicContact CD2-CE2 4.17Å; W49-F53 AromaticContact CE2-CE2 3.91Å; W49-F53 HydrophobicContact CE3-CD2 4.34Å; W49-F53 HydrophobicContact CG-CD2 4.36Å; W49-F53 HydrophobicContact CG-CE2 4.45Å; W49-F53 AromaticContact NE1-CE2 3.81Å; W49-F53 PolarHBondContact O-N 3.38Å; W49-F53 VanDerWaalsContact O-N 3.14Å; N50-F53 PolarHBondContact O-N 3.2Å; F53-G55 PolarHBondContact O-N 3.05Å; F53-C56 PolarHBondContact O-N 3.21Å; F53-C56 VanDerWaalsContact O-N 3.16Å
54	D	30.8	Very low	29.2	Very low	121 Å²	121	99.8 Å²	99.8	65%	0.647	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	24.9	172.3	-81.1	-20.5	0	0	0	114	N50	N50-D54 WeakPolarHBondContact O-CA 3.5Å; N50-D54 WeakPolarHBondContact O-CB 3.3Å; N50-D54 PolarHBondContact O-N 2.94Å
55	G	28.6	Very low	28.9	Very low	66 Å²	66	101.2 Å²	101.2	68%	0.68	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-5.8	162.5	0	0	0	0	0	113.8	F53	F53-G55 PolarHBondContact O-N 3.05Å
56	C	25.9	Very low	28.6	Very low	103 Å²	103	104.5 Å²	104.5	70%	0.696	60%	0.604	S	S	*	*	S	Bend	trans	-120.7	67.8	-174.9	-75.9	0	0	0	0	111.8	F53	F53-C56 PolarHBondContact O-N 3.21Å; F53-C56 VanDerWaalsContact O-N 3.16Å
57	S	25.6	Very low	28.2	Very low	114 Å²	114	105.3 Å²	105.3	80%	0.797	61%	0.613	S	S	*	*	S	Bend	trans	-166.9	70.8	160	-79.1	0	0	0	0	110.2
58	T	25.5	Very low	28.2	Very low	127 Å²	127	110.1 Å²	110.1	78%	0.779	63%	0.627	S	S	*	*			trans	179.8	77.6	142.7	50.4	0	0	0	0	107.3	S60	T58-S60 PolarHBondContact O-N 3.07Å
59	N	25.9	Very low	27.7	Very low	141 Å²	141	112.1 Å²	112.1	75%	0.754	64%	0.636	S	S	*	*			trans	-75.4	78.3	158.2	-87.8	-11.5	0	0	0	107.5	L61	N59-L61 PolarHBondContact O-N 2.94Å
60	S	27.2	Very low	27.6	Very low	104 Å²	104	116.2 Å²	116.2	73%	0.727	65%	0.652	S	S	*	*			trans	-76.8	104.9	152.9	40.3	0	0	0	0	107	T58	T58-S60 PolarHBondContact O-N 3.07Å
61	L	26.4	Very low	27.1	Very low	174 Å²	174	120.3 Å²	120.3	91%	0.911	67%	0.669	S	S	*	*			trans	-20.3	129.5	162	-75.6	132.2	0	0	0	114.1	N59	N59-L61 PolarHBondContact O-N 2.94Å
62	G	25.2	Very low	26.9	Very low	76 Å²	76	122.6 Å²	122.6	78%	0.784	69%	0.685	S	S	*	*			trans	149	73.6	169.2	0	0	0	0	0	113
63	Q	27.2	Very low	26.5	Very low	163 Å²	163	124.1 Å²	124.1	76%	0.762	70%	0.698	S	S	*	*			trans	-46.4	137	166.5	-68.4	171.3	-45.6	0	0	111.2
64	K	26.8	Very low	26.1	Very low	204 Å²	204	129.9 Å²	129.9	89%	0.887	73%	0.731	S	S	*	*			trans	-134	102	139.8	-87.5	-168.4	175.5	179.6	0	108.6
65	D	26.8	Very low	25.6	Very low	139 Å²	139	130.7 Å²	130.7	74%	0.743	74%	0.735	S	S	*	*			trans	-55.5	131	153.6	-109.1	-39.8	0	0	0	109
66	P	25.5	Very low	25.3	Very low	104 Å²	104	137 Å²	137	68%	0.675	74%	0.74	S	S	*	*	S	Bend	trans	-99.9	76.3	171.5	35.5	-26.3	0	0	0	109.6
67	T	25	Very low	25.2	Very low	101 Å²	101	142.9 Å²	142.9	62%	0.62	75%	0.749	S	S	*	*	S	Bend	trans	175.5	82.6	149	42.9	0	0	0	0	110	L485	T67-L485 HydrophobicContact CG2-CD1 4.34Å
68	Q	30.2	Very low	25	Very low	145 Å²	145	147.1 Å²	147.1	68%	0.678	75%	0.748	S	S	*	*			trans	-172.7	117.8	139	-105.7	174.4	23.5	0	0	108.6
69	Q	23.1	Very low	25.1	Very low	98 Å²	98	147.8 Å²	147.8	46%	0.458	75%	0.746	S	S	.	*			trans	-83.5	113.7	-178.6	-154.2	178.6	-8	0	0	105.8	Y541	Q69-Y541 HydrophobicContact CB-CD1 3.21Å; Q69-Y541 HydrophobicContact CB-CE1 3.7Å; Q69-Y541 HydrophobicContact CB-CG 3.65Å; Q69-Y541 WeakPolarHBondContact CB-O 3.08Å; Q69-Y541 VanDerWaalsContact CD-CD1 3.41Å; Q69-Y541 VanDerWaalsContact CD-CE2 3.41Å; Q69-Y541 HydrophobicContact CG-CD1 3.27Å; Q69-Y541 HydrophobicContact CG-CD2 4.38Å; Q69-Y541 HydrophobicContact CG-CE1 3.15Å; Q69-Y541 HydrophobicContact CG-CE2 4.31Å; Q69-Y541 HydrophobicContact CG-CG 3.87Å; Q69-Y541 PolarHBondContact N-O 3.11Å; Q69-Y541 VanDerWaalsContact NE2-CE2 3.32Å; Q69-Y541 PolarHBondContact NE2-OH 3.43Å; Q69-Y541 VanDerWaalsContact NE2-OH 3.09Å; Q69-Y541 VanDerWaalsContact O-CD1 3.28Å; Q69-Y541 WeakPolarHBondContact O-CD1 3.32Å; Q69-Y541 VanDerWaalsContact OE1-CG 3.29Å
70	Y	26.5	Very low	25.2	Very low	150 Å²	150	146 Å²	146	59%	0.588	74%	0.737	S	S	*	*			trans	-143.9	115.5	161	-92.6	-76.4	0	0	0	108.5	V72	Y70-V72 PolarHBondContact O-N 2.92Å
71	Q	22.1	Very low	25.1	Very low	170 Å²	170	148.1 Å²	148.1	79%	0.794	74%	0.74	S	S	*	*			trans	-60.6	115.7	165.3	-72.8	169.3	-39.5	0	0	108.3
72	V	26.5	Very low	25.1	Very low	122 Å²	122	149.7 Å²	149.7	74%	0.739	74%	0.74	S	S	*	*			trans	-140	126.4	154.4	-174	0	0	0	0	107.6	Y70	Y70-V72 PolarHBondContact O-N 2.92Å
73	N	22.4	Very low	25.2	Very low	144 Å²	144	154.7 Å²	154.7	77%	0.77	75%	0.747	S	S	*	*			trans	-53.2	129.3	-179.5	-59.1	-31.7	0	0	0	111.5
74	N	23.8	Very low	25.1	Very low	162 Å²	162	153.3 Å²	153.3	87%	0.866	74%	0.744	S	S	*	*			trans	-105.9	85.3	168.8	-83.4	-14.5	0	0	0	109
75	D	22	Very low	24.9	Very low	137 Å²	137	146.2 Å²	146.2	73%	0.733	72%	0.72	S	S	*	*			trans	-85.2	128.4	150.7	-74.4	-43.4	0	0	0	108.3
76	Y	21.6	Very low	25	Very low	200 Å²	200	146 Å²	146	78%	0.784	72%	0.724	S	S	*	*			trans	20.6	123.6	152.8	-67.8	-93.8	0	0	0	119.4
77	Y	24.5	Very low	25.3	Very low	225 Å²	225	148 Å²	148	88%	0.882	72%	0.724	S	S	*	*				-149.3	110.7	123.6	-95	-75.1	0	0	0	110.5
78	R	21.7	Very low	25.4	Very low	204 Å²	204	148.5 Å²	148.5	77%	0.77	72%	0.723	S	S	*	*			trans	-85.7	130.2	156.8	-174.7	-175.5	-172.8	170.6	5	105.6	D80	R78-D80 IonicContact NE-OD1 3.72Å
79	N	26.9	Very low	25.2	Very low	140 Å²	140	148.8 Å²	148.8	75%	0.749	73%	0.726	S	S	*	*			trans	-147.2	84.3	159.8	-93.1	-18.9	0	0	0	106.7
80	D	26.8	Very low	25.4	Very low	104 Å²	104	147 Å²	147	56%	0.556	73%	0.728	S	S	*	*				31.6	134.3	127.2	-56.7	-26.1	0	0	0	120.2	R78	R78-D80 IonicContact NE-OD1 3.72Å
81	D	25.3	Very low	25.4	Very low	148 Å²	148	142.7 Å²	142.7	79%	0.791	72%	0.723	S	S	*	*			trans	77.8	75.8	146	-55.3	-19	0	0	0	120.1
82	K	26.5	Very low	25.5	Very low	208 Å²	208	139.5 Å²	139.5	90%	0.904	72%	0.716	S	S	*	*			trans	177	78.8	130.8	-96.6	167.3	-174.9	-178.4	0	110
83	L	27.2	Very low	25.5	Very low	180 Å²	180	139.8 Å²	139.8	94%	0.942	71%	0.713	S	S	*	*			trans	-99.2	104.7	166.7	-92.8	157.9	0	0	0	108.9	S85	L83-S85 PolarHBondContact O-N 3.12Å
84	I	24.8	Very low	25.8	Very low	134 Å²	134	137 Å²	137	69%	0.687	71%	0.705	S	S	*	*			trans	-46.5	132.1	166.9	-70.3	165.2	0	0	0	109.1	D88	I84-D88 HydrophobicContact CG2-CB 4.18Å; I84-D88 WeakPolarHBondContact CG2-OD2 3.44Å
85	S	24.7	Very low	25.9	Very low	55 Å²	55	134.3 Å²	134.3	39%	0.385	70%	0.699	S	S	.	*			trans	-51.6	138.8	179.5	173.2	0	0	0	0	111.2	L83 Q87 D88	L83-S85 PolarHBondContact O-N 3.12Å; S85-Q87 PolarHBondContact O-N 3.27Å; S85-Q87 PolarHBondContact OG-N 2.82Å; S85-Q87 PolarHBondContact OG-OE1 3.42Å; S85-Q87 VanDerWaalsContact OG-OE1 3.04Å; S85-D88 PolarHBondContact O-N 3.37Å
86	T	28.7	Very low	26	Very low	135 Å²	135	134 Å²	134	83%	0.828	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	1.2	169.8	40	0	0	0	0	114.2
87	Q	31.1	Very low	26.1	Very low	147 Å²	147	133.6 Å²	133.6	69%	0.687	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-24.5	170.2	-93.4	144.5	-28.1	0	0	114.9	S85 M89 A90	S85-Q87 PolarHBondContact O-N 3.27Å; S85-Q87 PolarHBondContact OG-N 2.82Å; S85-Q87 PolarHBondContact OG-OE1 3.42Å; S85-Q87 VanDerWaalsContact OG-OE1 3.04Å; Q87-M89 PolarHBondContact O-N 3.17Å; Q87-A90 WeakPolarHBondContact O-CB 3.45Å; Q87-A90 PolarHBondContact O-N 3.21Å
88	D	26.8	Very low	26.1	Very low	110 Å²	110	128.5 Å²	128.5	59%	0.588	69%	0.692	S	S	*	*	H	α-helix	trans	-82.3	-17.5	-176.2	-64.8	-28.8	0	0	0	113.3	I84 S85	I84-D88 HydrophobicContact CG2-CB 4.18Å; I84-D88 WeakPolarHBondContact CG2-OD2 3.44Å; S85-D88 PolarHBondContact O-N 3.37Å
89	M	26.6	Very low	26.1	Very low	152 Å²	152	125.3 Å²	125.3	75%	0.749	69%	0.689	S	S	*	*	H	α-helix	trans	-82.2	-13	169.3	-78.2	-111	-100	0	0	113.2	Q87	Q87-M89 PolarHBondContact O-N 3.17Å
90	A	27.5	Very low	26	Very low	60 Å²	60	124.4 Å²	124.4	50%	0.496	68%	0.684	S	S	.	*	H	α-helix	trans	-81.2	-23.3	177	0	0	0	0	0	112.7	Q87 S94	Q87-A90 WeakPolarHBondContact O-CB 3.45Å; Q87-A90 PolarHBondContact O-N 3.21Å; A90-S94 PolarHBondContact O-N 3.31Å
91	A	25.9	Very low	26	Very low	59 Å²	59	124.8 Å²	124.8	49%	0.488	69%	0.686	S	S	.	*	H	α-helix	trans	-74.9	-34.3	-179.9	0	0	0	0	0	113.2	S94	A91-S94 PolarHBondContact O-N 3.31Å; A91-S94 PolarHBondContact O-OG 3.43Å
92	V	24.9	Very low	26	Very low	104 Å²	104	122 Å²	122	63%	0.63	68%	0.678	S	S	*	*	H	α-helix	trans	-79.5	-29.9	-179.2	-178.6	0	0	0	0	112.3	S94	V92-S94 PolarHBondContact O-N 3.26Å
93	N	26.9	Very low	26.2	Very low	127 Å²	127	118 Å²	118	68%	0.679	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-75.5	-11.4	171.6	-82.8	-28.3	0	0	0	113.6
94	S	28.6	Very low	26.1	Very low	87 Å²	87	115.4 Å²	115.4	61%	0.608	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-82.2	-8.8	-179	75.5	0	0	0	0	114.7	A90 A91 V92	A90-S94 PolarHBondContact O-N 3.31Å; A91-S94 PolarHBondContact O-N 3.31Å; A91-S94 PolarHBondContact O-OG 3.43Å; V92-S94 PolarHBondContact O-N 3.26Å
95	S	25.3	Very low	26	Very low	105 Å²	105	114.1 Å²	114.1	73%	0.734	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-95.6	0.4	178.7	-63.4	0	0	0	0	114.2
96	I	24.3	Very low	26.2	Very low	130 Å²	130	123.2 Å²	123.2	67%	0.667	69%	0.686	S	S	*	*	S	Bend	trans	-114.2	96.5	173	-57	176.4	0	0	0	106.7	P98	I96-P98 WeakPolarHBondContact O-CD 3.45Å; I96-P98 VanDerWaalsContact O-N 3.17Å
97	K	23.8	Very low	26	Very low	191 Å²	191	125 Å²	125	83%	0.83	69%	0.69	S	S	*	*			trans	-55.7	121.1	173.8	-80.8	-178.3	175.9	179.8	0	108.6	I99	K97-I99 PolarHBondContact O-N 3.15Å
98	P	23	Very low	25.8	Very low	118 Å²	118	121.2 Å²	121.2	77%	0.766	69%	0.691	S	S	*	*			trans	-62.1	130.2	168.7	-8.2	22.2	0	0	0	107.3	I96 D100	I96-P98 WeakPolarHBondContact O-CD 3.45Å; I96-P98 VanDerWaalsContact O-N 3.17Å; P98-D100 PolarHBondContact O-N 2.98Å
99	I	23.7	Very low	25.7	Very low	138 Å²	138	123.6 Å²	123.6	71%	0.708	70%	0.704	S	S	*	*			trans	-65	109.7	164.7	-64.9	172.1	0	0	0	106.1	K97 L101	K97-I99 PolarHBondContact O-N 3.15Å; I99-L101 HydrophobicContact CG2-CD1 4.02Å; I99-L101 HydrophobicContact CG2-CG 4.12Å; I99-L101 PolarHBondContact O-N 3.11Å; I99-L101 VanDerWaalsContact O-N 3.1Å
100	D	23.6	Very low	25.7	Very low	121 Å²	121	121.6 Å²	121.6	65%	0.647	71%	0.705	S	S	*	*			trans	-72.8	98	173.4	-168.9	-3.4	0	0	0	108.9	P98 S102	P98-D100 PolarHBondContact O-N 2.98Å; D100-S102 PolarHBondContact O-N 3.47Å; D100-S102 WeakPolarHBondContact OD1-CB 3.25Å; D100-S102 PolarHBondContact OD1-N 2.78Å; D100-S102 VanDerWaalsContact OD1-N 3.17Å; D100-S102 PolarHBondContact OD1-OG 3.2Å; D100-S102 PolarHBondContact OD2-OG 2.83Å
101	L	27.4	Very low	25.5	Very low	111 Å²	111	130.4 Å²	130.4	58%	0.581	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-80.3	16.2	177.8	-87.9	127.3	0	0	0	113.1	L43 I99 V103 L104	L43-L101 HydrophobicContact CD2-CD2 4.31Å; I99-L101 HydrophobicContact CG2-CD1 4.02Å; I99-L101 HydrophobicContact CG2-CG 4.12Å; I99-L101 PolarHBondContact O-N 3.11Å; I99-L101 VanDerWaalsContact O-N 3.1Å; L101-V103 VanDerWaalsContact C-N 3.3Å; L101-V103 PolarHBondContact O-N 3.25Å; L101-L104 HydrophobicContact CD2-CD1 4.25Å
102	S	25.8	Very low	25.6	Very low	91 Å²	91	136.5 Å²	136.5	64%	0.636	74%	0.743	S	S	*	*	G	3₁₀ helix	trans	-78.1	-1.7	-179	65.4	0	0	0	0	115.8	D100	D100-S102 PolarHBondContact O-N 3.47Å; D100-S102 WeakPolarHBondContact OD1-CB 3.25Å; D100-S102 PolarHBondContact OD1-N 2.78Å; D100-S102 VanDerWaalsContact OD1-N 3.17Å; D100-S102 PolarHBondContact OD1-OG 3.2Å; D100-S102 PolarHBondContact OD2-OG 2.83Å
103	V	29	Very low	25.6	Very low	124 Å²	124	138.3 Å²	138.3	75%	0.752	76%	0.755	S	S	*	*	G	3₁₀ helix	trans	-97.9	-7.2	-177.6	-175.6	0	0	0	0	113.7	L101 S105	L101-V103 VanDerWaalsContact C-N 3.3Å; L101-V103 PolarHBondContact O-N 3.25Å; V103-S105 PolarHBondContact O-N 3.33Å
104	L	25.2	Very low	25.4	Very low	124 Å²	124	140.8 Å²	140.8	65%	0.649	77%	0.765	S	S	*	*			trans	-96.7	64.9	-176.9	-63.1	174.7	0	0	0	112	L101	L101-L104 HydrophobicContact CD2-CD1 4.25Å
105	S	23.9	Very low	25.4	Very low	107 Å²	107	145.8 Å²	145.8	75%	0.748	78%	0.778	S	S	*	*			trans	-162.5	90.7	162.7	-88.3	0	0	0	0	110.2	V103	V103-S105 PolarHBondContact O-N 3.33Å
106	R	27.8	Very low	25.4	Very low	247 Å²	247	149.8 Å²	149.8	93%	0.932	79%	0.785	S	S	*	*			trans	-178.6	123.2	132.8	-101	162.7	174.8	-172.9	-4.5	109.3
107	D	26	Very low	25.4	Very low	171 Å²	171	150.3 Å²	150.3	91%	0.914	80%	0.799	S	S	*	*			trans	-53	152.3	169.5	-53.3	-66.2	0	0	0	111.8
108	G	26	Very low	25.4	Very low	69 Å²	69	144.5 Å²	144.5	71%	0.711	79%	0.794	S	S	*	*			trans	125.2	97.1	158.4	0	0	0	0	0	114.3
109	D	24.3	Very low	25.4	Very low	159 Å²	159	145.3 Å²	145.3	85%	0.85	80%	0.796	S	S	*	*			trans	37.6	111.5	141.7	-65.9	-30.5	0	0	0	119.3
110	S	26.8	Very low	25.3	Very low	110 Å²	110	146.8 Å²	146.8	77%	0.769	80%	0.804	S	S	*	*				162.5	129.9	110	47	0	0	0	0	110.8	E112	S110-E112 PolarHBondContact O-N 2.85Å
111	R	24	Very low	25.3	Very low	246 Å²	246	148.2 Å²	148.2	93%	0.928	81%	0.812	S	S	*	*			trans	-60.7	106.3	165.8	-80.1	168.4	157.6	157	-7.2	108.3
112	E	26.5	Very low	25.1	Very low	186 Å²	186	149.6 Å²	149.6	87%	0.869	83%	0.825	S	S	*	*			trans	-168.9	1.6	156.1	-113.1	162.9	-159.2	0	0	117.4	S110	S110-E112 PolarHBondContact O-N 2.85Å
113	T	24.8	Very low	25.1	Very low	142 Å²	142	152.7 Å²	152.7	87%	0.871	83%	0.833	S	S	*	*			trans	-113.1	49.8	176.9	46.4	0	0	0	0	113.4
114	M	23.7	Very low	24.8	Very low	179 Å²	179	150.7 Å²	150.7	88%	0.882	83%	0.825	S	S	*	*			trans	-95.7	74.2	158.6	-87.8	-176.4	61.6	0	0	109.2
115	Q	28.2	Very low	25	Very low	192 Å²	192	151.7 Å²	151.7	90%	0.897	84%	0.836	S	S	*	*	S	Bend	trans	-170.7	7.9	161.7	-113.3	161.4	8.7	0	0	118
116	Q	25.4	Very low	25.2	Very low	189 Å²	189	152.9 Å²	152.9	88%	0.883	83%	0.834	S	S	*	*	S	Bend	trans	-126.8	16	-175.1	-80.6	-176.1	-16	0	0	117.6
117	C	23.4	Very low	25.2	Very low	141 Å²	141	146.1 Å²	146.1	95%	0.953	81%	0.813	S	S	*	*			trans	-116.9	66	165	-80.6	0	0	0	0	110.7
118	G	23.7	Very low	25.1	Very low	70 Å²	70	141.6 Å²	141.6	72%	0.722	79%	0.793	S	S	*	*			trans	-105.9	85.5	168	0	0	0	0	0	110.4
119	T	23.7	Very low	25.2	Very low	134 Å²	134	143.5 Å²	143.5	82%	0.822	79%	0.793	S	S	*	*	S	Bend	trans	-173.7	91.5	154.4	20.9	0	0	0	0	108
120	I	22.6	Very low	25.5	Very low	169 Å²	169	140.1 Å²	140.1	87%	0.867	78%	0.778	S	S	*	*			trans	157.7	57	153.1	-70.6	151.6	0	0	0	104.8
121	N	24	Very low	25.6	Very low	152 Å²	152	140.8 Å²	140.8	81%	0.813	77%	0.767	S	S	*	*			trans	-109.3	114.6	153.2	-92.6	-16.7	0	0	0	103.8
122	T	23.1	Very low	25.9	Very low	140 Å²	140	134.4 Å²	134.4	86%	0.859	75%	0.75	S	S	*	*			trans	156.1	71.3	153.8	52.4	0	0	0	0	108
123	L	24.1	Very low	26	Very low	155 Å²	155	129.1 Å²	129.1	81%	0.812	73%	0.728	S	S	*	*			trans	-117.9	96.8	143.6	-94.1	157.9	0	0	0	105
124	S	24	Very low	26.3	Very low	82 Å²	82	129 Å²	129	57%	0.573	72%	0.717	S	S	*	*			trans	-46.7	140.1	-178.9	-144.1	0	0	0	0	111	D126	S124-D126 PolarHBondContact O-N 3.41Å
125	V	29	Very low	26.6	Very low	145 Å²	145	124.4 Å²	124.4	88%	0.879	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	17	177.8	171.8	0	0	0	0	112.7
126	D	28.4	Very low	26.6	Very low	132 Å²	132	118.8 Å²	118.8	71%	0.706	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.5	23.7	-172.3	-63	-51.2	0	0	0	115	S124 P128	S124-D126 PolarHBondContact O-N 3.41Å; D126-P128 VanDerWaalsContact O-CD 3.32Å; D126-P128 WeakPolarHBondContact O-CD 3.42Å
127	Q	27.5	Very low	26.9	Very low	106 Å²	106	114.5 Å²	114.5	50%	0.495	66%	0.661	S	S	.	*			trans	-86.7	116.4	178	-68.2	-93.4	-74.3	0	0	111.1
128	P	24.7	Very low	27.4	Very low	76 Å²	76	111.3 Å²	111.3	49%	0.494	64%	0.644	S	S	.	*			trans	-65.1	162	177.9	25.7	-31.8	0	0	0	111.7	D126 T130	D126-P128 VanDerWaalsContact O-CD 3.32Å; D126-P128 WeakPolarHBondContact O-CD 3.42Å; P128-T130 PolarHBondContact O-N 3.26Å
129	P	26.6	Very low	27.6	Very low	109 Å²	109	111.1 Å²	111.1	71%	0.708	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	12.4	-174.8	24.1	-32.7	0	0	0	115.6
130	T	30.7	Very low	27.8	Very low	87 Å²	87	108.7 Å²	108.7	53%	0.534	61%	0.613	S	S	.	*	H	α-helix	trans	-78.1	-31.6	-175.6	51.7	0	0	0	0	113.9	P128 N133	P128-T130 PolarHBondContact O-N 3.26Å; T130-N133 PolarHBondContact O-N 2.99Å
131	K	30.6	Very low	28.1	Very low	125 Å²	125	108.3 Å²	108.3	54%	0.543	60%	0.602	S	S	.	*	H	α-helix	trans	-74.5	-25.2	-178.9	-89.1	-174.6	-177.2	168.2	0	115.2	N133 E134 S135	K131-N133 PolarHBondContact O-N 3.03Å; K131-E134 PolarHBondContact O-N 3.14Å; K131-S135 PolarHBondContact O-OG 2.86Å
132	I	29	Very low	28.4	Very low	112 Å²	112	103.3 Å²	103.3	57%	0.574	58%	0.575	S	S	*	*	H	α-helix	trans	-67.2	-31.5	176.7	-62.6	172.6	0	0	0	110.4	S135 L136	I132-S135 PolarHBondContact O-OG 3.29Å; I132-L136 HydrophobicContact CG2-CD1 4.05Å; I132-L136 PolarHBondContact O-N 3.4Å
133	N	28.8	Very low	28.8	Very low	74 Å²	74	101.7 Å²	101.7	40%	0.396	56%	0.561	S	S	.	*	H	α-helix	trans	-65.3	-38.7	177.4	-78.8	-25.9	0	0	0	112.6	T130 K131 S135 L136 I137	T130-N133 PolarHBondContact O-N 2.99Å; K131-N133 PolarHBondContact O-N 3.03Å; N133-S135 PolarHBondContact O-N 3.41Å; N133-L136 PolarHBondContact O-N 3.23Å; N133-I137 HydrophobicContact CB-CD1 4.5Å; N133-I137 WeakPolarHBondContact O-CB 3.28Å; N133-I137 WeakPolarHBondContact O-CD1 3.38Å; N133-I137 WeakPolarHBondContact O-CG1 3.49Å; N133-I137 PolarHBondContact O-N 3.41Å
134	E	31.5	Very low	29.1	Very low	139 Å²	139	100.6 Å²	100.6	65%	0.65	56%	0.556	S	S	*	*	H	α-helix	trans	-67.6	-38.6	-179	-70.9	-179.7	164.4	0	0	112	K131 L136 I137 A138	K131-E134 PolarHBondContact O-N 3.14Å; E134-L136 VanDerWaalsContact C-N 3.31Å; E134-L136 PolarHBondContact O-N 3.45Å; E134-I137 PolarHBondContact O-N 3.31Å; E134-A138 WeakPolarHBondContact O-CB 3.35Å; E134-A138 PolarHBondContact O-N 2.92Å
135	S	30	Very low	29.2	Very low	83 Å²	83	105.7 Å²	105.7	58%	0.58	56%	0.564	S	S	*	*	H	α-helix	trans	-67.8	-26.3	175.4	37.5	0	0	0	0	114.2	K131 I132 N133	K131-S135 PolarHBondContact O-OG 2.86Å; I132-S135 PolarHBondContact O-OG 3.29Å; N133-S135 PolarHBondContact O-N 3.41Å
136	L	28	Very low	29.3	Very low	75 Å²	75	101 Å²	101	39%	0.393	53%	0.531	S	S	.	.	H	α-helix	trans	-83.6	-33.8	175.9	-85.9	155.4	0	0	0	112.3	I132 N133 E134 A138 N139	I132-L136 HydrophobicContact CG2-CD1 4.05Å; I132-L136 PolarHBondContact O-N 3.4Å; N133-L136 PolarHBondContact O-N 3.23Å; E134-L136 VanDerWaalsContact C-N 3.31Å; E134-L136 PolarHBondContact O-N 3.45Å; L136-A138 VanDerWaalsContact C-N 3.33Å; L136-N139 WeakPolarHBondContact O-CB 3.12Å; L136-N139 PolarHBondContact O-N 2.83Å
137	I	32.6	Very low	29.5	Very low	98 Å²	98	99.3 Å²	99.3	50%	0.503	52%	0.522	S	S	.	.	H	α-helix	trans	-72.5	-27.8	175.6	-65.5	164.2	0	0	0	111.2	N133 E134 N139	N133-I137 HydrophobicContact CB-CD1 4.5Å; N133-I137 WeakPolarHBondContact O-CB 3.28Å; N133-I137 WeakPolarHBondContact O-CD1 3.38Å; N133-I137 WeakPolarHBondContact O-CG1 3.49Å; N133-I137 PolarHBondContact O-N 3.41Å; E134-I137 PolarHBondContact O-N 3.31Å; I137-N139 PolarHBondContact O-N 3.48Å
138	A	33.2	Very low	29.7	Very low	74 Å²	74	98.9 Å²	98.9	61%	0.612	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-3.3	176.7	0	0	0	0	0	114.7	E134 L136 P140	E134-A138 WeakPolarHBondContact O-CB 3.35Å; E134-A138 PolarHBondContact O-N 2.92Å; L136-A138 VanDerWaalsContact C-N 3.33Å; A138-P140 WeakPolarHBondContact O-CD 3.13Å
139	N	27.9	Very low	30.3	Very low	67 Å²	67	103.3 Å²	103.3	36%	0.358	54%	0.54	S	S	.	.			trans	-76.6	110.8	-177.2	-160.5	-26.2	0	0	0	110.7	L136 I137 Y141 L142	L136-N139 WeakPolarHBondContact O-CB 3.12Å; L136-N139 PolarHBondContact O-N 2.83Å; I137-N139 PolarHBondContact O-N 3.48Å; N139-Y141 PolarHBondContact O-N 3.24Å; N139-Y141 PolarHBondContact OD1-N 2.85Å; N139-L142 HydrophobicContact CB-CD1 4.09Å; N139-L142 HydrophobicContact CB-CG 4.48Å; N139-L142 PolarHBondContact O-N 3.3Å
140	P	28	Very low	30.9	Very low	82 Å²	82	101.9 Å²	101.9	53%	0.532	53%	0.527	S	S	.	.	H	α-helix	trans	-61.9	-23.7	-174.4	-18.6	31.3	0	0	0	112.9	A138 N144	A138-P140 WeakPolarHBondContact O-CD 3.13Å; P140-N144 PolarHBondContact O-N 2.84Å; P140-N144 PolarHBondContact O-ND2 2.98Å
141	Y	27.7	Very low	31.2	Very low	161 Å²	161	99.4 Å²	99.4	63%	0.631	51%	0.51	S	S	*	.	H	α-helix	trans	-74.4	-25.1	179.4	-66.8	-81.1	0	0	0	113.4	N139	N139-Y141 PolarHBondContact O-N 3.24Å; N139-Y141 PolarHBondContact OD1-N 2.85Å
142	L	30.3	Very low	31.8	Very low	48 Å²	48	96.4 Å²	96.4	25%	0.251	50%	0.504	S	S	.	.	H	α-helix	trans	-80.9	-35	177.8	-80.8	167.3	0	0	0	111.9	N139	N139-L142 HydrophobicContact CB-CD1 4.09Å; N139-L142 HydrophobicContact CB-CG 4.48Å; N139-L142 PolarHBondContact O-N 3.3Å
143	N	31.5	Very low	32.6	Very low	105 Å²	105	94.5 Å²	94.5	56%	0.561	50%	0.501	S	S	*	.	H	α-helix	trans	-79.3	-25.9	-177.4	-116.9	0.2	0	0	0	113.9
144	N	30.7	Very low	33.1	Very low	132 Å²	132	92.9 Å²	92.9	71%	0.706	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-13.2	-177.3	-77.5	-15.9	0	0	0	114.6	P140	P140-N144 PolarHBondContact O-N 2.84Å; P140-N144 PolarHBondContact O-ND2 2.98Å
145	Y	27.6	Very low	33.6	Very low	190 Å²	190	88.5 Å²	88.5	75%	0.745	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.2	-6.3	-172.5	-76.6	-83.8	0	0	0	114.7
146	Y	29.9	Very low	34.4	Very low	45 Å²	45	88.8 Å²	88.8	18%	0.176	47%	0.467	C	S	.	.	S	Bend	trans	-126	143.5	-175.1	-81.4	-84	0	0	0	113.7	Y9 D150 I154	Y9-Y146 HydrophobicContact CD1-CE2 4.36Å; Y9-Y146 WeakPolarHBondContact CD1-OH 3.43Å; Y9-Y146 AromaticContact CE1-CE2 3.82Å; Y9-Y146 HydrophobicContact CE1-CE2 3.82Å; Y9-Y146 AromaticContact CE1-CZ 3.93Å; Y9-Y146 WeakPolarHBondContact CE1-OH 3.41Å; Y146-D150 HydrophobicContact CD1-CB 3.85Å; Y146-I154 HydrophobicContact CD1-CD1 4.44Å; Y146-I154 HydrophobicContact CE1-CD1 4.18Å
147	N	33.1	Very low	35.2	Very low	97 Å²	97	88.5 Å²	88.5	52%	0.519	47%	0.469	S	S	.	.			trans	-67.6	133.3	167	-164.1	-30.1	0	0	0	108.2	K149 D150 I151	N147-K149 PolarHBondContact O-N 2.88Å; N147-D150 WeakPolarHBondContact CB-OD2 3.37Å; N147-D150 WeakPolarHBondContact O-CB 3.45Å; N147-D150 PolarHBondContact O-N 3.39Å; N147-I151 PolarHBondContact O-N 3.22Å
148	P	30.8	Very low	35.4	Very low	97 Å²	97	85.8 Å²	85.8	63%	0.63	46%	0.455	S	S	*	.	H	α-helix	trans	-53.2	-26.9	-178.7	12.6	-27.8	0	0	0	114.6	S152	P148-S152 PolarHBondContact O-N 2.93Å; P148-S152 VanDerWaalsContact O-N 3.14Å
149	K	37.7	Very low	35.7	Very low	170 Å²	170	88.9 Å²	88.9	74%	0.739	46%	0.455	S	S	*	.	H	α-helix	trans	-66.2	-37	172.7	-70.3	-174.3	177.7	-179.1	0	113.3	N147 S152 S153	N147-K149 PolarHBondContact O-N 2.88Å; K149-S152 PolarHBondContact O-N 3.33Å; K149-S153 PolarHBondContact O-N 3.33Å; K149-S153 VanDerWaalsContact O-N 3.11Å
150	D	38.6	Very low	36.3	Very low	79 Å²	79	90.5 Å²	90.5	42%	0.422	46%	0.463	S	S	.	.	H	α-helix	trans	-71.4	-37.9	178.2	-63.4	-33.9	0	0	0	110.8	Y146 N147 S152 S153 I154	Y146-D150 HydrophobicContact CD1-CB 3.85Å; N147-D150 WeakPolarHBondContact CB-OD2 3.37Å; N147-D150 WeakPolarHBondContact O-CB 3.45Å; N147-D150 PolarHBondContact O-N 3.39Å; D150-S152 VanDerWaalsContact C-N 3.33Å; D150-S152 PolarHBondContact O-N 2.93Å; D150-S153 WeakPolarHBondContact O-CB 3.42Å; D150-S153 PolarHBondContact O-N 2.84Å; D150-I154 VanDerWaalsContact O-CG1 3.25Å; D150-I154 WeakPolarHBondContact O-CG1 3.48Å; D150-I154 PolarHBondContact O-N 3.1Å
151	I	37	Very low	36.5	Very low	35 Å²	35	89.6 Å²	89.6	18%	0.179	45%	0.454	C	S	.	.	H	α-helix	trans	-59.6	-45.2	173.3	-58.5	178.3	0	0	0	110.1	N147 S153 I154 L155	N147-I151 PolarHBondContact O-N 3.22Å; I151-S153 VanDerWaalsContact C-N 3.33Å; I151-S153 PolarHBondContact O-N 3.02Å; I151-I154 PolarHBondContact O-N 3.46Å; I151-L155 HydrophobicContact CG2-CD1 3.86Å; I151-L155 HydrophobicContact CG2-CG 4.26Å; I151-L155 WeakPolarHBondContact O-CB 3.36Å; I151-L155 VanDerWaalsContact O-CG 3.25Å; I151-L155 WeakPolarHBondContact O-CG 3.4Å; I151-L155 PolarHBondContact O-N 3.34Å
152	S	44.8	Very low	36.8	Very low	62 Å²	62	86.4 Å²	86.4	43%	0.434	45%	0.447	S	S	.	.	H	α-helix	trans	-63.2	-37.2	177.1	-170.6	0	0	0	0	112.9	P148 K149 D150 N156	P148-S152 PolarHBondContact O-N 2.93Å; P148-S152 VanDerWaalsContact O-N 3.14Å; K149-S152 PolarHBondContact O-N 3.33Å; D150-S152 VanDerWaalsContact C-N 3.33Å; D150-S152 PolarHBondContact O-N 2.93Å; S152-N156 WeakPolarHBondContact O-CB 3.46Å; S152-N156 PolarHBondContact O-N 3.06Å
153	S	44.6	Very low	37	Very low	71 Å²	71	88.6 Å²	88.6	50%	0.497	47%	0.466	S	S	.	.	H	α-helix	trans	-66.1	-45	175.8	-178.5	0	0	0	0	111.5	K149 D150 I151 N156 T157	K149-S153 PolarHBondContact O-N 3.33Å; K149-S153 VanDerWaalsContact O-N 3.11Å; D150-S153 WeakPolarHBondContact O-CB 3.42Å; D150-S153 PolarHBondContact O-N 2.84Å; I151-S153 VanDerWaalsContact C-N 3.33Å; I151-S153 PolarHBondContact O-N 3.02Å; S153-N156 PolarHBondContact O-N 3.33Å; S153-T157 WeakPolarHBondContact O-CB 3.39Å; S153-T157 PolarHBondContact O-N 2.93Å; S153-T157 PolarHBondContact O-OG1 3.37Å
154	I	40.1	Very low	36.9	Very low	40 Å²	40	89.8 Å²	89.8	21%	0.205	47%	0.471	C	S	.	.	H	α-helix	trans	-62.9	-44.6	176.5	-66.3	164.2	0	0	0	110.5	L13 Y146 D150 I151 T157 L158	L13-I154 HydrophobicContact CD1-CD1 4.29Å; Y146-I154 HydrophobicContact CD1-CD1 4.44Å; Y146-I154 HydrophobicContact CE1-CD1 4.18Å; D150-I154 VanDerWaalsContact O-CG1 3.25Å; D150-I154 WeakPolarHBondContact O-CG1 3.48Å; D150-I154 PolarHBondContact O-N 3.1Å; I151-I154 PolarHBondContact O-N 3.46Å; I154-T157 PolarHBondContact O-N 3.14Å; I154-L158 HydrophobicContact CG2-CD1 4.19Å; I154-L158 WeakPolarHBondContact O-CB 3.25Å; I154-L158 WeakPolarHBondContact O-CG 3.37Å; I154-L158 PolarHBondContact O-N 3.28Å
155	L	40.9	Very low	37	Very low	48 Å²	48	86.6 Å²	86.6	25%	0.251	46%	0.455	S	S	.	.	H	α-helix	trans	-63.2	-40.6	176.7	-72.7	173.4	0	0	0	112.2	I151 L158 K159	I151-L155 HydrophobicContact CG2-CD1 3.86Å; I151-L155 HydrophobicContact CG2-CG 4.26Å; I151-L155 WeakPolarHBondContact O-CB 3.36Å; I151-L155 VanDerWaalsContact O-CG 3.25Å; I151-L155 WeakPolarHBondContact O-CG 3.4Å; I151-L155 PolarHBondContact O-N 3.34Å; L155-L158 HydrophobicContact CD2-CD1 4.42Å; L155-L158 WeakPolarHBondContact O-CB 3.49Å; L155-L158 PolarHBondContact O-N 2.78Å; L155-K159 WeakPolarHBondContact O-CB 3.25Å; L155-K159 PolarHBondContact O-N 3.19Å
156	N	47.7	Very low	37.1	Very low	88 Å²	88	80.2 Å²	80.2	47%	0.471	43%	0.433	S	S	.	.	H	α-helix	trans	-66.6	-37.4	174.1	-83.3	-19.6	0	0	0	112.3	S152 S153 L158 K159 N160	S152-N156 WeakPolarHBondContact O-CB 3.46Å; S152-N156 PolarHBondContact O-N 3.06Å; S153-N156 PolarHBondContact O-N 3.33Å; N156-L158 VanDerWaalsContact C-N 3.35Å; N156-K159 WeakPolarHBondContact O-CB 3.23Å; N156-K159 PolarHBondContact O-N 3.36Å; N156-N160 PolarHBondContact O-N 3.31Å; N156-N160 PolarHBondContact O-ND2 3.33Å
157	T	44	Very low	37	Very low	69 Å²	69	83 Å²	83	42%	0.423	46%	0.457	S	S	.	.	H	α-helix	trans	-65.3	-41.2	175.5	-47.9	0	0	0	0	110.8	S153 I154 N160 L161	S153-T157 WeakPolarHBondContact O-CB 3.39Å; S153-T157 PolarHBondContact O-N 2.93Å; S153-T157 PolarHBondContact O-OG1 3.37Å; I154-T157 PolarHBondContact O-N 3.14Å; T157-N160 PolarHBondContact O-N 2.73Å; T157-L161 HydrophobicContact CG2-CD1 4.21Å; T157-L161 WeakPolarHBondContact O-CB 3.38Å; T157-L161 VanDerWaalsContact O-CG 3.3Å; T157-L161 WeakPolarHBondContact O-CG 3.33Å; T157-L161 PolarHBondContact O-N 3.28Å
158	L	37.1	Very low	36.8	Very low	42 Å²	42	84 Å²	84	22%	0.22	46%	0.455	C	S	.	.	H	α-helix	trans	-61	-44.1	171.9	-80.1	167.4	0	0	0	112	I17 I154 L155 N156 N160 L161 L162	I17-L158 HydrophobicContact CB-CD2 4.38Å; I17-L158 HydrophobicContact CD1-CD2 3.71Å; I17-L158 HydrophobicContact CD1-CG 4.07Å; I17-L158 HydrophobicContact CG1-CD2 3.75Å; I17-L158 HydrophobicContact CG2-CD2 3.74Å; I154-L158 HydrophobicContact CG2-CD1 4.19Å; I154-L158 WeakPolarHBondContact O-CB 3.25Å; I154-L158 WeakPolarHBondContact O-CG 3.37Å; I154-L158 PolarHBondContact O-N 3.28Å; L155-L158 HydrophobicContact CD2-CD1 4.42Å; L155-L158 WeakPolarHBondContact O-CB 3.49Å; L155-L158 PolarHBondContact O-N 2.78Å; N156-L158 VanDerWaalsContact C-N 3.35Å; L158-N160 PolarHBondContact O-N 2.89Å; L158-L161 PolarHBondContact O-N 3.15Å; L158-L162 WeakPolarHBondContact O-CB 3.37Å; L158-L162 WeakPolarHBondContact O-CD1 3.41Å; L158-L162 WeakPolarHBondContact O-CG 3.46Å; L158-L162 PolarHBondContact O-N 2.9Å
159	K	40	Very low	36.8	Very low	139 Å²	139	84.9 Å²	84.9	60%	0.604	45%	0.452	S	S	*	.	H	α-helix	trans	-60.4	-44.9	177.4	-149.3	179.1	-172.5	-176.9	0	111.3	L155 N156 L162 S163	L155-K159 WeakPolarHBondContact O-CB 3.25Å; L155-K159 PolarHBondContact O-N 3.19Å; N156-K159 WeakPolarHBondContact O-CB 3.23Å; N156-K159 PolarHBondContact O-N 3.36Å; K159-L162 PolarHBondContact O-N 3.03Å; K159-S163 WeakPolarHBondContact O-CB 3.09Å; K159-S163 PolarHBondContact O-N 3.34Å
160	N	40.4	Very low	36.4	Very low	100 Å²	100	85.1 Å²	85.1	54%	0.535	46%	0.455	S	S	.	.	H	α-helix	trans	-65.6	-42.5	176.4	-71.1	-17.3	0	0	0	111.9	N156 T157 L158 L162 S163 I164	N156-N160 PolarHBondContact O-N 3.31Å; N156-N160 PolarHBondContact O-ND2 3.33Å; T157-N160 PolarHBondContact O-N 2.73Å; L158-N160 PolarHBondContact O-N 2.89Å; N160-L162 VanDerWaalsContact C-N 3.32Å; N160-L162 PolarHBondContact O-N 2.8Å; N160-S163 PolarHBondContact O-N 3.21Å; N160-I164 WeakPolarHBondContact O-CB 3.36Å; N160-I164 WeakPolarHBondContact O-CD1 3.44Å; N160-I164 WeakPolarHBondContact O-CG1 3.5Å; N160-I164 PolarHBondContact O-N 2.89Å
161	L	32.9	Very low	35.9	Very low	64 Å²	64	86.1 Å²	86.1	34%	0.335	46%	0.46	S	S	.	.	H	α-helix	trans	-67.1	-32.1	177.7	-74.5	167.8	0	0	0	113	I17 T157 L158 N165	I17-L161 HydrophobicContact CG2-CD1 3.75Å; T157-L161 HydrophobicContact CG2-CD1 4.21Å; T157-L161 WeakPolarHBondContact O-CB 3.38Å; T157-L161 VanDerWaalsContact O-CG 3.3Å; T157-L161 WeakPolarHBondContact O-CG 3.33Å; T157-L161 PolarHBondContact O-N 3.28Å; L158-L161 PolarHBondContact O-N 3.15Å; L161-N165 WeakPolarHBondContact O-CB 3.48Å; L161-N165 PolarHBondContact O-N 3.23Å; L161-N165 PolarHBondContact O-ND2 2.78Å
162	L	32.8	Very low	35.5	Very low	94 Å²	94	89.7 Å²	89.7	49%	0.492	48%	0.477	S	S	.	.	H	α-helix	trans	-74.8	-36.6	173.8	-77.6	158.3	0	0	0	112	L158 K159 N160	L158-L162 WeakPolarHBondContact O-CB 3.37Å; L158-L162 WeakPolarHBondContact O-CD1 3.41Å; L158-L162 WeakPolarHBondContact O-CG 3.46Å; L158-L162 PolarHBondContact O-N 2.9Å; K159-L162 PolarHBondContact O-N 3.03Å; N160-L162 VanDerWaalsContact C-N 3.32Å; N160-L162 PolarHBondContact O-N 2.8Å
163	S	34.2	Very low	34.9	Very low	93 Å²	93	93.4 Å²	93.4	65%	0.65	49%	0.487	S	S	*	.	H	α-helix	trans	-69.5	-36.4	173.5	-88.9	0	0	0	0	113.2	K159 N160	K159-S163 WeakPolarHBondContact O-CB 3.09Å; K159-S163 PolarHBondContact O-N 3.34Å; N160-S163 PolarHBondContact O-N 3.21Å
164	I	31	Very low	34	Very low	130 Å²	130	96.5 Å²	96.5	67%	0.667	49%	0.494	S	S	*	.	H	α-helix	trans	-76.1	-28.8	-178.4	-66.5	163.5	0	0	0	111.8	N160	N160-I164 WeakPolarHBondContact O-CB 3.36Å; N160-I164 WeakPolarHBondContact O-CD1 3.44Å; N160-I164 WeakPolarHBondContact O-CG1 3.5Å; N160-I164 PolarHBondContact O-N 2.89Å
165	N	32.8	Very low	33.5	Very low	66 Å²	66	97.5 Å²	97.5	35%	0.353	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	9.5	-176.2	-72.9	-44.4	0	0	0	114.7	I25 L161 P167	I25-N165 HydrophobicContact CD1-CB 4.38Å; L161-N165 WeakPolarHBondContact O-CB 3.48Å; L161-N165 PolarHBondContact O-N 3.23Å; L161-N165 PolarHBondContact O-ND2 2.78Å; N165-P167 VanDerWaalsContact O-CD 3.29Å; N165-P167 WeakPolarHBondContact O-CD 3.44Å
166	N	29.6	Very low	32.9	Very low	56 Å²	56	98.7 Å²	98.7	30%	0.299	52%	0.517	S	S	.	.			trans	-118.9	74.6	178.6	-158.5	-21	0	0	0	112.6	Y168	N166-Y168 PolarHBondContact O-N 2.96Å; N166-Y168 PolarHBondContact OD1-N 3.36Å
167	P	26.5	Very low	31.9	Very low	104 Å²	104	98.5 Å²	98.5	68%	0.675	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	6	171.5	29.6	-32.2	0	0	0	113.7	N165	N165-P167 VanDerWaalsContact O-CD 3.29Å; N165-P167 WeakPolarHBondContact O-CD 3.44Å
168	Y	28.7	Very low	31	Very low	118 Å²	118	102 Å²	102	46%	0.463	53%	0.534	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-5.9	-172.3	-124.8	-97.4	0	0	0	115.4	N166 M172	N166-Y168 PolarHBondContact O-N 2.96Å; N166-Y168 PolarHBondContact OD1-N 3.36Å; Y168-M172 HydrophobicContact CD1-CG 3.91Å; Y168-M172 HydrophobicContact CE1-CG 4.4Å; Y168-M172 WeakPolarHBondContact O-CG 3.43Å; Y168-M172 PolarHBondContact O-N 3.32Å
169	M	31.9	Very low	30.5	Very low	115 Å²	115	104.2 Å²	104.2	57%	0.567	55%	0.553	S	S	*	*	H	α-helix	trans	-81	-19.8	175.8	-76.4	-67.1	-69.5	0	0	114.3
170	E	27.9	Very low	29.7	Very low	174 Å²	174	104.8 Å²	104.8	81%	0.813	56%	0.562	S	S	*	*	H	α-helix	trans	-88.4	-17.3	178.7	-150.9	150.3	-164	0	0	112.7
171	L	29.2	Very low	28.9	Very low	101 Å²	101	105.6 Å²	105.6	53%	0.529	57%	0.566	S	S	.	*	H	α-helix	trans	-94.7	-24	174.3	-77.1	161.7	0	0	0	113.3	H173 Q174 S175	L171-H173 VanDerWaalsContact C-N 3.34Å; L171-Q174 PolarHBondContact O-N 3.32Å; L171-S175 PolarHBondContact O-N 3.49Å; L171-S175 PolarHBondContact O-OG 2.96Å
172	M	28.2	Very low	28.4	Very low	109 Å²	109	108.9 Å²	108.9	54%	0.537	58%	0.584	S	S	.	*	H	α-helix	trans	-77.9	-19.3	175.2	-70.7	-80.9	-98	0	0	113.4	Y168 Q174 S175 S176	Y168-M172 HydrophobicContact CD1-CG 3.91Å; Y168-M172 HydrophobicContact CE1-CG 4.4Å; Y168-M172 WeakPolarHBondContact O-CG 3.43Å; Y168-M172 PolarHBondContact O-N 3.32Å; M172-Q174 VanDerWaalsContact C-N 3.29Å; M172-S175 WeakPolarHBondContact CA-OG 3.03Å; M172-S175 PolarHBondContact O-OG 2.81Å; M172-S176 PolarHBondContact O-OG 2.72Å
173	H	31.6	Very low	27.9	Very low	140 Å²	140	110.5 Å²	110.5	65%	0.648	60%	0.598	S	S	*	*	H	α-helix	trans	-77.5	-12.4	170.2	-104	-71.1	0	0	0	113.7	L171	L171-H173 VanDerWaalsContact C-N 3.34Å
174	Q	27.6	Very low	27.5	Very low	136 Å²	136	110.8 Å²	110.8	64%	0.636	60%	0.6	S	S	*	*	H	α-helix	trans	-96.2	-26.5	172.4	-66.5	-171	-13.9	0	0	112.5	L171 M172 S176 V177	L171-Q174 PolarHBondContact O-N 3.32Å; M172-Q174 VanDerWaalsContact C-N 3.29Å; Q174-S176 VanDerWaalsContact C-N 3.35Å; Q174-S176 PolarHBondContact O-N 3.16Å; Q174-V177 PolarHBondContact O-N 3.01Å
175	S	27.6	Very low	27.1	Very low	61 Å²	61	113 Å²	113	43%	0.427	61%	0.607	S	S	.	*	H	α-helix	trans	-81.1	-10	179.5	55.3	0	0	0	0	114.6	L171 M172	L171-S175 PolarHBondContact O-N 3.49Å; L171-S175 PolarHBondContact O-OG 2.96Å; M172-S175 WeakPolarHBondContact CA-OG 3.03Å; M172-S175 PolarHBondContact O-OG 2.81Å
176	S	29.2	Very low	26.7	Very low	74 Å²	74	114.7 Å²	114.7	52%	0.517	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.3	-2.8	169.6	40.3	0	0	0	0	114	M172 Q174	M172-S176 PolarHBondContact O-OG 2.72Å; Q174-S176 VanDerWaalsContact C-N 3.35Å; Q174-S176 PolarHBondContact O-N 3.16Å
177	V	25.8	Very low	26.5	Very low	84 Å²	84	120.2 Å²	120.2	51%	0.509	65%	0.646	S	S	.	*	S	Bend	trans	-93.3	-12.9	171.9	-179.4	0	0	0	0	111.9	Q174 S179 L181	Q174-V177 PolarHBondContact O-N 3.01Å; V177-S179 PolarHBondContact O-N 2.77Å; V177-L181 HydrophobicContact CG1-CD1 3.86Å
178	I	25.6	Very low	26.3	Very low	142 Å²	142	124.1 Å²	124.1	73%	0.728	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-6.3	-175.1	-62.5	178.1	0	0	0	113.1
179	S	26.4	Very low	26.1	Very low	89 Å²	89	123.7 Å²	123.7	62%	0.622	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	2.4	-180	35.6	0	0	0	0	115.7	V177	V177-S179 PolarHBondContact O-N 2.77Å
180	N	23.8	Very low	25.7	Very low	151 Å²	151	124.5 Å²	124.5	81%	0.807	68%	0.675	S	S	*	*	S	Bend	trans	-134.7	13.9	179	-81.2	-34.8	0	0	0	115.4
181	L	22.9	Very low	25.5	Very low	117 Å²	117	122.4 Å²	122.4	61%	0.613	67%	0.669	S	S	*	*	S	Bend	trans	-112.9	110.3	174.6	-80.5	154	0	0	0	110.2	V177	V177-L181 HydrophobicContact CG1-CD1 3.86Å
182	N	23.7	Very low	25.3	Very low	133 Å²	133	123.5 Å²	123.5	71%	0.711	68%	0.682	S	S	*	*			trans	84.2	68.9	156.5	-49.1	-23.4	0	0	0	115.3
183	T	22.3	Very low	25	Very low	128 Å²	128	122.7 Å²	122.7	79%	0.785	69%	0.688	S	S	*	*				-18.1	137.7	97.2	41.4	0	0	0	0	115.1
184	S	24.3	Very low	24.8	Very low	98 Å²	98	123.3 Å²	123.3	69%	0.685	70%	0.695	S	S	*	*	S	Bend	trans	73.2	102.1	174.4	32.2	0	0	0	0	118.5
185	Q	23.9	Very low	24.8	Very low	178 Å²	178	126.2 Å²	126.2	83%	0.832	71%	0.706	S	S	*	*				76.4	109.4	125.1	-62.6	-178.5	14.4	0	0	119.5
186	S	23.9	Very low	24.6	Very low	100 Å²	100	128 Å²	128	70%	0.699	72%	0.718	S	S	*	*				93.1	122.8	118.1	79.7	0	0	0	0	120
187	K	25.2	Very low	24.5	Very low	173 Å²	173	131.2 Å²	131.2	75%	0.752	74%	0.735	S	S	*	*			trans	82.5	106.4	131.2	-79.1	-177.2	176.5	178.4	0	120.5
188	F	21.9	Very low	24.6	Very low	186 Å²	186	135.8 Å²	135.8	82%	0.816	75%	0.748	S	S	*	*			trans	88.3	150.4	131	-73.9	-58.8	0	0	0	120.4
189	P	24.6	Very low	24.7	Very low	108 Å²	108	134.9 Å²	134.9	70%	0.701	76%	0.755	S	S	*	*			trans	-120.6	-158.6	-141.1	33.2	-8.9	0	0	0	112.4
190	V	24.2	Very low	24.6	Very low	132 Å²	132	136.9 Å²	136.9	80%	0.8	76%	0.758	S	S	*	*			trans	116.8	135.1	172.4	176.2	0	0	0	0	111.2
191	D	23.3	Very low	24.9	Very low	130 Å²	130	138 Å²	138	70%	0.695	76%	0.762	S	S	*	*			cis	-159.3	149.3	-5.5	-128.5	-29.2	0	0	0	107.4
192	P	24.3	Very low	25	Very low	124 Å²	124	136.3 Å²	136.3	81%	0.805	76%	0.76	S	S	*	*			trans	-99.8	89.9	171.5	33.4	-22.9	0	0	0	112
193	S	23.6	Very low	25.4	Very low	93 Å²	93	136.2 Å²	136.2	65%	0.65	76%	0.76	S	S	*	*			trans	-162.3	81.3	167	64.4	0	0	0	0	113.4
194	L	26.9	Very low	25.5	Very low	153 Å²	153	136.7 Å²	136.7	80%	0.801	76%	0.758	S	S	*	*			trans	-145.9	122.3	163.2	-82.2	-179.6	0	0	0	111
195	F	28.1	Very low	25.9	Very low	196 Å²	196	138.3 Å²	138.3	86%	0.86	76%	0.758	S	S	*	*			trans	95.5	78.7	166.1	-59.9	-74.3	0	0	0	119.5
196	S	23.3	Very low	26	Very low	99 Å²	99	136.3 Å²	136.3	69%	0.692	75%	0.754	S	S	*	*			trans	-78.1	148.6	158.9	50.2	0	0	0	0	114.9
197	T	27.5	Very low	26.4	Very low	142 Å²	142	138.9 Å²	138.9	87%	0.871	75%	0.754	S	S	*	*			trans	-155	88.3	140.5	46.9	0	0	0	0	108.5
198	K	26.3	Very low	26.5	Very low	179 Å²	179	137 Å²	137	78%	0.778	75%	0.752	S	S	*	*				51.8	110	97.5	-84.8	-173.4	178.4	178.3	0	117
199	S	28.9	Very low	26.8	Very low	124 Å²	124	132.9 Å²	132.9	87%	0.867	75%	0.747	S	S	*	*				-150.2	108.1	123.8	55.5	0	0	0	0	109.6
200	N	24.6	Very low	27	Very low	130 Å²	130	133.6 Å²	133.6	70%	0.695	75%	0.749	S	S	*	*			trans	-68.6	156.5	175.5	-64.4	-26.2	0	0	0	111.5
201	I	28.9	Very low	27	Very low	174 Å²	174	132.8 Å²	132.8	89%	0.892	74%	0.744	S	S	*	*				-168.4	134.4	115.8	-85.4	147.9	0	0	0	107.4
202	S	25.1	Very low	27.1	Very low	83 Å²	83	134.4 Å²	134.4	58%	0.58	75%	0.752	S	S	*	*			trans	-99.4	178.5	-165.9	47.1	0	0	0	0	113
203	D	32.2	Very low	27.1	Very low	131 Å²	131	133.1 Å²	133.1	70%	0.701	74%	0.742	S	S	*	*			trans	86.4	103.2	153.7	-48.3	-40.9	0	0	0	115.6
204	N	25.1	Very low	27.4	Very low	138 Å²	138	134 Å²	134	74%	0.738	75%	0.749	S	S	*	*				86	141	82.6	-90.2	-6.5	0	0	0	113.3
205	D	31.9	Very low	27.4	Very low	131 Å²	131	134.2 Å²	134.2	70%	0.701	75%	0.745	S	S	*	*			trans	86.2	105.2	155.3	-53.2	-31.5	0	0	0	120.3
206	N	26.8	Very low	27.4	Very low	137 Å²	137	131.6 Å²	131.6	73%	0.733	74%	0.74	S	S	*	*				55.1	144.7	117.7	-71.6	-29	0	0	0	122.6
207	H	31.4	Very low	27.6	Very low	154 Å²	154	135.6 Å²	135.6	71%	0.713	75%	0.748	S	S	*	*			trans	90.5	113.4	155.5	-77.7	-69.5	0	0	0	119.2
208	D	28	Very low	27.4	Very low	133 Å²	133	137.6 Å²	137.6	71%	0.711	75%	0.748	S	S	*	*				56.7	128.5	123.2	-65.6	-15.7	0	0	0	117.2
209	S	27.6	Very low	27.5	Very low	99 Å²	99	137.6 Å²	137.6	69%	0.692	76%	0.755	S	S	*	*			cis	168.9	168.5	33.9	35.6	0	0	0	0	108.8
210	V	28.8	Very low	27.2	Very low	123 Å²	123	139.3 Å²	139.3	75%	0.745	75%	0.754	S	S	*	*			trans	81.6	87	159.6	-159.2	0	0	0	0	115.5
211	V	25	Very low	27.2	Very low	115 Å²	115	136.2 Å²	136.2	70%	0.697	75%	0.747	S	S	*	*				63.1	105.7	81.6	-175.8	0	0	0	0	113.4
212	N	26.1	Very low	27	Very low	164 Å²	164	133.4 Å²	133.4	88%	0.877	74%	0.743	S	S	*	*				-156.4	126.5	114.9	-115.3	-12.2	0	0	0	112.8
213	V	24.2	Very low	27.1	Very low	98 Å²	98	134.9 Å²	134.9	59%	0.594	75%	0.753	S	S	*	*			trans	-86.1	148.5	-176.3	168.2	0	0	0	0	110.1	Q215	V213-Q215 HydrophobicContact CG1-CG 3.99Å
214	S	30	Very low	26.8	Very low	112 Å²	112	133.2 Å²	133.2	78%	0.783	75%	0.749	S	S	*	*			trans	-174.7	97.4	133.2	-78.5	0	0	0	0	105.9
215	Q	25.5	Very low	26.7	Very low	157 Å²	157	137.6 Å²	137.6	73%	0.734	76%	0.756	S	S	*	*				48	111.2	90	-72.6	177	-39.4	0	0	110	V213	V213-Q215 HydrophobicContact CG1-CG 3.99Å
216	D	27.7	Very low	26.3	Very low	140 Å²	140	137.2 Å²	137.2	75%	0.749	76%	0.758	S	S	*	*				-152.7	132.7	68.4	-72.7	-41.8	0	0	0	114.7
217	E	27.8	Very low	26.3	Very low	183 Å²	183	135.6 Å²	135.6	86%	0.855	74%	0.744	S	S	*	*			trans	41	125.4	131.9	-70.7	179.3	135.7	0	0	123.4
218	Q	24.9	Very low	25.9	Very low	185 Å²	185	137.4 Å²	137.4	86%	0.864	75%	0.75	S	S	*	*			trans	-43.2	145.9	153.1	-60	176.2	-34.3	0	0	112.5
219	L	27	Very low	25.7	Very low	179 Å²	179	133.9 Å²	133.9	94%	0.937	74%	0.735	S	S	*	*			trans	-165.4	134	133.2	-99.1	170.1	0	0	0	111
220	N	23.6	Very low	25.6	Very low	159 Å²	159	139.5 Å²	139.5	85%	0.85	74%	0.741	S	S	*	*			trans	-70	169.9	-179.6	-86	-35.8	0	0	0	113.7
221	A	24.8	Very low	25.4	Very low	66 Å²	66	141.3 Å²	141.3	55%	0.545	74%	0.739	S	S	.	*			trans	100	111.5	144.2	0	0	0	0	0	119.3	I323	A221-I323 HydrophobicContact CB-CD1 4.36Å
222	S	24.9	Very low	25.4	Very low	115 Å²	115	139.7 Å²	139.7	80%	0.804	73%	0.733	S	S	*	*				60.8	126.2	121.9	-47.9	0	0	0	0	121.2
223	S	25.7	Very low	25.4	Very low	114 Å²	114	136.7 Å²	136.7	80%	0.797	72%	0.716	S	S	*	*			trans	117.8	151.3	149.7	-114.9	0	0	0	0	117.2
224	P	26	Very low	25.6	Very low	95 Å²	95	139 Å²	139	62%	0.617	72%	0.724	S	S	*	*				-135.2	98.4	-104.2	31.2	-8.4	0	0	0	112.2
225	W	23.1	Very low	25.6	Very low	231 Å²	231	140.8 Å²	140.8	88%	0.875	72%	0.72	S	S	*	*			trans	-141.8	130.1	-175.1	-75.9	85	0	0	0	114.3
226	V	24.2	Very low	25.8	Very low	122 Å²	122	136.9 Å²	136.9	74%	0.739	70%	0.703	S	S	*	*			trans	81.4	109.8	146.5	-175.9	0	0	0	0	117	K228	V226-K228 PolarHBondContact O-N 3.3Å; V226-K228 VanDerWaalsContact O-N 3.08Å
227	K	25.3	Very low	25.7	Very low	103 Å²	103	132 Å²	132	45%	0.448	68%	0.677	S	S	.	*			trans	-56.4	112	169.1	-66	-169.6	-147.6	89.5	0	111.1	L430 C431	K227-L430 WeakPolarHBondContact CE-O 3.5Å; K227-L430 PolarHBondContact NZ-O 2.72Å; K227-C431 VanDerWaalsContact CE-SG 3.55Å; K227-C431 VanDerWaalsContact NZ-CA 3.28Å
228	K	24.2	Very low	26	Very low	192 Å²	192	128.8 Å²	128.8	84%	0.835	67%	0.666	S	S	*	*			trans	-63.1	124.9	160	-76.4	177	176.5	173.7	0	109.3	V226 R230	V226-K228 PolarHBondContact O-N 3.3Å; V226-K228 VanDerWaalsContact O-N 3.08Å; K228-R230 PolarHBondContact O-N 3.22Å
229	P	23.2	Very low	26.2	Very low	60 Å²	60	125 Å²	125	39%	0.39	66%	0.656	S	S	.	*			trans	-63.7	130.9	169	25.9	-29.2	0	0	0	108.7	F231	P229-F231 HydrophobicContact CB-CD2 4.47Å; P229-F231 PolarHBondContact O-N 2.92Å
230	R	25.4	Very low	26.1	Very low	217 Å²	217	122 Å²	122	82%	0.819	65%	0.647	S	S	*	*	S	Bend	trans	-68.8	78.9	170.8	-84.8	-179.7	152	146.3	-1.9	109.6	K228	K228-R230 PolarHBondContact O-N 3.22Å
231	F	24.8	Very low	26.5	Very low	160 Å²	160	123.7 Å²	123.7	70%	0.702	65%	0.646	S	S	*	*			trans	-133.7	108.9	156.6	-72.6	-74.7	0	0	0	106.7	P229 I233	P229-F231 HydrophobicContact CB-CD2 4.47Å; P229-F231 PolarHBondContact O-N 2.92Å; F231-I233 PolarHBondContact O-N 3.15Å; F231-I233 VanDerWaalsContact O-N 3.17Å
232	S	25.9	Very low	26.7	Very low	82 Å²	82	128 Å²	128	57%	0.573	66%	0.66	S	S	*	*			trans	-64.5	118.5	173.3	-76.4	0	0	0	0	108.1	L234 E235	S232-L234 PolarHBondContact O-N 2.85Å; S232-E235 PolarHBondContact O-N 3.34Å
233	I	25.8	Very low	26.6	Very low	101 Å²	101	127.8 Å²	127.8	52%	0.518	65%	0.654	S	S	.	*	G	3₁₀ helix	trans	-50.1	-20.4	173.8	-69.8	167.4	0	0	0	111.9	F231 E235 L286	F231-I233 PolarHBondContact O-N 3.15Å; F231-I233 VanDerWaalsContact O-N 3.17Å; I233-E235 PolarHBondContact O-N 3.04Å; I233-L286 HydrophobicContact CG2-CD2 3.86Å
234	L	28.3	Very low	26.8	Very low	145 Å²	145	128.4 Å²	128.4	76%	0.759	65%	0.652	S	S	*	*	G	3₁₀ helix	trans	-66.9	-24.9	172.6	-89.7	75.3	0	0	0	115.2	S232 L236	S232-L234 PolarHBondContact O-N 2.85Å; L234-L236 VanDerWaalsContact C-N 3.32Å; L234-L236 PolarHBondContact O-N 3.46Å
235	E	29	Very low	26.7	Very low	151 Å²	151	131.4 Å²	131.4	71%	0.706	66%	0.658	S	S	*	*	G	3₁₀ helix	trans	-81.4	-10.4	-178.3	-77.3	-174.2	141.6	0	0	113.8	S232 I233	S232-E235 PolarHBondContact O-N 3.34Å; I233-E235 PolarHBondContact O-N 3.04Å
236	L	29.4	Very low	26.9	Very low	74 Å²	74	127.7 Å²	127.7	39%	0.387	66%	0.656	S	S	.	*	G	3₁₀ helix	trans	-95.2	-3.3	179	-73.7	161.8	0	0	0	113.3	L234 I289	L234-L236 VanDerWaalsContact C-N 3.32Å; L234-L236 PolarHBondContact O-N 3.46Å; L236-I289 HydrophobicContact CD1-CG2 4.41Å
237	I	27.3	Very low	27.2	Very low	38 Å²	38	127.6 Å²	127.6	20%	0.195	66%	0.66	C	S	.	*			trans	-107.8	103.7	-176.2	-55	171.6	0	0	0	109.1	T239 L286	I237-T239 PolarHBondContact O-N 3.42Å; I237-L286 HydrophobicContact CD1-CD2 4.38Å
238	N	32.9	Very low	27.2	Very low	115 Å²	115	129 Å²	129	62%	0.615	68%	0.677	S	S	*	*			trans	-76.4	107.4	169.4	-84.1	-17.7	0	0	0	109.8	R273	N238-R273 PolarHBondContact ND2-NH2 3.13Å
239	T	29.5	Very low	27.6	Very low	107 Å²	107	124.8 Å²	124.8	66%	0.656	67%	0.67	S	S	*	*			trans	-82.8	125.2	160.9	54.5	0	0	0	0	109.6	I237 K241	I237-T239 PolarHBondContact O-N 3.42Å; T239-K241 PolarHBondContact O-N 3.49Å
240	P	25.6	Very low	27.7	Very low	115 Å²	115	128.4 Å²	128.4	75%	0.747	69%	0.686	S	S	*	*			trans	-74	114.3	173.5	28.5	-29.3	0	0	0	109.7	N242	P240-N242 PolarHBondContact O-N 3.16Å
241	K	31.3	Very low	27.9	Very low	194 Å²	194	126 Å²	126	84%	0.843	68%	0.684	S	S	*	*			trans	-80.3	112.4	169	-74.8	-174.3	176.5	-175.2	0	108.9	T239	T239-K241 PolarHBondContact O-N 3.49Å
242	N	28	Very low	28.1	Very low	157 Å²	157	122.6 Å²	122.6	84%	0.84	68%	0.68	S	S	*	*			trans	-67.8	129.8	165	-86.9	-29.9	0	0	0	109.3	P240	P240-N242 PolarHBondContact O-N 3.16Å
243	V	24.6	Very low	28.1	Very low	111 Å²	111	124.8 Å²	124.8	67%	0.673	69%	0.69	S	S	*	*			trans	-84.7	122.5	168.7	174.5	0	0	0	0	106.7	E245	V243-E245 HydrophobicContact CG1-CG 4.11Å
244	V	29.2	Very low	28.3	Very low	126 Å²	126	129.1 Å²	129.1	76%	0.764	71%	0.705	S	S	*	*			trans	-122.7	101.5	158.2	179.9	0	0	0	0	105.4
245	E	24.7	Very low	28.4	Very low	159 Å²	159	128 Å²	128	74%	0.743	70%	0.704	S	S	*	*			trans	-69	133.6	159.2	-72.4	165.9	175.8	0	0	106.9	V243	V243-E245 HydrophobicContact CG1-CG 4.11Å
246	N	27.4	Very low	28.3	Very low	153 Å²	153	126.3 Å²	126.3	82%	0.818	71%	0.709	S	S	*	*			trans	-159.6	109.7	151.8	-90.4	-18.6	0	0	0	108.4
247	S	29.1	Very low	28.5	Very low	120 Å²	120	126.5 Å²	126.5	84%	0.839	73%	0.728	S	S	*	*			trans	-62	137.9	164.8	26.1	0	0	0	0	111.3
248	T	26	Very low	28.4	Very low	131 Å²	131	131 Å²	131	80%	0.804	76%	0.758	S	S	*	*			trans	-55.5	160.5	163.4	46.4	0	0	0	0	111.5
249	P	32.1	Very low	28.5	Very low	105 Å²	105	135.3 Å²	135.3	68%	0.682	77%	0.771	S	S	*	*			cis	-149.1	178.9	40.7	39.6	-16.8	0	0	0	117.9
250	D	26.2	Very low	28.4	Very low	136 Å²	136	140.2 Å²	140.2	73%	0.727	78%	0.783	S	S	*	*			trans	82.3	122.1	151.7	-67.1	-24.3	0	0	0	123.4
251	H	29.8	Very low	28.6	Very low	165 Å²	165	141 Å²	141	76%	0.764	79%	0.792	S	S	*	*			trans	62.7	110.4	138.7	-76.3	-71	0	0	0	122.1
252	S	27.7	Very low	28.6	Very low	90 Å²	90	135 Å²	135	63%	0.629	78%	0.784	S	S	*	*				66.6	111.7	129.6	64	0	0	0	0	120.7
253	T	27.3	Very low	28.5	Very low	127 Å²	127	135 Å²	135	78%	0.779	79%	0.785	S	S	*	*			trans	74.3	124.4	130.8	52.2	0	0	0	0	121.4
254	K	29.8	Very low	28.7	Very low	193 Å²	193	137.3 Å²	137.3	84%	0.839	79%	0.793	S	S	*	*			trans	95.5	108.6	142	-77.8	-177.6	176.7	177.8	0	119.8
255	V	29.4	Very low	28.8	Very low	122 Å²	122	137.4 Å²	137.4	74%	0.739	79%	0.794	S	S	*	*				92.1	118.1	120	178.2	0	0	0	0	118.6
256	S	27.2	Very low	29.4	Very low	114 Å²	114	141 Å²	141	80%	0.797	80%	0.801	S	S	*	*			trans	-0.2	135.6	156.5	59.9	0	0	0	0	121.3
257	G	33.1	Very low	29.8	Very low	78 Å²	78	140.7 Å²	140.7	80%	0.804	80%	0.8	S	S	*	*			trans	-170.4	97.1	158.2	0	0	0	0	0	112
258	T	26.4	Very low	30.7	Very low	132 Å²	132	143.5 Å²	143.5	81%	0.81	80%	0.796	S	S	*	*			trans	-66.7	136.4	170.8	49.7	0	0	0	0	111.7
259	K	34	Very low	32.4	Very low	207 Å²	207	146 Å²	146	90%	0.9	79%	0.791	S	S	*	*				-177.1	139.1	126.5	-98.6	163.9	-173.9	179.8	0	113.4
260	K	28.8	Very low	33.4	Very low	209 Å²	209	143.9 Å²	143.9	91%	0.909	77%	0.771	S	S	*	*			trans	-46.6	148.2	-178.3	-64	164.2	173.6	175.9	0	116.2
261	S	28.6	Very low	35.3	Very low	132 Å²	132	143.4 Å²	143.4	92%	0.923	76%	0.763	S	S	*	*				179.7	135.4	124.6	-170.3	0	0	0	0	112.3
262	G	31.2	Very low	37.1	Very low	67 Å²	67	135.6 Å²	135.6	69%	0.691	73%	0.727	S	S	*	*			trans	117.8	62.3	157.6	0	0	0	0	0	118.7	N264	G262-N264 PolarHBondContact O-N 3.04Å; G262-N264 VanDerWaalsContact O-N 3.16Å
263	N	27	Very low	38.5	Very low	158 Å²	158	139.2 Å²	139.2	85%	0.845	73%	0.727	S	S	*	*			trans	-68.1	104.2	167	-86.8	-16.9	0	0	0	111.2
264	N	28.5	Very low	39.9	Very low	159 Å²	159	138.1 Å²	138.1	85%	0.85	72%	0.716	S	S	*	*			trans	-108.1	79.7	166.8	-106.8	-22.6	0	0	0	110	G262 R266	G262-N264 PolarHBondContact O-N 3.04Å; G262-N264 VanDerWaalsContact O-N 3.16Å; N264-R266 VanDerWaalsContact C-N 3.33Å; N264-R266 PolarHBondContact O-N 3.48Å
265	T	31.5	Very low	42.1	Very low	128 Å²	128	131 Å²	131	79%	0.785	69%	0.69	S	S	*	*			trans	-78.7	75.6	173.5	42.7	0	0	0	0	110.7	N267	T265-N267 PolarHBondContact O-N 3.06Å
266	R	36.4	Very low	43.8	Very low	234 Å²	234	130.1 Å²	130.1	88%	0.883	68%	0.681	S	S	*	*			trans	-69.4	110.3	167.7	-97.9	-178.8	-177.5	160.8	1.8	109.9	N264 K268	N264-R266 VanDerWaalsContact C-N 3.33Å; N264-R266 PolarHBondContact O-N 3.48Å; R266-K268 PolarHBondContact O-N 3.42Å
267	N	36.4	Very low	45.7	Very low	148 Å²	148	130.4 Å²	130.4	79%	0.791	67%	0.67	S	S	*	*			trans	-39.2	104.9	174.8	-82.6	-29.3	0	0	0	113.7	T265 R269	T265-N267 PolarHBondContact O-N 3.06Å; N267-R269 PolarHBondContact O-N 2.93Å
268	K	46.8	Very low	47.2	Very low	178 Å²	178	130.4 Å²	130.4	77%	0.774	65%	0.654	S	S	*	*			trans	-73	102.9	172.9	-69.2	175.9	-178.8	173	0	109.3	R266	R266-K268 PolarHBondContact O-N 3.42Å
269	R	61.3	Low	49.4	Very low	183 Å²	183	125.9 Å²	125.9	69%	0.691	62%	0.623	S	S	*	*			trans	-90.4	134.7	172.1	-66.4	-175.3	-174.9	173.4	2.6	110.8	N267 F279	N267-R269 PolarHBondContact O-N 2.93Å; R269-F279 CarbonylContact C-O 3.49Å; R269-F279 WeakPolarHBondContact CA-O 3.37Å
270	F	54.3	Low	50.5	Low	61 Å²	61	120.8 Å²	120.8	27%	0.268	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.1	133	176.7	-61.6	-91.1	0	0	0	110.1	T278 F279 T281 Q282 L285	F270-T278 CarbonylContact O-C 3.48Å; F270-T278 VanDerWaalsContact O-CA 3.27Å; F270-T278 WeakPolarHBondContact O-CA 3.39Å; F270-F279 HydrophobicContact CB-CB 4.31Å; F270-F279 PolarHBondContact N-O 3.31Å; F270-F279 PolarHBondContact O-N 2.86Å; F270-T281 VanDerWaalsContact CD2-C 3.41Å; F270-Q282 HydrophobicContact CD1-CB 4.33Å; F270-Q282 HydrophobicContact CE1-CB 3.92Å; F270-Q282 HydrophobicContact CE1-CG 4.4Å; F270-Q282 HydrophobicContact CE2-CB 4.25Å; F270-Q282 HydrophobicContact CZ-CB 3.88Å; F270-L285 HydrophobicContact CB-CB 4.27Å; F270-L285 HydrophobicContact CB-CD2 3.97Å
271	K	64.9	Low	52.3	Low	126 Å²	126	114 Å²	114	55%	0.548	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.4	128.9	-175.5	-171.5	176.8	178.2	-177.5	0	111.6	N276 H277 T278	K271-N276 WeakPolarHBondContact CE-O 3.4Å; K271-N276 WeakPolarHBondContact CE-OD1 3.42Å; K271-N276 PolarHBondContact NZ-OD1 3.16Å; K271-H277 CarbonylContact C-O 3.59Å; K271-H277 WeakPolarHBondContact CA-O 3.29Å; K271-T278 HydrophobicContact CB-CG2 4.45Å; K271-T278 HydrophobicContact CG-CG2 4.32Å
272	C	68.7	Low	53.5	Low	2 Å²	2	111.9 Å²	111.9	1%	0.014	57%	0.565	C	S	.	*			trans	-73.2	128.6	172.6	178.6	0	0	0	0	110.7	L274 C275 N276 H277 F279 L285 H288	C272-L274 VanDerWaalsContact C-N 3.32Å; C272-L274 PolarHBondContact SG-N 3.06Å; C272-L274 VanDerWaalsContact SG-N 3.4Å; C272-C275 VanDerWaalsContact CB-SG 3.58Å; C272-N276 WeakPolarHBondContact O-CA 3.49Å; C272-N276 PolarHBondContact O-N 3.28Å; C272-H277 PolarHBondContact N-O 3.07Å; C272-F279 HydrophobicContact CB-CE2 3.9Å; C272-L285 HydrophobicContact CB-CD1 3.71Å; C272-H288 VanDerWaalsContact SG-CD2 3.54Å; C272-H288 PolarHBondContact SG-NE2 2.91Å; C272-H288 VanDerWaalsContact SG-NE2 3.36Å
273	R	57.9	Low	54.9	Low	165 Å²	165	114.2 Å²	114.2	62%	0.623	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-19.9	177.3	-93.9	-178.9	172	156.4	-0.9	114.1	N238	N238-R273 PolarHBondContact ND2-NH2 3.13Å
274	L	56.3	Low	56.5	Low	104 Å²	104	108.2 Å²	108.2	55%	0.545	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-37.1	-176.1	-62.5	172.5	0	0	0	112.5	C272 L292	C272-L274 VanDerWaalsContact C-N 3.32Å; C272-L274 PolarHBondContact SG-N 3.06Å; C272-L274 VanDerWaalsContact SG-N 3.4Å; L274-L292 HydrophobicContact CB-CD1 4.11Å; L274-L292 HydrophobicContact CD1-CD1 4.16Å
275	C	75	Confident	58.2	Low	44 Å²	44	101.1 Å²	101.1	30%	0.297	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.9	1.3	-175.6	70.7	0	0	0	0	114.1	C272 H277 H288	C272-C275 VanDerWaalsContact CB-SG 3.58Å; C275-H277 PolarHBondContact O-N 2.79Å; C275-H277 VanDerWaalsContact O-N 3.1Å; C275-H277 VanDerWaalsContact SG-CD2 3.55Å; C275-H277 PolarHBondContact SG-N 3.23Å; C275-H277 VanDerWaalsContact SG-N 3.42Å; C275-H288 PolarHBondContact SG-CE1 2.64Å; C275-H288 PolarHBondContact SG-NE2 3.17Å
276	N	66.5	Low	59.4	Low	104 Å²	104	97.5 Å²	97.5	56%	0.556	47%	0.468	S	S	*	.			trans	62	5.9	-176.7	-72.3	-41.1	0	0	0	117.3	K271 C272	K271-N276 WeakPolarHBondContact CE-O 3.4Å; K271-N276 WeakPolarHBondContact CE-OD1 3.42Å; K271-N276 PolarHBondContact NZ-OD1 3.16Å; C272-N276 WeakPolarHBondContact O-CA 3.49Å; C272-N276 PolarHBondContact O-N 3.28Å
277	H	65.5	Low	60.9	Low	120 Å²	120	93.7 Å²	93.7	56%	0.556	46%	0.458	S	S	*	.			trans	-64.8	143.5	175.5	-84.4	-86.1	0	0	0	113	K271 C272 C275 F279	K271-H277 CarbonylContact C-O 3.59Å; K271-H277 WeakPolarHBondContact CA-O 3.29Å; C272-H277 PolarHBondContact N-O 3.07Å; C275-H277 PolarHBondContact O-N 2.79Å; C275-H277 VanDerWaalsContact O-N 3.1Å; C275-H277 VanDerWaalsContact SG-CD2 3.55Å; C275-H277 PolarHBondContact SG-N 3.23Å; C275-H277 VanDerWaalsContact SG-N 3.42Å; H277-F279 HydrophobicContact CB-CE2 3.73Å; H277-F279 HydrophobicContact CB-CZ 3.85Å; H277-F279 WeakPolarHBondContact O-CD2 3.18Å; H277-F279 WeakPolarHBondContact O-CE2 3.38Å
278	T	65.6	Low	62.4	Low	77 Å²	77	88.6 Å²	88.6	47%	0.472	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	137.1	177.9	59.4	0	0	0	0	111.9	F270 K271	F270-T278 CarbonylContact O-C 3.48Å; F270-T278 VanDerWaalsContact O-CA 3.27Å; F270-T278 WeakPolarHBondContact O-CA 3.39Å; K271-T278 HydrophobicContact CB-CG2 4.45Å; K271-T278 HydrophobicContact CG-CG2 4.32Å
279	F	71.6	Confident	62.9	Low	37 Å²	37	81.3 Å²	81.3	16%	0.162	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.9	-173.1	-65.7	-82.1	0	0	0	109.9	R269 F270 C272 H277 T281 S284 L285 H288	R269-F279 CarbonylContact C-O 3.49Å; R269-F279 WeakPolarHBondContact CA-O 3.37Å; F270-F279 HydrophobicContact CB-CB 4.31Å; F270-F279 PolarHBondContact N-O 3.31Å; F270-F279 PolarHBondContact O-N 2.86Å; C272-F279 HydrophobicContact CB-CE2 3.9Å; H277-F279 HydrophobicContact CB-CE2 3.73Å; H277-F279 HydrophobicContact CB-CZ 3.85Å; H277-F279 WeakPolarHBondContact O-CD2 3.18Å; H277-F279 WeakPolarHBondContact O-CE2 3.38Å; F279-T281 VanDerWaalsContact C-N 3.3Å; F279-S284 WeakPolarHBondContact CB-OG 3.42Å; F279-L285 HydrophobicContact CB-CB 4.18Å; F279-L285 HydrophobicContact CD2-CB 4.02Å; F279-L285 HydrophobicContact CD2-CD1 3.73Å; F279-L285 HydrophobicContact CD2-CG 4.49Å; F279-L285 HydrophobicContact CE2-CD1 3.95Å; F279-L285 HydrophobicContact CG-CB 4.12Å; F279-H288 HydrophobicContact CE1-CB 3.69Å; F279-H288 AromaticContact CE1-CG 3.96Å; F279-H288 HydrophobicContact CE2-CB 4.15Å; F279-H288 AromaticContact CE2-CD2 3.62Å; F279-H288 AromaticContact CE2-CG 3.87Å; F279-H288 HydrophobicContact CZ-CB 3.42Å; F279-H288 VanDerWaalsContact CZ-CB 3.42Å; F279-H288 AromaticContact CZ-CD2 3.44Å; F279-H288 VanDerWaalsContact CZ-CD2 3.44Å; F279-H288 WeakPolarHBondContact CZ-CD2 3.16Å; F279-H288 AromaticContact CZ-CG 3.2Å; F279-H288 AromaticContact CZ-ND1 3.69Å; F279-H288 AromaticContact CZ-NE2 4Å
280	S	58.5	Low	62.5	Low	100 Å²	100	76.9 Å²	76.9	70%	0.699	39%	0.389	S	S	*	.	S	Bend	trans	-74.7	-20.8	178.7	52.2	0	0	0	0	112.8
281	T	64.8	Low	63	Low	66 Å²	66	77.2 Å²	77.2	41%	0.405	40%	0.399	S	S	.	.	S	Bend	trans	-137.6	152.8	-177.2	63.5	0	0	0	0	111.6	F270 F279 I283 S284 L285	F270-T281 VanDerWaalsContact CD2-C 3.41Å; F279-T281 VanDerWaalsContact C-N 3.3Å; T281-I283 PolarHBondContact O-N 3.08Å; T281-S284 PolarHBondContact N-OG 2.73Å; T281-S284 PolarHBondContact O-N 3.26Å; T281-S284 PolarHBondContact O-OG 3.38Å; T281-S284 WeakPolarHBondContact OG1-CB 3.46Å; T281-S284 PolarHBondContact OG1-N 3.23Å; T281-S284 PolarHBondContact OG1-OG 3Å; T281-L285 PolarHBondContact O-N 2.9Å
282	Q	54.8	Low	62.4	Low	88 Å²	88	73.2 Å²	73.2	41%	0.411	38%	0.383	S	S	.	.	H	α-helix	trans	-62.9	-32.7	174.5	-174.8	175.1	-17.7	0	0	112	F270 L285 L286	F270-Q282 HydrophobicContact CD1-CB 4.33Å; F270-Q282 HydrophobicContact CE1-CB 3.92Å; F270-Q282 HydrophobicContact CE1-CG 4.4Å; F270-Q282 HydrophobicContact CE2-CB 4.25Å; F270-Q282 HydrophobicContact CZ-CB 3.88Å; Q282-L285 PolarHBondContact O-N 3.38Å; Q282-L286 HydrophobicContact CG-CD1 4.31Å; Q282-L286 WeakPolarHBondContact O-CG 2.91Å; Q282-L286 PolarHBondContact O-N 2.88Å
283	I	59.6	Low	61.2	Low	117 Å²	117	77 Å²	77	60%	0.6	40%	0.401	S	S	*	.	H	α-helix	trans	-64.7	-41.8	177.6	-62	171.8	0	0	0	111.1	T281 L286 K287	T281-I283 PolarHBondContact O-N 3.08Å; I283-L286 PolarHBondContact O-N 2.91Å; I283-K287 WeakPolarHBondContact O-CG 3.5Å; I283-K287 PolarHBondContact O-N 3.48Å
284	S	62.4	Low	60.4	Low	32 Å²	32	72.9 Å²	72.9	22%	0.224	39%	0.394	C	S	.	.	H	α-helix	trans	-69.4	-35.2	178.3	50.9	0	0	0	0	112.4	F279 T281 H288	F279-S284 WeakPolarHBondContact CB-OG 3.42Å; T281-S284 PolarHBondContact N-OG 2.73Å; T281-S284 PolarHBondContact O-N 3.26Å; T281-S284 PolarHBondContact O-OG 3.38Å; T281-S284 WeakPolarHBondContact OG1-CB 3.46Å; T281-S284 PolarHBondContact OG1-N 3.23Å; T281-S284 PolarHBondContact OG1-OG 3Å; S284-H288 WeakPolarHBondContact O-CB 3.2Å; S284-H288 PolarHBondContact O-N 3.27Å; S284-H288 VanDerWaalsContact O-N 3.11Å
285	L	63.6	Low	59.8	Low	10 Å²	10	71.6 Å²	71.6	5%	0.052	39%	0.39	C	S	.	.	H	α-helix	trans	-61.4	-44.9	169.3	174.7	64.2	0	0	0	112.1	F270 C272 F279 T281 Q282 H288 I289	F270-L285 HydrophobicContact CB-CB 4.27Å; F270-L285 HydrophobicContact CB-CD2 3.97Å; C272-L285 HydrophobicContact CB-CD1 3.71Å; F279-L285 HydrophobicContact CB-CB 4.18Å; F279-L285 HydrophobicContact CD2-CB 4.02Å; F279-L285 HydrophobicContact CD2-CD1 3.73Å; F279-L285 HydrophobicContact CD2-CG 4.49Å; F279-L285 HydrophobicContact CE2-CD1 3.95Å; F279-L285 HydrophobicContact CG-CB 4.12Å; T281-L285 PolarHBondContact O-N 2.9Å; Q282-L285 PolarHBondContact O-N 3.38Å; L285-H288 WeakPolarHBondContact O-CB 3.46Å; L285-H288 PolarHBondContact O-N 2.86Å; L285-I289 HydrophobicContact CD1-CD1 3.88Å; L285-I289 HydrophobicContact CD1-CG1 4.12Å; L285-I289 HydrophobicContact CD2-CD1 4.45Å; L285-I289 HydrophobicContact CG-CD1 3.86Å; L285-I289 HydrophobicContact CG-CG1 4.47Å; L285-I289 WeakPolarHBondContact O-CG1 3.5Å; L285-I289 PolarHBondContact O-N 3.07Å
286	L	57.5	Low	58	Low	51 Å²	51	74.1 Å²	74.1	27%	0.267	40%	0.398	S	S	.	.	H	α-helix	trans	-63.9	-43.6	179.5	-77.4	164.4	0	0	0	112.4	I233 I237 Q282 I283 H288 I289 N290	I233-L286 HydrophobicContact CG2-CD2 3.86Å; I237-L286 HydrophobicContact CD1-CD2 4.38Å; Q282-L286 HydrophobicContact CG-CD1 4.31Å; Q282-L286 WeakPolarHBondContact O-CG 2.91Å; Q282-L286 PolarHBondContact O-N 2.88Å; I283-L286 PolarHBondContact O-N 2.91Å; L286-H288 VanDerWaalsContact C-N 3.28Å; L286-H288 PolarHBondContact O-N 3.46Å; L286-I289 PolarHBondContact O-N 3.12Å; L286-N290 PolarHBondContact O-N 3.43Å
287	K	67.3	Low	56.1	Low	154 Å²	154	75.3 Å²	75.3	67%	0.67	40%	0.395	S	S	*	.	H	α-helix	trans	-58.5	-41.8	173.7	-73.6	-175.9	177.7	-173.3	0	111.6	I283 S291	I283-K287 WeakPolarHBondContact O-CG 3.5Å; I283-K287 PolarHBondContact O-N 3.48Å; K287-S291 PolarHBondContact O-N 2.85Å
288	H	68.3	Low	54.5	Low	41 Å²	41	74.5 Å²	74.5	19%	0.19	40%	0.395	C	S	.	.	H	α-helix	trans	-67.4	-43.6	178.3	171.1	75.4	0	0	0	113.4	C272 C275 F279 S284 L285 L286 N290 S291 L292	C272-H288 VanDerWaalsContact SG-CD2 3.54Å; C272-H288 PolarHBondContact SG-NE2 2.91Å; C272-H288 VanDerWaalsContact SG-NE2 3.36Å; C275-H288 PolarHBondContact SG-CE1 2.64Å; C275-H288 PolarHBondContact SG-NE2 3.17Å; F279-H288 HydrophobicContact CE1-CB 3.69Å; F279-H288 AromaticContact CE1-CG 3.96Å; F279-H288 HydrophobicContact CE2-CB 4.15Å; F279-H288 AromaticContact CE2-CD2 3.62Å; F279-H288 AromaticContact CE2-CG 3.87Å; F279-H288 HydrophobicContact CZ-CB 3.42Å; F279-H288 VanDerWaalsContact CZ-CB 3.42Å; F279-H288 AromaticContact CZ-CD2 3.44Å; F279-H288 VanDerWaalsContact CZ-CD2 3.44Å; F279-H288 WeakPolarHBondContact CZ-CD2 3.16Å; F279-H288 AromaticContact CZ-CG 3.2Å; F279-H288 AromaticContact CZ-ND1 3.69Å; F279-H288 AromaticContact CZ-NE2 4Å; S284-H288 WeakPolarHBondContact O-CB 3.2Å; S284-H288 PolarHBondContact O-N 3.27Å; S284-H288 VanDerWaalsContact O-N 3.11Å; L285-H288 WeakPolarHBondContact O-CB 3.46Å; L285-H288 PolarHBondContact O-N 2.86Å; L286-H288 VanDerWaalsContact C-N 3.28Å; L286-H288 PolarHBondContact O-N 3.46Å; H288-N290 VanDerWaalsContact C-N 3.33Å; H288-N290 PolarHBondContact O-N 3.38Å; H288-S291 PolarHBondContact O-N 2.87Å; H288-L292 VanDerWaalsContact CE1-CD1 3.48Å; H288-L292 WeakPolarHBondContact CE1-CD1 3.17Å; H288-L292 WeakPolarHBondContact NE2-CD1 3.47Å; H288-L292 PolarHBondContact O-N 3.08Å
289	I	57.3	Low	52.8	Low	26 Å²	26	74.8 Å²	74.8	13%	0.133	40%	0.4	C	S	.	.	H	α-helix	trans	-62.3	-42.2	176	-68.8	168.5	0	0	0	110.8	L236 L285 L286 L292 H293	L236-I289 HydrophobicContact CD1-CG2 4.41Å; L285-I289 HydrophobicContact CD1-CD1 3.88Å; L285-I289 HydrophobicContact CD1-CG1 4.12Å; L285-I289 HydrophobicContact CD2-CD1 4.45Å; L285-I289 HydrophobicContact CG-CD1 3.86Å; L285-I289 HydrophobicContact CG-CG1 4.47Å; L285-I289 WeakPolarHBondContact O-CG1 3.5Å; L285-I289 PolarHBondContact O-N 3.07Å; L286-I289 PolarHBondContact O-N 3.12Å; I289-L292 PolarHBondContact O-N 2.75Å; I289-H293 PolarHBondContact O-N 2.59Å
290	N	51.7	Low	50.8	Low	90 Å²	90	80.3 Å²	80.3	48%	0.481	43%	0.426	S	S	.	.	H	α-helix	trans	-62.1	-45.7	176.8	-74.4	-12.2	0	0	0	111.1	L286 H288 L292 H293 T294	L286-N290 PolarHBondContact O-N 3.43Å; H288-N290 VanDerWaalsContact C-N 3.33Å; H288-N290 PolarHBondContact O-N 3.38Å; N290-L292 PolarHBondContact O-N 3.48Å; N290-H293 PolarHBondContact O-N 3.17Å; N290-H293 VanDerWaalsContact O-N 3.14Å; N290-T294 PolarHBondContact O-N 3.29Å; N290-T294 PolarHBondContact O-OG1 3Å
291	S	64.3	Low	49.4	Very low	68 Å²	68	79.1 Å²	79.1	48%	0.476	42%	0.422	S	S	.	.	H	α-helix	trans	-59.5	-42.1	176.5	-179.7	0	0	0	0	113.3	K287 H288 H293 T294 T295	K287-S291 PolarHBondContact O-N 2.85Å; H288-S291 PolarHBondContact O-N 2.87Å; S291-H293 VanDerWaalsContact C-N 3.33Å; S291-H293 PolarHBondContact O-N 2.9Å; S291-T294 PolarHBondContact O-N 3.07Å; S291-T295 WeakPolarHBondContact O-CG2 3.49Å; S291-T295 PolarHBondContact O-N 3.3Å; S291-T295 PolarHBondContact O-OG1 3.29Å
292	L	53.6	Low	47.6	Very low	41 Å²	41	82 Å²	82	22%	0.215	44%	0.435	C	S	.	.	H	α-helix	trans	-61.6	-37.9	173.6	-88.5	159.8	0	0	0	113.2	L274 H288 I289 N290 T295 Q296	L274-L292 HydrophobicContact CB-CD1 4.11Å; L274-L292 HydrophobicContact CD1-CD1 4.16Å; H288-L292 VanDerWaalsContact CE1-CD1 3.48Å; H288-L292 WeakPolarHBondContact CE1-CD1 3.17Å; H288-L292 WeakPolarHBondContact NE2-CD1 3.47Å; H288-L292 PolarHBondContact O-N 3.08Å; I289-L292 PolarHBondContact O-N 2.75Å; N290-L292 PolarHBondContact O-N 3.48Å; L292-T295 WeakPolarHBondContact CA-OG1 3.31Å; L292-T295 PolarHBondContact O-OG1 2.85Å; L292-Q296 WeakPolarHBondContact O-CB 3.39Å; L292-Q296 WeakPolarHBondContact O-CG 3.49Å; L292-Q296 PolarHBondContact O-N 3.38Å
293	H	42.9	Very low	46.3	Very low	83 Å²	83	82.9 Å²	82.9	38%	0.384	45%	0.451	S	S	.	.	H	α-helix	trans	-72.2	-35.2	178.7	-165.7	-90.3	0	0	0	111.3	I289 N290 S291 Y297	I289-H293 PolarHBondContact O-N 2.59Å; N290-H293 PolarHBondContact O-N 3.17Å; N290-H293 VanDerWaalsContact O-N 3.14Å; S291-H293 VanDerWaalsContact C-N 3.33Å; S291-H293 PolarHBondContact O-N 2.9Å; H293-Y297 AromaticContact CE1-CD2 3.55Å; H293-Y297 AromaticContact CE1-CE2 3.32Å; H293-Y297 WeakPolarHBondContact CE1-CE2 3.43Å; H293-Y297 AromaticContact ND1-CD2 3.79Å; H293-Y297 AromaticContact NE2-CE2 3.91Å; H293-Y297 PolarHBondContact O-N 3.49Å; H293-Y297 VanDerWaalsContact O-N 3.07Å
294	T	40.8	Very low	44.7	Very low	78 Å²	78	82.4 Å²	82.4	48%	0.479	46%	0.455	S	S	.	.	H	α-helix	trans	-65.9	-41.5	173.4	-21.8	0	0	0	0	111.6	N290 S291 Y297 L298	N290-T294 PolarHBondContact O-N 3.29Å; N290-T294 PolarHBondContact O-OG1 3Å; S291-T294 PolarHBondContact O-N 3.07Å; T294-Y297 PolarHBondContact O-N 3.23Å; T294-L298 HydrophobicContact CG2-CD1 4.45Å; T294-L298 WeakPolarHBondContact O-CB 3.34Å; T294-L298 WeakPolarHBondContact O-CD1 3.23Å; T294-L298 VanDerWaalsContact O-CG 3.27Å; T294-L298 WeakPolarHBondContact O-CG 3.43Å; T294-L298 PolarHBondContact O-N 3.06Å
295	T	43.9	Very low	43.1	Very low	76 Å²	76	88.3 Å²	88.3	47%	0.466	49%	0.485	S	S	.	.	H	α-helix	trans	-70.2	-33.9	178.1	53.5	0	0	0	0	112.9	S291 L292 S299	S291-T295 WeakPolarHBondContact O-CG2 3.49Å; S291-T295 PolarHBondContact O-N 3.3Å; S291-T295 PolarHBondContact O-OG1 3.29Å; L292-T295 WeakPolarHBondContact CA-OG1 3.31Å; L292-T295 PolarHBondContact O-OG1 2.85Å; T295-S299 WeakPolarHBondContact O-CB 3.38Å; T295-S299 PolarHBondContact O-N 3.41Å; T295-S299 PolarHBondContact O-OG 3.01Å
296	Q	37.1	Very low	41.4	Very low	98 Å²	98	94.5 Å²	94.5	46%	0.458	52%	0.523	S	S	.	.	H	α-helix	trans	-68.4	-31.9	171.5	-80.8	-175.3	-28	0	0	113.7	L292 S299 Q300	L292-Q296 WeakPolarHBondContact O-CB 3.39Å; L292-Q296 WeakPolarHBondContact O-CG 3.49Å; L292-Q296 PolarHBondContact O-N 3.38Å; Q296-S299 PolarHBondContact O-OG 3.31Å; Q296-S299 VanDerWaalsContact O-OG 3.12Å; Q296-Q300 WeakPolarHBondContact O-CG 3.38Å; Q296-Q300 PolarHBondContact O-N 3.29Å
297	Y	27.4	Very low	39.8	Very low	128 Å²	128	97.5 Å²	97.5	50%	0.502	55%	0.545	S	S	.	.	H	α-helix	trans	-74.1	-39.6	174.2	-106.8	-96	0	0	0	112	H293 T294 Q300 A301	H293-Y297 AromaticContact CE1-CD2 3.55Å; H293-Y297 AromaticContact CE1-CE2 3.32Å; H293-Y297 WeakPolarHBondContact CE1-CE2 3.43Å; H293-Y297 AromaticContact ND1-CD2 3.79Å; H293-Y297 AromaticContact NE2-CE2 3.91Å; H293-Y297 PolarHBondContact O-N 3.49Å; H293-Y297 VanDerWaalsContact O-N 3.07Å; T294-Y297 PolarHBondContact O-N 3.23Å; Y297-Q300 PolarHBondContact O-N 2.86Å; Y297-A301 PolarHBondContact O-N 3.35Å; Y297-A301 VanDerWaalsContact O-N 3.15Å
298	L	30.8	Very low	37.7	Very low	103 Å²	103	98.6 Å²	98.6	54%	0.539	56%	0.557	S	S	.	*	H	α-helix	trans	-69.4	-31	177.2	-70.9	165.2	0	0	0	112.4	T294 N302	T294-L298 HydrophobicContact CG2-CD1 4.45Å; T294-L298 WeakPolarHBondContact O-CB 3.34Å; T294-L298 WeakPolarHBondContact O-CD1 3.23Å; T294-L298 VanDerWaalsContact O-CG 3.27Å; T294-L298 WeakPolarHBondContact O-CG 3.43Å; T294-L298 PolarHBondContact O-N 3.06Å; L298-N302 PolarHBondContact O-ND2 3.37Å
299	S	30.3	Very low	35.7	Very low	84 Å²	84	103 Å²	103	59%	0.587	59%	0.588	S	S	*	*	H	α-helix	trans	-76	-25.4	174.6	65.1	0	0	0	0	113.9	T295 Q296	T295-S299 WeakPolarHBondContact O-CB 3.38Å; T295-S299 PolarHBondContact O-N 3.41Å; T295-S299 PolarHBondContact O-OG 3.01Å; Q296-S299 PolarHBondContact O-OG 3.31Å; Q296-S299 VanDerWaalsContact O-OG 3.12Å
300	Q	30.8	Very low	34	Very low	153 Å²	153	107.1 Å²	107.1	72%	0.715	62%	0.618	S	S	*	*	H	α-helix	trans	-82.1	-21.3	173.4	-73.7	176	35.9	0	0	113.3	Q296 Y297	Q296-Q300 WeakPolarHBondContact O-CG 3.38Å; Q296-Q300 PolarHBondContact O-N 3.29Å; Y297-Q300 PolarHBondContact O-N 2.86Å
301	A	27.7	Very low	32.7	Very low	74 Å²	74	108.2 Å²	108.2	61%	0.612	63%	0.633	S	S	*	*	H	α-helix	trans	-82.6	-12.9	177.2	0	0	0	0	0	113.7	Y297	Y297-A301 PolarHBondContact O-N 3.35Å; Y297-A301 VanDerWaalsContact O-N 3.15Å
302	N	28.1	Very low	30.9	Very low	127 Å²	127	110 Å²	110	68%	0.679	65%	0.646	S	S	*	*			trans	-107.7	45	-173.2	-72.1	-18.5	0	0	0	113.8	L298	L298-N302 PolarHBondContact O-ND2 3.37Å
303	S	26.2	Very low	29.4	Very low	106 Å²	106	113.9 Å²	113.9	74%	0.741	67%	0.671	S	S	*	*			trans	-93.8	116.6	166.1	-163.7	0	0	0	0	109.3
304	P	27.7	Very low	28.4	Very low	107 Å²	107	117.3 Å²	117.3	70%	0.695	69%	0.692	S	S	*	*			trans	-85.8	120.1	-173.3	32.6	-28.4	0	0	0	109.8
305	D	27.3	Very low	27.5	Very low	157 Å²	157	119.7 Å²	119.7	84%	0.84	71%	0.706	S	S	*	*			trans	-160.4	121.1	155.5	-91.8	-36.5	0	0	0	110
306	V	28.5	Very low	26.5	Very low	140 Å²	140	122.9 Å²	122.9	85%	0.848	73%	0.725	S	S	*	*	S	Bend	trans	97	128.8	164.6	-167.3	0	0	0	0	117
307	P	24.9	Very low	25.8	Very low	114 Å²	114	126.9 Å²	126.9	74%	0.74	74%	0.744	S	S	*	*			trans	-91.6	148.4	-146.1	35.3	-33	0	0	0	115.3
308	L	22	Very low	25.7	Very low	176 Å²	176	126.8 Å²	126.8	92%	0.921	76%	0.762	S	S	*	*			trans	-67.5	124.8	168.8	-69.1	163.2	0	0	0	110.1
309	T	25.8	Very low	25.2	Very low	135 Å²	135	129.5 Å²	129.5	83%	0.828	78%	0.777	S	S	*	*			trans	-119.5	130.5	150.7	50	0	0	0	0	109
310	S	21.8	Very low	24.9	Very low	111 Å²	111	134.5 Å²	134.5	78%	0.776	79%	0.791	S	S	*	*			trans	-65	142.3	-170.2	47.6	0	0	0	0	114.8
311	S	25.9	Very low	24.4	Very low	114 Å²	114	133 Å²	133	80%	0.797	79%	0.792	S	S	*	*				-167.2	116.5	129.3	6.9	0	0	0	0	112.8
312	S	25.3	Very low	24.3	Very low	105 Å²	105	135.3 Å²	135.3	73%	0.734	80%	0.799	S	S	*	*			trans	52.8	96	142.5	57.6	0	0	0	0	121.5
313	V	21.5	Very low	24	Very low	122 Å²	122	134.6 Å²	134.6	74%	0.739	79%	0.794	S	S	*	*				38.5	109.6	99.8	-176.8	0	0	0	0	117.4
314	N	22	Very low	23.8	Very low	155 Å²	155	137.5 Å²	137.5	83%	0.829	80%	0.795	S	S	*	*				167.3	137	103.9	-104	-21.1	0	0	0	113.2
315	V	21.8	Very low	23.5	Very low	129 Å²	129	139.8 Å²	139.8	78%	0.782	80%	0.802	S	S	*	*			trans	-81.6	135.2	171.4	173.9	0	0	0	0	109.2
316	T	24.2	Very low	23.5	Very low	142 Å²	142	138.5 Å²	138.5	87%	0.871	80%	0.795	S	S	*	*			trans	-147.5	140.4	147.7	42	0	0	0	0	110.3
317	E	21.3	Very low	23.3	Very low	183 Å²	183	141.4 Å²	141.4	86%	0.855	80%	0.796	S	S	*	*			trans	-76.4	135.5	-172.7	-61	162.1	142.4	0	0	112
318	S	24.8	Very low	23.3	Very low	125 Å²	125	141.9 Å²	141.9	87%	0.874	79%	0.792	S	S	*	*			trans	-161.4	115.5	143	-30.3	0	0	0	0	109.9
319	N	21.8	Very low	23.3	Very low	161 Å²	161	137.5 Å²	137.5	86%	0.861	79%	0.789	S	S	*	*			trans	-72.4	133.9	170.6	-74.8	-40.8	0	0	0	110.4
320	E	22.8	Very low	23.3	Very low	188 Å²	188	140 Å²	140	88%	0.879	79%	0.789	S	S	*	*			trans	-161.6	119.8	139.4	-110.7	172.8	-161.7	0	0	110.2
321	V	21.9	Very low	23.3	Very low	122 Å²	122	139 Å²	139	74%	0.739	79%	0.787	S	S	*	*			trans	-105.6	116.6	-178.7	171.7	0	0	0	0	107.9	I323	V321-I323 HydrophobicContact CG1-CD1 4.41Å; V321-I323 HydrophobicContact CG1-CG1 3.79Å
322	V	24	Very low	23.3	Very low	123 Å²	123	143.8 Å²	143.8	75%	0.745	79%	0.789	S	S	*	*			trans	-106.5	113.3	165.5	178.6	0	0	0	0	108.1
323	I	21.9	Very low	23.3	Very low	111 Å²	111	147 Å²	147	57%	0.569	79%	0.793	S	S	*	*			trans	-89.1	117.3	175.7	-57.4	176.6	0	0	0	108.1	A221 V321	A221-I323 HydrophobicContact CB-CD1 4.36Å; V321-I323 HydrophobicContact CG1-CD1 4.41Å; V321-I323 HydrophobicContact CG1-CG1 3.79Å
324	H	23.6	Very low	23.7	Very low	168 Å²	168	147.2 Å²	147.2	78%	0.778	79%	0.79	S	S	*	*			trans	-109.4	109.2	159.9	-92.1	-71.6	0	0	0	109.3	N326	H324-N326 PolarHBondContact O-N 3.17Å
325	D	21.2	Very low	23.8	Very low	155 Å²	155	148.3 Å²	148.3	83%	0.829	79%	0.792	S	S	*	*			trans	-64.2	119.4	162.4	-81.9	-38.6	0	0	0	109.3
326	N	25.7	Very low	24.1	Very low	129 Å²	129	146 Å²	146	69%	0.69	78%	0.781	S	S	*	*			trans	-125.1	98	168.1	-153.8	-19.8	0	0	0	110	H324 N328	H324-N326 PolarHBondContact O-N 3.17Å; N326-N328 PolarHBondContact O-N 3.41Å; N326-N328 PolarHBondContact OD1-ND2 3.43Å
327	K	24.1	Very low	24.2	Very low	202 Å²	202	142.6 Å²	142.6	88%	0.878	77%	0.774	S	S	*	*			trans	-56.8	100.2	157.2	-69	173.7	178.6	173	0	107.8
328	N	24.9	Very low	24.5	Very low	123 Å²	123	141.9 Å²	141.9	66%	0.658	77%	0.772	S	S	*	*			trans	-157.9	115.9	161.8	-93.8	-43.3	0	0	0	110.9	N326 K330	N326-N328 PolarHBondContact O-N 3.41Å; N326-N328 PolarHBondContact OD1-ND2 3.43Å; N328-K330 PolarHBondContact O-N 3.27Å
329	G	22.3	Very low	24.5	Very low	84 Å²	84	143.3 Å²	143.3	87%	0.866	77%	0.77	S	S	*	*			trans	-60.3	120.1	165.8	0	0	0	0	0	109.8
330	K	25.8	Very low	24.6	Very low	188 Å²	188	144.6 Å²	144.6	82%	0.817	77%	0.768	S	S	*	*			trans	-138.2	122.6	160.5	-77.9	-172.8	177.6	175.7	0	108.2	N328 Y332	N328-K330 PolarHBondContact O-N 3.27Å; K330-Y332 PolarHBondContact O-N 2.65Å
331	A	23.4	Very low	24.8	Very low	90 Å²	90	140.4 Å²	140.4	74%	0.744	76%	0.759	S	S	*	*			trans	-51.1	129.5	174.9	0	0	0	0	0	110.7	Q333	A331-Q333 PolarHBondContact O-N 3.37Å
332	Y	25.4	Very low	25	Very low	214 Å²	214	145.5 Å²	145.5	84%	0.839	77%	0.765	S	S	*	*			trans	-68.2	86.9	163.2	-85.5	-86.3	0	0	0	108.5	K330 N334	K330-Y332 PolarHBondContact O-N 2.65Å; Y332-N334 VanDerWaalsContact C-N 3.29Å; Y332-N334 PolarHBondContact O-N 3.44Å
333	Q	25.5	Very low	25	Very low	172 Å²	172	147.3 Å²	147.3	80%	0.804	77%	0.771	S	S	*	*			trans	-66.2	89.7	161.6	-78.1	-178.1	-19.9	0	0	108.4	A331 M335	A331-Q333 PolarHBondContact O-N 3.37Å; Q333-M335 PolarHBondContact O-N 3.43Å
334	N	29.4	Very low	25.2	Very low	128 Å²	128	147.7 Å²	147.7	68%	0.684	78%	0.778	S	S	*	*			trans	-93.5	92.9	166.6	-73.6	-22.8	0	0	0	108.1	Y332 C336	Y332-N334 VanDerWaalsContact C-N 3.29Å; Y332-N334 PolarHBondContact O-N 3.44Å; N334-C336 PolarHBondContact O-N 3.44Å
335	M	24.3	Very low	25.2	Very low	178 Å²	178	146.3 Å²	146.3	88%	0.877	78%	0.776	S	S	*	*			trans	-61.3	113.4	176.6	-68.7	-148.3	74.3	0	0	110.7	Q333	Q333-M335 PolarHBondContact O-N 3.43Å
336	C	27.6	Very low	25.5	Very low	81 Å²	81	147 Å²	147	55%	0.547	78%	0.779	S	S	.	*			trans	-125.6	109.1	153.9	-169.6	0	0	0	0	105.7	N334 M338 M438	N334-C336 PolarHBondContact O-N 3.44Å; C336-M338 PolarHBondContact O-N 3.11Å; C336-M338 VanDerWaalsContact O-N 3.1Å; C336-M438 HydrophobicContact CB-CE 4.45Å
337	G	26.3	Very low	25.3	Very low	69 Å²	69	147.8 Å²	147.8	71%	0.711	78%	0.783	S	S	*	*			trans	-55.8	114.1	-174.6	0	0	0	0	0	111.3	N339	G337-N339 PolarHBondContact O-N 3.25Å
338	M	27.7	Very low	25.5	Very low	168 Å²	168	144.6 Å²	144.6	83%	0.828	78%	0.781	S	S	*	*			trans	-72.3	105.5	168	-64.6	-179	74.9	0	0	107.8	C336 K340	C336-M338 PolarHBondContact O-N 3.11Å; C336-M338 VanDerWaalsContact O-N 3.1Å; M338-K340 VanDerWaalsContact C-N 3.26Å; M338-K340 PolarHBondContact O-N 3.47Å
339	N	24.6	Very low	25.6	Very low	156 Å²	156	142.7 Å²	142.7	83%	0.834	79%	0.79	S	S	*	*			trans	-64.4	95.1	161.4	-91.1	-17.9	0	0	0	108.3	G337 S341	G337-N339 PolarHBondContact O-N 3.25Å; N339-S341 VanDerWaalsContact C-N 3.26Å; N339-S341 PolarHBondContact O-N 3.28Å
340	K	24.5	Very low	25.7	Very low	188 Å²	188	141.8 Å²	141.8	82%	0.817	78%	0.781	S	S	*	*			trans	-71	80.7	163.5	-71.9	179.9	179.3	177.2	0	108.2	M338 R342	M338-K340 VanDerWaalsContact C-N 3.26Å; M338-K340 PolarHBondContact O-N 3.47Å; K340-R342 PolarHBondContact O-N 3.45Å
341	S	27.2	Very low	25.7	Very low	99 Å²	99	140.1 Å²	140.1	69%	0.692	78%	0.78	S	S	*	*			trans	-88.8	88.2	163.6	-60.9	0	0	0	0	108.6	N339 N343	N339-S341 VanDerWaalsContact C-N 3.26Å; N339-S341 PolarHBondContact O-N 3.28Å; S341-N343 PolarHBondContact O-N 3.31Å; S341-N343 VanDerWaalsContact O-N 3.17Å
342	R	25.6	Very low	25.7	Very low	229 Å²	229	140.9 Å²	140.9	86%	0.864	78%	0.781	S	S	*	*			trans	-55.2	107.6	150.4	-84.6	175.8	163.7	142.1	-6.3	106.2	K340 V344	K340-R342 PolarHBondContact O-N 3.45Å; R342-V344 HydrophobicContact CB-CG2 4.32Å; R342-V344 PolarHBondContact O-N 3.05Å
343	N	24.9	Very low	25.8	Very low	161 Å²	161	135.6 Å²	135.6	86%	0.861	78%	0.775	S	S	*	*			trans	-71.7	91.2	160.6	-92.5	-23.2	0	0	0	106.7	S341	S341-N343 PolarHBondContact O-N 3.31Å; S341-N343 VanDerWaalsContact O-N 3.17Å
344	V	25.7	Very low	25.7	Very low	119 Å²	119	134.1 Å²	134.1	72%	0.721	78%	0.778	S	S	*	*			trans	-66.1	132.1	162.4	173.6	0	0	0	0	107	R342	R342-V344 HydrophobicContact CB-CG2 4.32Å; R342-V344 PolarHBondContact O-N 3.05Å
345	L	22.9	Very low	25.6	Very low	139 Å²	139	131.6 Å²	131.6	73%	0.728	78%	0.782	S	S	*	*			trans	-42.4	138.2	172	-86.7	77.6	0	0	0	112.1
346	L	27	Very low	25.5	Very low	170 Å²	170	131.8 Å²	131.8	89%	0.89	79%	0.786	S	S	*	*			trans	-141.5	98.5	141	-97.7	148.7	0	0	0	107.5
347	N	22	Very low	25.4	Very low	146 Å²	146	133.2 Å²	133.2	78%	0.781	80%	0.797	S	S	*	*			trans	-76	120.2	163.3	-98.2	-9.1	0	0	0	108.4
348	T	29.3	Very low	25.3	Very low	135 Å²	135	136.4 Å²	136.4	83%	0.828	80%	0.802	S	S	*	*			trans	-156.2	105.4	146.9	49.4	0	0	0	0	103.6
349	G	25.7	Very low	25.2	Very low	83 Å²	83	136 Å²	136	86%	0.856	80%	0.801	S	S	*	*			cis	103.5	105	45.9	0	0	0	0	0	107.7
350	G	25.9	Very low	25.1	Very low	65 Å²	65	132.9 Å²	132.9	67%	0.67	79%	0.792	S	S	*	*			trans	104.2	104.3	153.4	0	0	0	0	0	118.8
351	N	25.2	Very low	25.1	Very low	152 Å²	152	129 Å²	129	81%	0.813	79%	0.789	S	S	*	*				68.9	100.7	127.8	-59.7	-0.4	0	0	0	118.1
352	S	23.3	Very low	25.1	Very low	107 Å²	107	131.8 Å²	131.8	75%	0.748	79%	0.794	S	S	*	*				81.8	118.2	85.4	73.3	0	0	0	0	113.7
353	S	26.5	Very low	25.1	Very low	102 Å²	102	125.6 Å²	125.6	71%	0.713	79%	0.786	S	S	*	*			trans	124.2	110.1	144.3	78.6	0	0	0	0	114.7
354	T	25.4	Very low	25.1	Very low	141 Å²	141	123.3 Å²	123.3	87%	0.865	78%	0.782	S	S	*	*			trans	50.6	122.3	134.2	57.6	0	0	0	0	119.5
355	G	26.1	Very low	25.5	Very low	76 Å²	76	123.6 Å²	123.6	78%	0.784	79%	0.79	S	S	*	*			trans	143.1	97.6	151	0	0	0	0	0	114
356	L	22.3	Very low	25.7	Very low	181 Å²	181	128.1 Å²	128.1	95%	0.948	80%	0.797	S	S	*	*			trans	-62.9	131.4	160.5	-75.1	153.6	0	0	0	109.7
357	S	26.2	Very low	25.9	Very low	111 Å²	111	127.4 Å²	127.4	78%	0.776	80%	0.795	S	S	*	*			trans	-157	121.6	148.2	50.4	0	0	0	0	111.6
358	V	22.6	Very low	26.5	Very low	136 Å²	136	129.3 Å²	129.3	82%	0.824	80%	0.796	S	S	*	*			trans	-75.5	124.6	168.3	170.7	0	0	0	0	107.9
359	I	26.5	Very low	26.4	Very low	159 Å²	159	130.4 Å²	130.4	82%	0.815	80%	0.796	S	S	*	*			trans	-143.7	126	156.8	-61.5	-174.1	0	0	0	110.1
360	S	22.3	Very low	26.6	Very low	91 Å²	91	130.3 Å²	130.3	64%	0.636	80%	0.796	S	S	*	*			trans	-73.5	162	172.3	-55.6	0	0	0	0	113.5
361	S	24.1	Very low	26.6	Very low	107 Å²	107	134.3 Å²	134.3	75%	0.748	80%	0.802	S	S	*	*			trans	88	142.1	146.1	-49.3	0	0	0	0	119.1
362	I	28	Very low	26.8	Very low	158 Å²	158	132.2 Å²	132.2	81%	0.81	80%	0.799	S	S	*	*			trans	141.7	93	149.7	-69.8	156.8	0	0	0	107.3
363	S	25.6	Very low	26.9	Very low	99 Å²	99	134 Å²	134	69%	0.692	80%	0.801	S	S	*	*				76.9	118.5	78.2	-55.2	0	0	0	0	115.2
364	S	25.4	Very low	26.8	Very low	112 Å²	112	139.6 Å²	139.6	78%	0.783	81%	0.807	S	S	*	*			trans	68.2	123	139.8	-55.8	0	0	0	0	120.8
365	S	32.5	Very low	26.8	Very low	126 Å²	126	137.5 Å²	137.5	88%	0.881	80%	0.798	S	S	*	*				179	148.4	109.7	-75.6	0	0	0	0	113.9
366	R	28	Very low	26.8	Very low	233 Å²	233	138.6 Å²	138.6	88%	0.879	79%	0.794	S	S	*	*			trans	-84.9	161.9	-166.4	-62.8	164.6	178	164.8	-1.8	113.8
367	N	32.1	Very low	27	Very low	156 Å²	156	138.6 Å²	138.6	83%	0.834	79%	0.79	S	S	*	*			trans	162.3	102.9	134.1	-77.3	-16.8	0	0	0	108.7
368	K	33.6	Very low	27.1	Very low	186 Å²	186	142 Å²	142	81%	0.809	80%	0.795	S	S	*	*				64.3	106	85.5	-79.5	-162.3	177.4	-174.7	0	116.7
369	D	26.5	Very low	27.3	Very low	157 Å²	157	142.8 Å²	142.8	84%	0.84	80%	0.795	S	S	*	*			trans	47.4	127.4	135.4	-45.3	-34.3	0	0	0	121.4
370	G	31	Very low	27.2	Very low	82 Å²	82	140.8 Å²	140.8	85%	0.845	80%	0.795	S	S	*	*			trans	166	94.1	165.3	0	0	0	0	0	115.4
371	N	24.5	Very low	27.5	Very low	148 Å²	148	142 Å²	142	79%	0.791	80%	0.799	S	S	*	*			trans	-52.3	145	176.3	-165	19.7	0	0	0	115.9
372	S	31	Very low	27.7	Very low	109 Å²	109	145.1 Å²	145.1	76%	0.762	80%	0.803	S	S	*	*				157.4	143.4	126.8	55.4	0	0	0	0	114.3
373	D	25.5	Very low	27.7	Very low	145 Å²	145	143.1 Å²	143.1	78%	0.775	80%	0.799	S	S	*	*			trans	-60.7	136.1	-169.6	-55.5	-64.3	0	0	0	116.1
374	Y	23.6	Very low	27.9	Very low	218 Å²	218	143 Å²	143	86%	0.855	80%	0.798	S	S	*	*				168.4	143.9	120.8	-117.3	-106.5	0	0	0	110.5
375	S	25.1	Very low	28.1	Very low	97 Å²	97	144.2 Å²	144.2	68%	0.678	80%	0.801	S	S	*	*			trans	98.1	124.3	157	-51	0	0	0	0	119
376	S	26.8	Very low	28.3	Very low	99 Å²	99	142.8 Å²	142.8	69%	0.692	79%	0.787	S	S	*	*			trans	72.4	111.7	140	44	0	0	0	0	119
377	Q	26.2	Very low	28.5	Very low	182 Å²	182	138 Å²	138	85%	0.85	78%	0.784	S	S	*	*			trans	47.6	102.7	131.4	-67	172.8	-17.3	0	0	115.8
378	M	27.6	Very low	28.9	Very low	182 Å²	182	135.3 Å²	135.3	90%	0.897	77%	0.773	S	S	*	*			trans	-151.6	114.8	134.7	-80.8	-133.4	178.7	0	0	110.5	S380	M378-S380 PolarHBondContact O-N 3.5Å
379	N	27.2	Very low	29.2	Very low	152 Å²	152	131.5 Å²	131.5	81%	0.813	77%	0.766	S	S	*	*			trans	-58.4	118.4	156.4	-69.6	-38.7	0	0	0	107.4	T381	N379-T381 PolarHBondContact O-N 2.82Å; N379-T381 PolarHBondContact O-OG1 3.12Å
380	S	25.2	Very low	29.8	Very low	117 Å²	117	128.6 Å²	128.6	82%	0.818	76%	0.757	S	S	*	*			trans	-67.8	79.3	179.3	-58.3	0	0	0	0	111.6	M378 M382	M378-S380 PolarHBondContact O-N 3.5Å; S380-M382 PolarHBondContact O-N 2.94Å
381	T	28.4	Very low	30.2	Very low	118 Å²	118	129.9 Å²	129.9	72%	0.724	75%	0.748	S	S	*	*			trans	-73.9	100.7	160.2	3.3	0	0	0	0	108.4	N379 T383	N379-T381 PolarHBondContact O-N 2.82Å; N379-T381 PolarHBondContact O-OG1 3.12Å; T381-T383 VanDerWaalsContact C-N 3.25Å; T381-T383 PolarHBondContact O-N 3.32Å
382	M	27.2	Very low	30.8	Very low	171 Å²	171	127.4 Å²	127.4	84%	0.842	74%	0.74	S	S	*	*			trans	-70.5	84.1	165.3	-80.3	-78.6	149.8	0	0	109.2	S380 S384	S380-M382 PolarHBondContact O-N 2.94Å; M382-S384 PolarHBondContact O-N 3.14Å
383	T	27.6	Very low	31.1	Very low	116 Å²	116	128 Å²	128	71%	0.712	74%	0.735	S	S	*	*			trans	-73.5	90.7	163.2	33.4	0	0	0	0	109	T381 T385	T381-T383 VanDerWaalsContact C-N 3.25Å; T381-T383 PolarHBondContact O-N 3.32Å; T383-T385 PolarHBondContact O-N 3.19Å; T383-T385 VanDerWaalsContact O-N 3.08Å
384	S	30.5	Very low	31.6	Very low	97 Å²	97	129.5 Å²	129.5	68%	0.678	74%	0.737	S	S	*	*			trans	-76.3	90	167.9	-55.4	0	0	0	0	109.8	M382 T386	M382-S384 PolarHBondContact O-N 3.14Å; S384-T386 VanDerWaalsContact C-N 3.32Å; S384-T386 PolarHBondContact O-N 2.89Å
385	T	29.2	Very low	32.5	Very low	137 Å²	137	126.9 Å²	126.9	84%	0.84	73%	0.732	S	S	*	*			trans	-66.9	88.9	159.8	31	0	0	0	0	108.8	T383	T383-T385 PolarHBondContact O-N 3.19Å; T383-T385 VanDerWaalsContact O-N 3.08Å
386	T	36.7	Very low	33.4	Very low	97 Å²	97	132.2 Å²	132.2	60%	0.595	74%	0.739	S	S	*	*			trans	-91	107.7	173.6	5.4	0	0	0	0	110.2	S384 V388	S384-T386 VanDerWaalsContact C-N 3.32Å; S384-T386 PolarHBondContact O-N 2.89Å; T386-V388 PolarHBondContact O-N 3.01Å
387	T	33.2	Very low	34.1	Very low	131 Å²	131	130.6 Å²	130.6	80%	0.804	74%	0.738	S	S	*	*			trans	-54.8	120.3	166.5	44.5	0	0	0	0	110.3
388	V	40.5	Very low	35.2	Very low	101 Å²	101	126.4 Å²	126.4	61%	0.612	72%	0.718	S	S	*	*			trans	-87	114	176.4	178.9	0	0	0	0	108.4	T386 M412	T386-V388 PolarHBondContact O-N 3.01Å; V388-M412 HydrophobicContact CG1-CE 4.44Å
389	T	39.8	Very low	37.2	Very low	106 Å²	106	120.8 Å²	120.8	65%	0.65	70%	0.696	S	S	*	*			trans	-83.2	111.9	171.1	41	0	0	0	0	109.7
390	S	39	Very low	39.1	Very low	96 Å²	96	116.8 Å²	116.8	67%	0.671	67%	0.67	S	S	*	*			trans	-84.5	125	167.9	53.7	0	0	0	0	109.6
391	V	39.1	Very low	41.4	Very low	108 Å²	108	116.3 Å²	116.3	66%	0.655	65%	0.653	S	S	*	*			trans	-96	123	164.8	-173.4	0	0	0	0	107.9	N393	V391-N393 PolarHBondContact O-N 3.09Å
392	P	37.7	Very low	43.8	Very low	96 Å²	96	110.7 Å²	110.7	62%	0.623	62%	0.618	S	S	*	*			trans	-80.1	108.7	179.8	-5.5	22.5	0	0	0	110.7
393	N	37.7	Very low	45.8	Very low	121 Å²	121	107.6 Å²	107.6	65%	0.647	60%	0.602	S	S	*	*			trans	-102.1	113.8	161.2	-81.4	-23.4	0	0	0	108.9	V391	V391-N393 PolarHBondContact O-N 3.09Å
394	H	36.2	Very low	47.6	Very low	177 Å²	177	106.3 Å²	106.3	82%	0.819	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	125.9	171.1	-114.5	-92.4	0	0	0	109.2
395	H	42	Very low	49.8	Very low	164 Å²	164	104 Å²	104	76%	0.759	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	120.2	-16.7	166.8	-76.1	-82.6	0	0	0	119.1
396	Y	42.7	Very low	51.8	Low	209 Å²	209	103.4 Å²	103.4	82%	0.82	57%	0.565	S	S	*	*	S	Bend	trans	-147.3	132.8	174.2	-76.8	-90.7	0	0	0	108.8	H398	Y396-H398 PolarHBondContact O-N 3.3Å
397	G	43.1	Very low	53.5	Low	65 Å²	65	104.4 Å²	104.4	67%	0.67	56%	0.561	S	S	*	*			trans	-43.3	130.9	-172.5	0	0	0	0	0	113.3	P399	G397-P399 VanDerWaalsContact O-CD 3.22Å; G397-P399 WeakPolarHBondContact O-CD 3.46Å
398	H	48.4	Very low	55.4	Low	93 Å²	93	102 Å²	102	43%	0.431	55%	0.546	S	S	.	.			trans	-44.3	108.8	-170.3	-64.7	-66.7	0	0	0	112.6	Y396 Y400	Y396-H398 PolarHBondContact O-N 3.3Å; H398-Y400 VanDerWaalsContact O-CD2 3.32Å; H398-Y400 WeakPolarHBondContact O-CD2 3.43Å; H398-Y400 VanDerWaalsContact O-CE2 3.31Å; H398-Y400 WeakPolarHBondContact O-CE2 3.48Å; H398-Y400 PolarHBondContact O-N 3.1Å
399	P	69.7	Low	57.1	Low	65 Å²	65	99.6 Å²	99.6	42%	0.422	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-71.3	126.1	175.6	25.7	-29.4	0	0	0	109.8	G397 V408 Y410	G397-P399 VanDerWaalsContact O-CD 3.22Å; G397-P399 WeakPolarHBondContact O-CD 3.46Å; P399-V408 HydrophobicContact CB-CG1 3.52Å; P399-Y410 HydrophobicContact CB-CD1 4.47Å; P399-Y410 HydrophobicContact CB-CE1 4.4Å
400	Y	67	Low	58.7	Low	68 Å²	68	103.8 Å²	103.8	27%	0.267	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	117	176.4	-62.3	-79.4	0	0	0	109.6	H398 V408 Y409 M412 L415	H398-Y400 VanDerWaalsContact O-CD2 3.32Å; H398-Y400 WeakPolarHBondContact O-CD2 3.43Å; H398-Y400 VanDerWaalsContact O-CE2 3.31Å; H398-Y400 WeakPolarHBondContact O-CE2 3.48Å; H398-Y400 PolarHBondContact O-N 3.1Å; Y400-V408 CarbonylContact O-C 3.58Å; Y400-Y409 WeakPolarHBondContact CA-O 3.25Å; Y400-Y409 WeakPolarHBondContact CB-O 3.44Å; Y400-Y409 PolarHBondContact N-O 2.89Å; Y400-Y409 WeakPolarHBondContact O-CB 3.48Å; Y400-Y409 PolarHBondContact O-N 3.43Å; Y400-M412 HydrophobicContact CD1-CB 4.38Å; Y400-M412 HydrophobicContact CD1-CE 3.55Å; Y400-M412 HydrophobicContact CD1-SD 3.78Å; Y400-M412 HydrophobicContact CD2-CB 4.32Å; Y400-M412 HydrophobicContact CE1-CB 4Å; Y400-M412 HydrophobicContact CE1-CE 3.13Å; Y400-M412 HydrophobicContact CE1-CG 4.42Å; Y400-M412 HydrophobicContact CE1-SD 3.85Å; Y400-M412 HydrophobicContact CE2-CB 3.91Å; Y400-M412 HydrophobicContact CG-SD 4.45Å; Y400-L415 HydrophobicContact CD1-CD2 4.49Å; Y400-L415 HydrophobicContact CG-CD2 4.46Å
401	F	73	Confident	60.4	Low	107 Å²	107	101.8 Å²	101.8	47%	0.469	52%	0.517	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	148.1	177.8	61.6	-85.9	0	0	0	111.4	K407	F401-K407 CarbonylContact C-O 3.54Å; F401-K407 WeakPolarHBondContact CA-O 3.46Å
402	C	79.2	Confident	62	Low	0 Å²	0	99.4 Å²	99.4	0%	0	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-88.3	116.1	171.7	-173.8	0	0	0	0	111	L404 C405 N406 K407 L415 H418 H422	C402-L404 PolarHBondContact O-N 2.83Å; C402-L404 VanDerWaalsContact O-N 3.13Å; C402-L404 PolarHBondContact SG-N 3.04Å; C402-C405 PolarHBondContact O-N 2.79Å; C402-N406 WeakPolarHBondContact O-CA 3.39Å; C402-N406 PolarHBondContact O-N 3.47Å; C402-K407 PolarHBondContact N-O 3.4Å; C402-L415 HydrophobicContact CB-CD1 3.77Å; C402-H418 WeakPolarHBondContact CB-CD2 3.45Å; C402-H418 WeakPolarHBondContact CB-NE2 3.44Å; C402-H418 PolarHBondContact SG-CD2 3.3Å; C402-H418 PolarHBondContact SG-NE2 3.33Å; C402-H422 PolarHBondContact SG-CD2 3.48Å; C402-H422 PolarHBondContact SG-NE2 3.08Å
403	H	68.5	Low	63.9	Low	106 Å²	106	98.9 Å²	98.9	49%	0.491	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-17	176.3	61.3	-83.4	0	0	0	114.3
404	L	67.3	Low	65.8	Low	88 Å²	88	95 Å²	95	46%	0.461	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-18.8	-177.7	-60	171	0	0	0	113.8	C402 H422	C402-L404 PolarHBondContact O-N 2.83Å; C402-L404 VanDerWaalsContact O-N 3.13Å; C402-L404 PolarHBondContact SG-N 3.04Å; L404-H422 HydrophobicContact CB-CB 4.19Å; L404-H422 HydrophobicContact CD1-CB 3.31Å; L404-H422 HydrophobicContact CG-CB 4.36Å
405	C	74.9	Confident	67.7	Low	48 Å²	48	87.3 Å²	87.3	32%	0.324	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.8	14.6	177.6	77.2	0	0	0	0	114.6	C402 K407 H418 H422	C402-C405 PolarHBondContact O-N 2.79Å; C405-K407 PolarHBondContact O-N 2.98Å; C405-K407 VanDerWaalsContact SG-CG 3.53Å; C405-H418 PolarHBondContact SG-CE1 2.86Å; C405-H418 PolarHBondContact SG-NE2 3.09Å; C405-H422 VanDerWaalsContact CB-CE1 3.42Å; C405-H422 WeakPolarHBondContact CB-CE1 3.43Å; C405-H422 PolarHBondContact SG-CE1 3.49Å; C405-H422 PolarHBondContact SG-NE2 3.16Å
406	N	71.8	Confident	69.2	Low	125 Å²	125	85.7 Å²	85.7	67%	0.668	44%	0.439	S	S	*	.			trans	53.2	24.1	177.8	-60.5	-20.1	0	0	0	115.4	C402	C402-N406 WeakPolarHBondContact O-CA 3.39Å; C402-N406 PolarHBondContact O-N 3.47Å
407	K	73.4	Confident	70.6	Confident	119 Å²	119	78.5 Å²	78.5	52%	0.517	41%	0.413	S	S	.	.			trans	-79.1	135.6	174.8	-76.6	-177.2	-175.3	-177	0	111	F401 C402 C405 Y409	F401-K407 CarbonylContact C-O 3.54Å; F401-K407 WeakPolarHBondContact CA-O 3.46Å; C402-K407 PolarHBondContact N-O 3.4Å; C405-K407 PolarHBondContact O-N 2.98Å; C405-K407 VanDerWaalsContact SG-CG 3.53Å; K407-Y409 HydrophobicContact CB-CE2 3.61Å; K407-Y409 WeakPolarHBondContact O-CD2 3.42Å
408	V	72.3	Confident	72.2	Confident	79 Å²	79	76 Å²	76	48%	0.479	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	136.1	-177.6	-176.3	0	0	0	0	111.1	P399 Y400	P399-V408 HydrophobicContact CB-CG1 3.52Å; Y400-V408 CarbonylContact O-C 3.58Å
409	Y	77	Confident	73.2	Confident	52 Å²	52	73.1 Å²	73.1	20%	0.204	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	133.9	-178.1	-67.5	-84.8	0	0	0	110.3	Y400 K407 S411 A414 L415 H418	Y400-Y409 WeakPolarHBondContact CA-O 3.25Å; Y400-Y409 WeakPolarHBondContact CB-O 3.44Å; Y400-Y409 PolarHBondContact N-O 2.89Å; Y400-Y409 WeakPolarHBondContact O-CB 3.48Å; Y400-Y409 PolarHBondContact O-N 3.43Å; K407-Y409 HydrophobicContact CB-CE2 3.61Å; K407-Y409 WeakPolarHBondContact O-CD2 3.42Å; Y409-S411 VanDerWaalsContact C-N 3.25Å; Y409-S411 PolarHBondContact O-N 2.82Å; Y409-A414 HydrophobicContact CD1-CB 3.69Å; Y409-A414 HydrophobicContact CG-CB 4.29Å; Y409-L415 HydrophobicContact CD2-CB 4.32Å; Y409-L415 HydrophobicContact CD2-CD1 3.81Å; Y409-L415 HydrophobicContact CE2-CD1 4.38Å; Y409-L415 HydrophobicContact CG-CB 4.35Å; Y409-H418 HydrophobicContact CD2-CB 4.32Å; Y409-H418 HydrophobicContact CE1-CB 3.87Å; Y409-H418 HydrophobicContact CE2-CB 3.58Å; Y409-H418 AromaticContact CE2-CD2 3.22Å; Y409-H418 WeakPolarHBondContact CE2-CD2 3.47Å; Y409-H418 AromaticContact CE2-CG 3.3Å; Y409-H418 AromaticContact CE2-NE2 3.85Å; Y409-H418 AromaticContact CZ-CD2 3.7Å; Y409-H418 AromaticContact CZ-CG 3.25Å; Y409-H418 AromaticContact CZ-ND1 3.69Å; Y409-H418 WeakPolarHBondContact OH-CB 3.46Å; Y409-H418 PolarHBondContact OH-CE1 3.46Å; Y409-H418 PolarHBondContact OH-ND1 2.89Å
410	Y	72.7	Confident	73	Confident	194 Å²	194	76.8 Å²	76.8	76%	0.761	38%	0.378	S	S	*	.	S	Bend	trans	-88.4	10.5	-179.2	-58.4	-80.8	0	0	0	113.6	P399	P399-Y410 HydrophobicContact CB-CD1 4.47Å; P399-Y410 HydrophobicContact CB-CE1 4.4Å
411	S	75.4	Confident	72.8	Confident	54 Å²	54	76 Å²	76	38%	0.378	38%	0.381	S	S	.	.	S	Bend	trans	-146.3	134.8	176.8	174.3	0	0	0	0	110.1	Y409 S413 A414 L415	Y409-S411 VanDerWaalsContact C-N 3.25Å; Y409-S411 PolarHBondContact O-N 2.82Å; S411-S413 PolarHBondContact O-N 3.5Å; S411-S413 PolarHBondContact OG-N 3.46Å; S411-A414 WeakPolarHBondContact O-CA 3.37Å; S411-A414 WeakPolarHBondContact O-CB 3.39Å; S411-A414 PolarHBondContact O-N 3.38Å; S411-L415 PolarHBondContact O-N 3.19Å
412	M	73.1	Confident	72.3	Confident	58 Å²	58	74 Å²	74	29%	0.286	37%	0.373	S	S	.	.	H	α-helix	trans	-58	-34.7	174.9	-176.9	63	88.7	0	0	111.2	V388 Y400 A414 L415 K416	V388-M412 HydrophobicContact CG1-CE 4.44Å; Y400-M412 HydrophobicContact CD1-CB 4.38Å; Y400-M412 HydrophobicContact CD1-CE 3.55Å; Y400-M412 HydrophobicContact CD1-SD 3.78Å; Y400-M412 HydrophobicContact CD2-CB 4.32Å; Y400-M412 HydrophobicContact CE1-CB 4Å; Y400-M412 HydrophobicContact CE1-CE 3.13Å; Y400-M412 HydrophobicContact CE1-CG 4.42Å; Y400-M412 HydrophobicContact CE1-SD 3.85Å; Y400-M412 HydrophobicContact CE2-CB 3.91Å; Y400-M412 HydrophobicContact CG-SD 4.45Å; M412-A414 VanDerWaalsContact C-N 3.31Å; M412-A414 PolarHBondContact O-N 3.07Å; M412-L415 PolarHBondContact O-N 3.25Å; M412-L415 HydrophobicContact SD-CD2 4.49Å; M412-K416 HydrophobicContact CG-CD 4.31Å; M412-K416 HydrophobicContact CG-CG 4.45Å; M412-K416 WeakPolarHBondContact O-CB 3.34Å; M412-K416 WeakPolarHBondContact O-CG 3.23Å; M412-K416 PolarHBondContact O-N 3.41Å
413	S	76.2	Confident	71.2	Confident	85 Å²	85	78 Å²	78	59%	0.594	40%	0.398	S	S	*	.	H	α-helix	trans	-63.2	-39.1	175.5	-57.5	0	0	0	0	111.6	S411 M417	S411-S413 PolarHBondContact O-N 3.5Å; S411-S413 PolarHBondContact OG-N 3.46Å; S413-M417 WeakPolarHBondContact O-CB 3.44Å; S413-M417 WeakPolarHBondContact O-CG 3.49Å; S413-M417 PolarHBondContact O-N 2.9Å
414	A	77.6	Confident	70.5	Confident	39 Å²	39	75.7 Å²	75.7	32%	0.322	39%	0.389	S	S	.	.	H	α-helix	trans	-71.3	-40.9	177.1	0	0	0	0	0	111.6	Y409 S411 M412 M417 H418	Y409-A414 HydrophobicContact CD1-CB 3.69Å; Y409-A414 HydrophobicContact CG-CB 4.29Å; S411-A414 WeakPolarHBondContact O-CA 3.37Å; S411-A414 WeakPolarHBondContact O-CB 3.39Å; S411-A414 PolarHBondContact O-N 3.38Å; M412-A414 VanDerWaalsContact C-N 3.31Å; M412-A414 PolarHBondContact O-N 3.07Å; A414-M417 PolarHBondContact O-N 3.39Å; A414-H418 WeakPolarHBondContact O-CB 3.29Å; A414-H418 PolarHBondContact O-N 3.39Å
415	L	76.6	Confident	70.1	Confident	16 Å²	16	75.8 Å²	75.8	8%	0.084	39%	0.394	C	S	.	.	H	α-helix	trans	-61.7	-48.9	172	178.9	65.4	0	0	0	111.3	Y400 C402 Y409 S411 M412 M417 H418 V419	Y400-L415 HydrophobicContact CD1-CD2 4.49Å; Y400-L415 HydrophobicContact CG-CD2 4.46Å; C402-L415 HydrophobicContact CB-CD1 3.77Å; Y409-L415 HydrophobicContact CD2-CB 4.32Å; Y409-L415 HydrophobicContact CD2-CD1 3.81Å; Y409-L415 HydrophobicContact CE2-CD1 4.38Å; Y409-L415 HydrophobicContact CG-CB 4.35Å; S411-L415 PolarHBondContact O-N 3.19Å; M412-L415 PolarHBondContact O-N 3.25Å; M412-L415 HydrophobicContact SD-CD2 4.49Å; L415-M417 VanDerWaalsContact C-N 3.3Å; L415-M417 PolarHBondContact O-N 3.44Å; L415-H418 CarbonylContact O-C 3.45Å; L415-H418 WeakPolarHBondContact O-CA 3.5Å; L415-H418 WeakPolarHBondContact O-CB 3.44Å; L415-H418 PolarHBondContact O-N 3.44Å; L415-V419 HydrophobicContact CD1-CG2 3.86Å; L415-V419 HydrophobicContact CG-CG2 4.05Å; L415-V419 WeakPolarHBondContact O-CG2 3.43Å; L415-V419 PolarHBondContact O-N 3.25Å
416	K	74.4	Confident	69.3	Low	130 Å²	130	73.9 Å²	73.9	57%	0.565	38%	0.382	S	S	*	.	H	α-helix	trans	-57.7	-42.5	177.8	-77.4	179.8	178.5	179.8	0	111.8	M412 H418 R420	M412-K416 HydrophobicContact CG-CD 4.31Å; M412-K416 HydrophobicContact CG-CG 4.45Å; M412-K416 WeakPolarHBondContact O-CB 3.34Å; M412-K416 WeakPolarHBondContact O-CG 3.23Å; M412-K416 PolarHBondContact O-N 3.41Å; K416-H418 VanDerWaalsContact C-N 3.29Å; K416-H418 PolarHBondContact O-N 3.49Å; K416-R420 WeakPolarHBondContact O-CG 3.24Å; K416-R420 PolarHBondContact O-N 3.22Å
417	M	72.1	Confident	69	Low	57 Å²	57	74 Å²	74	28%	0.281	38%	0.376	S	S	.	.	H	α-helix	trans	-64.7	-34.2	174.6	-80.1	-57.8	-48.8	0	0	112.6	S413 A414 L415 R420	S413-M417 WeakPolarHBondContact O-CB 3.44Å; S413-M417 WeakPolarHBondContact O-CG 3.49Å; S413-M417 PolarHBondContact O-N 2.9Å; A414-M417 PolarHBondContact O-N 3.39Å; L415-M417 VanDerWaalsContact C-N 3.3Å; L415-M417 PolarHBondContact O-N 3.44Å; M417-R420 WeakPolarHBondContact O-CB 3.49Å; M417-R420 PolarHBondContact SD-NH1 2.92Å
418	H	75.9	Confident	69.2	Low	12 Å²	12	68.4 Å²	68.4	6%	0.056	35%	0.352	C	S	.	.	H	α-helix	trans	-76.1	-40.1	175.9	169.5	66.5	0	0	0	113.4	C402 C405 Y409 A414 L415 K416 R420 T421 H422	C402-H418 WeakPolarHBondContact CB-CD2 3.45Å; C402-H418 WeakPolarHBondContact CB-NE2 3.44Å; C402-H418 PolarHBondContact SG-CD2 3.3Å; C402-H418 PolarHBondContact SG-NE2 3.33Å; C405-H418 PolarHBondContact SG-CE1 2.86Å; C405-H418 PolarHBondContact SG-NE2 3.09Å; Y409-H418 HydrophobicContact CD2-CB 4.32Å; Y409-H418 HydrophobicContact CE1-CB 3.87Å; Y409-H418 HydrophobicContact CE2-CB 3.58Å; Y409-H418 AromaticContact CE2-CD2 3.22Å; Y409-H418 WeakPolarHBondContact CE2-CD2 3.47Å; Y409-H418 AromaticContact CE2-CG 3.3Å; Y409-H418 AromaticContact CE2-NE2 3.85Å; Y409-H418 AromaticContact CZ-CD2 3.7Å; Y409-H418 AromaticContact CZ-CG 3.25Å; Y409-H418 AromaticContact CZ-ND1 3.69Å; Y409-H418 WeakPolarHBondContact OH-CB 3.46Å; Y409-H418 PolarHBondContact OH-CE1 3.46Å; Y409-H418 PolarHBondContact OH-ND1 2.89Å; A414-H418 WeakPolarHBondContact O-CB 3.29Å; A414-H418 PolarHBondContact O-N 3.39Å; L415-H418 CarbonylContact O-C 3.45Å; L415-H418 WeakPolarHBondContact O-CA 3.5Å; L415-H418 WeakPolarHBondContact O-CB 3.44Å; L415-H418 PolarHBondContact O-N 3.44Å; K416-H418 VanDerWaalsContact C-N 3.29Å; K416-H418 PolarHBondContact O-N 3.49Å; H418-R420 PolarHBondContact O-N 3.3Å; H418-T421 PolarHBondContact ND1-OG1 3.18Å; H418-T421 WeakPolarHBondContact O-CA 3.47Å; H418-T421 VanDerWaalsContact O-CB 3.26Å; H418-T421 WeakPolarHBondContact O-CB 3.36Å; H418-T421 PolarHBondContact O-N 3.23Å; H418-T421 PolarHBondContact O-OG1 3.1Å; H418-H422 AromaticContact CD2-NE2 3.87Å; H418-H422 AromaticContact CE1-CD2 3.91Å; H418-H422 AromaticContact CE1-CE1 3.92Å; H418-H422 AromaticContact CE1-NE2 3.14Å; H418-H422 PolarHBondContact CE1-NE2 3.39Å; H418-H422 AromaticContact NE2-CD2 3.59Å; H418-H422 AromaticContact NE2-NE2 2.92Å; H418-H422 PolarHBondContact NE2-NE2 2.74Å
419	V	68.6	Low	69.1	Low	34 Å²	34	72 Å²	72	21%	0.206	37%	0.368	C	S	.	.	H	α-helix	trans	-62.9	-31.4	176	175	0	0	0	0	110.8	L415 T421 H422 T423	L415-V419 HydrophobicContact CD1-CG2 3.86Å; L415-V419 HydrophobicContact CG-CG2 4.05Å; L415-V419 WeakPolarHBondContact O-CG2 3.43Å; L415-V419 PolarHBondContact O-N 3.25Å; V419-T421 PolarHBondContact O-N 3.1Å; V419-H422 PolarHBondContact O-N 3.41Å; V419-T423 PolarHBondContact O-N 3.43Å; V419-T423 PolarHBondContact O-OG1 3.13Å
420	R	66.3	Low	68.9	Low	141 Å²	141	74.5 Å²	74.5	53%	0.532	39%	0.385	S	S	.	.	H	α-helix	trans	-61	-21.1	167.4	-72.5	173.2	178.4	162.2	-2.2	114	K416 M417 H418 T423	K416-R420 WeakPolarHBondContact O-CG 3.24Å; K416-R420 PolarHBondContact O-N 3.22Å; M417-R420 WeakPolarHBondContact O-CB 3.49Å; M417-R420 PolarHBondContact SD-NH1 2.92Å; H418-R420 PolarHBondContact O-N 3.3Å; R420-T423 WeakPolarHBondContact CA-OG1 3.46Å; R420-T423 CarbonylContact O-C 3.57Å
421	T	62.6	Low	69.1	Low	53 Å²	53	66.7 Å²	66.7	33%	0.325	36%	0.358	S	S	.	.	H	α-helix	trans	-81.6	-15	172.6	72.2	0	0	0	0	113.6	H418 V419 L424	H418-T421 PolarHBondContact ND1-OG1 3.18Å; H418-T421 WeakPolarHBondContact O-CA 3.47Å; H418-T421 VanDerWaalsContact O-CB 3.26Å; H418-T421 WeakPolarHBondContact O-CB 3.36Å; H418-T421 PolarHBondContact O-N 3.23Å; H418-T421 PolarHBondContact O-OG1 3.1Å; V419-T421 PolarHBondContact O-N 3.1Å; T421-L424 WeakPolarHBondContact O-CD1 2.83Å; T421-L424 WeakPolarHBondContact O-CG 3.47Å
422	H	62.8	Low	69	Low	64 Å²	64	66.9 Å²	66.9	30%	0.296	37%	0.369	S	S	.	.	H	α-helix	trans	-91.5	-40.7	169.3	-65.8	-61.7	0	0	0	111.6	C402 L404 C405 H418 V419 L424	C402-H422 PolarHBondContact SG-CD2 3.48Å; C402-H422 PolarHBondContact SG-NE2 3.08Å; L404-H422 HydrophobicContact CB-CB 4.19Å; L404-H422 HydrophobicContact CD1-CB 3.31Å; L404-H422 HydrophobicContact CG-CB 4.36Å; C405-H422 VanDerWaalsContact CB-CE1 3.42Å; C405-H422 WeakPolarHBondContact CB-CE1 3.43Å; C405-H422 PolarHBondContact SG-CE1 3.49Å; C405-H422 PolarHBondContact SG-NE2 3.16Å; H418-H422 AromaticContact CD2-NE2 3.87Å; H418-H422 AromaticContact CE1-CD2 3.91Å; H418-H422 AromaticContact CE1-CE1 3.92Å; H418-H422 AromaticContact CE1-NE2 3.14Å; H418-H422 PolarHBondContact CE1-NE2 3.39Å; H418-H422 AromaticContact NE2-CD2 3.59Å; H418-H422 AromaticContact NE2-NE2 2.92Å; H418-H422 PolarHBondContact NE2-NE2 2.74Å; V419-H422 PolarHBondContact O-N 3.41Å; H422-L424 PolarHBondContact O-N 3.3Å
423	T	55.1	Low	69	Low	85 Å²	85	70 Å²	70	52%	0.521	38%	0.381	S	S	.	.	S	Bend	trans	-84.6	56.8	173.4	51.3	0	0	0	0	109.8	V419 R420 P425	V419-T423 PolarHBondContact O-N 3.43Å; V419-T423 PolarHBondContact O-OG1 3.13Å; R420-T423 WeakPolarHBondContact CA-OG1 3.46Å; R420-T423 CarbonylContact O-C 3.57Å; T423-P425 WeakPolarHBondContact O-CD 3.37Å; T423-P425 WeakPolarHBondContact O-CG 3.32Å; T423-P425 VanDerWaalsContact O-N 3.07Å
424	L	55	Low	68.8	Low	57 Å²	57	68 Å²	68	30%	0.298	37%	0.369	S	S	.	.			trans	-62.5	102.7	-177.2	-71.5	150.3	0	0	0	110.5	T421 H422 C426 A434	T421-L424 WeakPolarHBondContact O-CD1 2.83Å; T421-L424 WeakPolarHBondContact O-CG 3.47Å; H422-L424 PolarHBondContact O-N 3.3Å; L424-C426 PolarHBondContact O-N 3.14Å; L424-A434 HydrophobicContact CB-CB 4.09Å; L424-A434 HydrophobicContact CD1-CB 3.49Å; L424-A434 VanDerWaalsContact CD1-CB 3.49Å; L424-A434 HydrophobicContact CD2-CB 3.59Å; L424-A434 HydrophobicContact CG-CB 3.88Å
425	P	58.9	Low	68.4	Low	90 Å²	90	68.1 Å²	68.1	58%	0.584	36%	0.362	S	S	*	.			trans	-79.7	-13.5	179	-0.7	20.8	0	0	0	110.9	T423	T423-P425 WeakPolarHBondContact O-CD 3.37Å; T423-P425 WeakPolarHBondContact O-CG 3.32Å; T423-P425 VanDerWaalsContact O-N 3.07Å
426	C	58.3	Low	67.9	Low	8 Å²	8	69.5 Å²	69.5	5%	0.054	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	73.2	-162.5	-57.5	0	0	0	0	110.3	L424 F435 L441	L424-C426 PolarHBondContact O-N 3.14Å; C426-F435 PolarHBondContact O-N 3.42Å; C426-L441 HydrophobicContact CB-CB 3.98Å; C426-L441 HydrophobicContact CB-CD2 3.65Å; C426-L441 HydrophobicContact CB-CG 4.4Å
427	K	64.5	Low	67.4	Low	128 Å²	128	68.9 Å²	68.9	56%	0.557	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.8	139.3	167.1	-66.2	-179.3	-177.3	177.1	0	109.2	N429 A434	K427-N429 PolarHBondContact O-N 3.21Å; K427-A434 HydrophobicContact CG-CB 3.95Å
428	C	76.9	Confident	67.2	Low	1 Å²	1	70.2 Å²	70.2	1%	0.007	37%	0.374	C	S	.	.			trans	-76.5	115.4	170.3	178.7	0	0	0	0	109.2	L430 C431 G432 K433 F435 L441 H444 H448	C428-L430 PolarHBondContact O-N 2.6Å; C428-L430 VanDerWaalsContact O-N 3.16Å; C428-C431 HydrophobicContact CB-CB 3.78Å; C428-C431 PolarHBondContact O-N 3.25Å; C428-C431 VanDerWaalsContact O-N 3.13Å; C428-C431 PolarHBondContact SG-N 2.83Å; C428-G432 WeakPolarHBondContact O-CA 3.46Å; C428-G432 PolarHBondContact O-N 3.33Å; C428-K433 WeakPolarHBondContact CB-O 3.27Å; C428-K433 PolarHBondContact N-O 3.36Å; C428-F435 HydrophobicContact CB-CE2 4.34Å; C428-L441 HydrophobicContact CB-CD1 3.66Å; C428-H444 VanDerWaalsContact CB-CD2 3.47Å; C428-H444 WeakPolarHBondContact CB-CD2 3.42Å; C428-H444 WeakPolarHBondContact CB-NE2 3.18Å; C428-H444 PolarHBondContact SG-CD2 2.89Å; C428-H444 PolarHBondContact SG-NE2 3.03Å; C428-H448 VanDerWaalsContact SG-CD2 3.58Å; C428-H448 PolarHBondContact SG-NE2 3.15Å; C428-H448 VanDerWaalsContact SG-NE2 3.42Å
429	N	70.4	Confident	66.9	Low	154 Å²	154	76.7 Å²	76.7	82%	0.824	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.9	179	-62.9	-9.3	0	0	0	112.6	K427	K427-N429 PolarHBondContact O-N 3.21Å
430	L	73.1	Confident	67.1	Low	104 Å²	104	77.7 Å²	77.7	55%	0.545	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-42.9	176.1	-59.4	174.9	0	0	0	111.1	K227 C428 H448	K227-L430 WeakPolarHBondContact CE-O 3.5Å; K227-L430 PolarHBondContact NZ-O 2.72Å; C428-L430 PolarHBondContact O-N 2.6Å; C428-L430 VanDerWaalsContact O-N 3.16Å; L430-H448 HydrophobicContact CD1-CB 3.39Å; L430-H448 VanDerWaalsContact CD1-CG 3.48Å
431	C	76.7	Confident	67.5	Low	31 Å²	31	71.7 Å²	71.7	21%	0.209	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-30.7	-173.9	-98.2	0	0	0	0	118	K227 C428 K433 H444 H448	K227-C431 VanDerWaalsContact CE-SG 3.55Å; K227-C431 VanDerWaalsContact NZ-CA 3.28Å; C428-C431 HydrophobicContact CB-CB 3.78Å; C428-C431 PolarHBondContact O-N 3.25Å; C428-C431 VanDerWaalsContact O-N 3.13Å; C428-C431 PolarHBondContact SG-N 2.83Å; C431-K433 HydrophobicContact CB-CB 3.73Å; C431-K433 HydrophobicContact CB-CD 4.25Å; C431-K433 HydrophobicContact CB-CG 3.82Å; C431-K433 PolarHBondContact O-N 3.21Å; C431-H444 PolarHBondContact SG-CE1 3.39Å; C431-H444 PolarHBondContact SG-NE2 3.44Å; C431-H444 VanDerWaalsContact SG-NE2 3.36Å; C431-H448 PolarHBondContact SG-CE1 2.99Å; C431-H448 PolarHBondContact SG-NE2 3.33Å
432	G	74	Confident	68.1	Low	58 Å²	58	73 Å²	73	60%	0.598	39%	0.385	S	S	*	.			trans	68.7	-5.5	-154.4	0	0	0	0	0	114.4	C428 A434	C428-G432 WeakPolarHBondContact O-CA 3.46Å; C428-G432 PolarHBondContact O-N 3.33Å; G432-A434 PolarHBondContact O-N 3.02Å
433	K	73.8	Confident	68.6	Low	123 Å²	123	71 Å²	71	54%	0.535	38%	0.382	S	S	.	.			trans	-66.7	130	178.2	-77.5	-177.6	-177.1	-174.8	0	109.9	C428 C431 F435	C428-K433 WeakPolarHBondContact CB-O 3.27Å; C428-K433 PolarHBondContact N-O 3.36Å; C431-K433 HydrophobicContact CB-CB 3.73Å; C431-K433 HydrophobicContact CB-CD 4.25Å; C431-K433 HydrophobicContact CB-CG 3.82Å; C431-K433 PolarHBondContact O-N 3.21Å; K433-F435 HydrophobicContact CB-CE2 3.79Å; K433-F435 HydrophobicContact CB-CZ 4.02Å; K433-F435 WeakPolarHBondContact O-CE2 3.39Å
434	A	71.2	Confident	69.8	Low	42 Å²	42	68 Å²	68	35%	0.347	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	136.7	-176.9	0	0	0	0	0	110.9	L424 K427 G432	L424-A434 HydrophobicContact CB-CB 4.09Å; L424-A434 HydrophobicContact CD1-CB 3.49Å; L424-A434 VanDerWaalsContact CD1-CB 3.49Å; L424-A434 HydrophobicContact CD2-CB 3.59Å; L424-A434 HydrophobicContact CG-CB 3.88Å; K427-A434 HydrophobicContact CG-CB 3.95Å; G432-A434 PolarHBondContact O-N 3.02Å
435	F	69.7	Low	70.8	Confident	42 Å²	42	67.8 Å²	67.8	18%	0.184	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146.6	-177.2	-62.2	-89.2	0	0	0	110.6	C426 C428 K433 R437 L440 L441 H444	C426-F435 PolarHBondContact O-N 3.42Å; C428-F435 HydrophobicContact CB-CE2 4.34Å; K433-F435 HydrophobicContact CB-CE2 3.79Å; K433-F435 HydrophobicContact CB-CZ 4.02Å; K433-F435 WeakPolarHBondContact O-CE2 3.39Å; F435-R437 VanDerWaalsContact C-N 3.28Å; F435-R437 PolarHBondContact O-N 3.49Å; F435-L440 HydrophobicContact CB-CB 4.08Å; F435-L440 HydrophobicContact CD1-CB 3.95Å; F435-L440 HydrophobicContact CG-CB 4.31Å; F435-L441 HydrophobicContact CB-CB 4.26Å; F435-L441 HydrophobicContact CD2-CB 4.1Å; F435-L441 HydrophobicContact CD2-CD1 3.75Å; F435-L441 HydrophobicContact CE2-CD1 4.08Å; F435-L441 HydrophobicContact CG-CB 4.36Å; F435-H444 HydrophobicContact CD2-CB 4.46Å; F435-H444 HydrophobicContact CE1-CB 3.86Å; F435-H444 HydrophobicContact CE2-CB 3.69Å; F435-H444 AromaticContact CE2-CD2 3.24Å; F435-H444 WeakPolarHBondContact CE2-CD2 3.45Å; F435-H444 AromaticContact CE2-CG 3.4Å; F435-H444 VanDerWaalsContact CE2-CG 3.4Å; F435-H444 AromaticContact CE2-NE2 3.9Å; F435-H444 HydrophobicContact CZ-CB 3.34Å; F435-H444 AromaticContact CZ-CD2 3.49Å; F435-H444 VanDerWaalsContact CZ-CD2 3.49Å; F435-H444 WeakPolarHBondContact CZ-CD2 3.44Å; F435-H444 AromaticContact CZ-CG 3.13Å; F435-H444 AromaticContact CZ-ND1 3.57Å
436	S	64.8	Low	71.8	Confident	45 Å²	45	67 Å²	67	32%	0.315	35%	0.346	S	S	.	.	S	Bend	trans	-75.8	-13.7	-178.7	58.2	0	0	0	0	114.1
437	R	63.8	Low	72.7	Confident	118 Å²	118	69.6 Å²	69.6	45%	0.445	36%	0.362	S	S	.	.	S	Bend	trans	-147	147.7	-176.9	-60.8	-176.9	176.8	172.2	-4	110.9	F435 W439 L440 L441	F435-R437 VanDerWaalsContact C-N 3.28Å; F435-R437 PolarHBondContact O-N 3.49Å; R437-W439 VanDerWaalsContact CD-NE1 3.25Å; R437-W439 PolarHBondContact O-N 3.37Å; R437-L440 HydrophobicContact CB-CD1 4.16Å; R437-L440 HydrophobicContact CB-CG 4.42Å; R437-L440 WeakPolarHBondContact O-CB 3.46Å; R437-L440 PolarHBondContact O-N 3.4Å; R437-L441 PolarHBondContact O-N 2.94Å
438	M	68.5	Low	73.4	Confident	85 Å²	85	66.3 Å²	66.3	42%	0.419	35%	0.348	S	S	.	.	H	α-helix	trans	-60.1	-42	-179.3	-174.1	63.4	77.2	0	0	113.4	C336 L440 L441 N442	C336-M438 HydrophobicContact CB-CE 4.45Å; M438-L440 VanDerWaalsContact C-N 3.25Å; M438-L440 PolarHBondContact O-N 3.05Å; M438-L441 WeakPolarHBondContact O-CB 3.48Å; M438-L441 PolarHBondContact O-N 3.27Å; M438-L441 VanDerWaalsContact O-N 3.09Å; M438-L441 HydrophobicContact SD-CD2 4.31Å; M438-N442 PolarHBondContact O-N 3.11Å
439	W	70.9	Confident	73.2	Confident	147 Å²	147	70.3 Å²	70.3	56%	0.557	37%	0.373	S	S	*	.	H	α-helix	trans	-64.6	-30.1	179.9	69.1	-94.3	0	0	0	113	R437 G443	R437-W439 VanDerWaalsContact CD-NE1 3.25Å; R437-W439 PolarHBondContact O-N 3.37Å; W439-G443 PolarHBondContact O-N 3.16Å
440	L	72	Confident	73.4	Confident	56 Å²	56	65.3 Å²	65.3	29%	0.293	36%	0.358	S	S	.	.	H	α-helix	trans	-70.1	-40.4	173.2	-71.3	170.1	0	0	0	111	F435 R437 M438 H444	F435-L440 HydrophobicContact CB-CB 4.08Å; F435-L440 HydrophobicContact CD1-CB 3.95Å; F435-L440 HydrophobicContact CG-CB 4.31Å; R437-L440 HydrophobicContact CB-CD1 4.16Å; R437-L440 HydrophobicContact CB-CG 4.42Å; R437-L440 WeakPolarHBondContact O-CB 3.46Å; R437-L440 PolarHBondContact O-N 3.4Å; M438-L440 VanDerWaalsContact C-N 3.25Å; M438-L440 PolarHBondContact O-N 3.05Å; L440-H444 VanDerWaalsContact O-CB 3.29Å; L440-H444 WeakPolarHBondContact O-CB 3.36Å; L440-H444 PolarHBondContact O-N 3.25Å
441	L	75.5	Confident	73.4	Confident	15 Å²	15	65.9 Å²	65.9	8%	0.079	36%	0.358	C	S	.	.	H	α-helix	trans	-63.1	-46	172.9	175.4	63	0	0	0	111	C426 C428 F435 R437 M438 G443 H444 L445	C426-L441 HydrophobicContact CB-CB 3.98Å; C426-L441 HydrophobicContact CB-CD2 3.65Å; C426-L441 HydrophobicContact CB-CG 4.4Å; C428-L441 HydrophobicContact CB-CD1 3.66Å; F435-L441 HydrophobicContact CB-CB 4.26Å; F435-L441 HydrophobicContact CD2-CB 4.1Å; F435-L441 HydrophobicContact CD2-CD1 3.75Å; F435-L441 HydrophobicContact CE2-CD1 4.08Å; F435-L441 HydrophobicContact CG-CB 4.36Å; R437-L441 PolarHBondContact O-N 2.94Å; M438-L441 WeakPolarHBondContact O-CB 3.48Å; M438-L441 PolarHBondContact O-N 3.27Å; M438-L441 VanDerWaalsContact O-N 3.09Å; M438-L441 HydrophobicContact SD-CD2 4.31Å; L441-G443 PolarHBondContact O-N 3.35Å; L441-H444 CarbonylContact O-C 3.52Å; L441-H444 WeakPolarHBondContact O-CA 3.43Å; L441-H444 WeakPolarHBondContact O-CB 3.24Å; L441-H444 PolarHBondContact O-N 3.49Å; L441-H444 VanDerWaalsContact O-N 3.08Å; L441-L445 HydrophobicContact CD1-CG 4.2Å; L441-L445 HydrophobicContact CG-CD1 4.2Å; L441-L445 HydrophobicContact CG-CG 4.35Å; L441-L445 WeakPolarHBondContact O-CG 3.48Å; L441-L445 PolarHBondContact O-N 2.98Å
442	N	73.3	Confident	73.5	Confident	80 Å²	80	70.5 Å²	70.5	43%	0.428	37%	0.374	S	S	.	.	H	α-helix	trans	-61.7	-44.2	177.3	-72.6	-14.7	0	0	0	111.8	M438 H444 L445 R446	M438-N442 PolarHBondContact O-N 3.11Å; N442-H444 VanDerWaalsContact C-N 3.25Å; N442-H444 PolarHBondContact O-N 3.19Å; N442-L445 PolarHBondContact O-N 2.79Å; N442-R446 PolarHBondContact O-N 3.35Å
443	G	74.9	Confident	73.7	Confident	21 Å²	21	71.2 Å²	71.2	22%	0.216	37%	0.368	C	S	.	.	H	α-helix	trans	-61	-35.1	172.7	0	0	0	0	0	112.6	W439 L441	W439-G443 PolarHBondContact O-N 3.16Å; L441-G443 PolarHBondContact O-N 3.35Å
444	H	80.7	Confident	74	Confident	22 Å²	22	67.1 Å²	67.1	10%	0.102	35%	0.351	C	S	.	.	H	α-helix	trans	-71.5	-39.3	173.5	170.6	66.6	0	0	0	113.1	C428 C431 F435 L440 L441 N442 R446 T447 H448	C428-H444 VanDerWaalsContact CB-CD2 3.47Å; C428-H444 WeakPolarHBondContact CB-CD2 3.42Å; C428-H444 WeakPolarHBondContact CB-NE2 3.18Å; C428-H444 PolarHBondContact SG-CD2 2.89Å; C428-H444 PolarHBondContact SG-NE2 3.03Å; C431-H444 PolarHBondContact SG-CE1 3.39Å; C431-H444 PolarHBondContact SG-NE2 3.44Å; C431-H444 VanDerWaalsContact SG-NE2 3.36Å; F435-H444 HydrophobicContact CD2-CB 4.46Å; F435-H444 HydrophobicContact CE1-CB 3.86Å; F435-H444 HydrophobicContact CE2-CB 3.69Å; F435-H444 AromaticContact CE2-CD2 3.24Å; F435-H444 WeakPolarHBondContact CE2-CD2 3.45Å; F435-H444 AromaticContact CE2-CG 3.4Å; F435-H444 VanDerWaalsContact CE2-CG 3.4Å; F435-H444 AromaticContact CE2-NE2 3.9Å; F435-H444 HydrophobicContact CZ-CB 3.34Å; F435-H444 AromaticContact CZ-CD2 3.49Å; F435-H444 VanDerWaalsContact CZ-CD2 3.49Å; F435-H444 WeakPolarHBondContact CZ-CD2 3.44Å; F435-H444 AromaticContact CZ-CG 3.13Å; F435-H444 AromaticContact CZ-ND1 3.57Å; L440-H444 VanDerWaalsContact O-CB 3.29Å; L440-H444 WeakPolarHBondContact O-CB 3.36Å; L440-H444 PolarHBondContact O-N 3.25Å; L441-H444 CarbonylContact O-C 3.52Å; L441-H444 WeakPolarHBondContact O-CA 3.43Å; L441-H444 WeakPolarHBondContact O-CB 3.24Å; L441-H444 PolarHBondContact O-N 3.49Å; L441-H444 VanDerWaalsContact O-N 3.08Å; N442-H444 VanDerWaalsContact C-N 3.25Å; N442-H444 PolarHBondContact O-N 3.19Å; H444-R446 PolarHBondContact O-N 3.29Å; H444-T447 PolarHBondContact ND1-OG1 2.76Å; H444-T447 WeakPolarHBondContact O-CA 3.34Å; H444-T447 VanDerWaalsContact O-CB 3.25Å; H444-T447 WeakPolarHBondContact O-CB 3.44Å; H444-T447 PolarHBondContact O-N 2.86Å; H444-T447 PolarHBondContact O-OG1 3.41Å; H444-H448 AromaticContact CE1-NE2 3.62Å; H444-H448 AromaticContact NE2-CD2 3.8Å; H444-H448 AromaticContact NE2-NE2 3.3Å; H444-H448 PolarHBondContact NE2-NE2 3.11Å
445	L	75.9	Confident	74.3	Confident	53 Å²	53	68 Å²	68	28%	0.277	36%	0.358	S	S	.	.	H	α-helix	trans	-60	-33.3	177.7	-74.8	171.4	0	0	0	111.6	L441 N442 T447 H448 T449	L441-L445 HydrophobicContact CD1-CG 4.2Å; L441-L445 HydrophobicContact CG-CD1 4.2Å; L441-L445 HydrophobicContact CG-CG 4.35Å; L441-L445 WeakPolarHBondContact O-CG 3.48Å; L441-L445 PolarHBondContact O-N 2.98Å; N442-L445 PolarHBondContact O-N 2.79Å; L445-T447 PolarHBondContact O-N 3.2Å; L445-T447 VanDerWaalsContact O-N 3.12Å; L445-H448 WeakPolarHBondContact O-CA 3.49Å; L445-H448 WeakPolarHBondContact O-CB 3.46Å; L445-H448 PolarHBondContact O-N 2.91Å; L445-T449 PolarHBondContact O-N 2.93Å; L445-T449 VanDerWaalsContact O-N 3.07Å
446	R	78.1	Confident	74.8	Confident	73 Å²	73	66.5 Å²	66.5	28%	0.275	35%	0.352	S	S	.	.	H	α-helix	trans	-59.2	-23	171.2	-65.5	176	-176.5	170.8	-0.7	113.7	N442 H444 H448 T449 G450 E451 A464	N442-R446 PolarHBondContact O-N 3.35Å; H444-R446 PolarHBondContact O-N 3.29Å; R446-H448 VanDerWaalsContact C-N 3.28Å; R446-T449 WeakPolarHBondContact CA-OG1 3.09Å; R446-G450 WeakPolarHBondContact O-CA 3.5Å; R446-G450 PolarHBondContact O-N 3.09Å; R446-E451 HydrophobicContact CG-CB 4.4Å; R446-A464 HydrophobicContact CB-CB 4.04Å; R446-A464 WeakPolarHBondContact CD-O 3.34Å; R446-A464 PolarHBondContact NH1-O 2.86Å; R446-A464 VanDerWaalsContact NH1-O 3.15Å
447	T	77.6	Confident	75.5	Confident	64 Å²	64	71 Å²	71	39%	0.393	37%	0.37	S	S	.	.	H	α-helix	trans	-74.9	-18.8	173.6	74.2	0	0	0	0	113.3	H444 L445	H444-T447 PolarHBondContact ND1-OG1 2.76Å; H444-T447 WeakPolarHBondContact O-CA 3.34Å; H444-T447 VanDerWaalsContact O-CB 3.25Å; H444-T447 WeakPolarHBondContact O-CB 3.44Å; H444-T447 PolarHBondContact O-N 2.86Å; H444-T447 PolarHBondContact O-OG1 3.41Å; L445-T447 PolarHBondContact O-N 3.2Å; L445-T447 VanDerWaalsContact O-N 3.12Å
448	H	79.3	Confident	76.1	Confident	58 Å²	58	70.5 Å²	70.5	27%	0.269	38%	0.375	S	S	.	.	H	α-helix	trans	-90.3	-45.2	172.5	-70.8	-63.2	0	0	0	112.6	C428 L430 C431 H444 L445 R446 G450	C428-H448 VanDerWaalsContact SG-CD2 3.58Å; C428-H448 PolarHBondContact SG-NE2 3.15Å; C428-H448 VanDerWaalsContact SG-NE2 3.42Å; L430-H448 HydrophobicContact CD1-CB 3.39Å; L430-H448 VanDerWaalsContact CD1-CG 3.48Å; C431-H448 PolarHBondContact SG-CE1 2.99Å; C431-H448 PolarHBondContact SG-NE2 3.33Å; H444-H448 AromaticContact CE1-NE2 3.62Å; H444-H448 AromaticContact NE2-CD2 3.8Å; H444-H448 AromaticContact NE2-NE2 3.3Å; H444-H448 PolarHBondContact NE2-NE2 3.11Å; L445-H448 WeakPolarHBondContact O-CA 3.49Å; L445-H448 WeakPolarHBondContact O-CB 3.46Å; L445-H448 PolarHBondContact O-N 2.91Å; R446-H448 VanDerWaalsContact C-N 3.28Å; H448-G450 PolarHBondContact O-N 3.04Å
449	T	73.6	Confident	76.7	Confident	86 Å²	86	68.3 Å²	68.3	53%	0.528	37%	0.368	S	S	.	.	H	α-helix	trans	-73.9	-19.1	-179.5	59.5	0	0	0	0	112.5	L445 R446 E451	L445-T449 PolarHBondContact O-N 2.93Å; L445-T449 VanDerWaalsContact O-N 3.07Å; R446-T449 WeakPolarHBondContact CA-OG1 3.09Å; T449-E451 PolarHBondContact O-N 3.01Å; T449-E451 WeakPolarHBondContact OG1-CG 3.48Å; T449-E451 PolarHBondContact OG1-N 3.21Å
450	G	74.1	Confident	77.1	Confident	48 Å²	48	68.5 Å²	68.5	50%	0.495	39%	0.385	S	S	.	.			trans	76.4	2.6	-175.5	0	0	0	0	0	113.4	R446 H448 K452	R446-G450 WeakPolarHBondContact O-CA 3.5Å; R446-G450 PolarHBondContact O-N 3.09Å; H448-G450 PolarHBondContact O-N 3.04Å; G450-K452 PolarHBondContact O-N 3.42Å
451	E	72.6	Confident	77.5	Confident	117 Å²	117	73.6 Å²	73.6	55%	0.547	40%	0.401	S	S	.	.			trans	-59.6	127.2	178	-74.1	178.9	-176.4	0	0	111.3	R446 T449 P453	R446-E451 HydrophobicContact CG-CB 4.4Å; T449-E451 PolarHBondContact O-N 3.01Å; T449-E451 WeakPolarHBondContact OG1-CG 3.48Å; T449-E451 PolarHBondContact OG1-N 3.21Å; E451-P453 VanDerWaalsContact C-CD 3.45Å; E451-P453 WeakPolarHBondContact O-CD 3.39Å
452	K	78.8	Confident	77.7	Confident	127 Å²	127	74.1 Å²	74.1	55%	0.552	41%	0.407	S	S	*	.			trans	-123.3	72.7	178.9	-73.7	155.6	163.7	-103.3	0	109.2	G450 F454 A462 F463	G450-K452 PolarHBondContact O-N 3.42Å; K452-F454 PolarHBondContact O-N 3.41Å; K452-A462 HydrophobicContact CB-CB 3.54Å; K452-A462 HydrophobicContact CD-CB 4.45Å; K452-A462 WeakPolarHBondContact CD-O 3.44Å; K452-A462 HydrophobicContact CG-CB 4.47Å; K452-A462 WeakPolarHBondContact CG-O 3.46Å; K452-A462 PolarHBondContact NZ-O 3.36Å; K452-A462 WeakPolarHBondContact O-CB 3.43Å; K452-F463 CarbonylContact C-O 3.59Å; K452-F463 WeakPolarHBondContact CA-O 3.4Å
453	P	78.9	Confident	78	Confident	73 Å²	73	72.2 Å²	72.2	47%	0.474	40%	0.395	S	S	.	.			trans	-67.5	-17.9	-175.4	25.9	-33.5	0	0	0	113.3	E451 A455	E451-P453 VanDerWaalsContact C-CD 3.45Å; E451-P453 WeakPolarHBondContact O-CD 3.39Å; P453-A455 PolarHBondContact O-N 2.92Å
454	F	79.1	Confident	78	Confident	38 Å²	38	72.3 Å²	72.3	17%	0.167	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	87.6	-175.8	-56.4	-66.6	0	0	0	111	K452 A462 F463 D465 R466 L469	K452-F454 PolarHBondContact O-N 3.41Å; F454-A462 CarbonylContact O-C 3.51Å; F454-A462 WeakPolarHBondContact O-CA 3.12Å; F454-F463 HydrophobicContact CB-CB 4.42Å; F454-F463 WeakPolarHBondContact CB-O 3.49Å; F454-F463 PolarHBondContact N-O 3.42Å; F454-F463 VanDerWaalsContact N-O 3.11Å; F454-F463 PolarHBondContact O-N 2.81Å; F454-D465 VanDerWaalsContact CD2-C 3.45Å; F454-R466 HydrophobicContact CD2-CB 4.46Å; F454-R466 HydrophobicContact CE1-CB 4.26Å; F454-R466 HydrophobicContact CE1-CG 4.48Å; F454-R466 HydrophobicContact CE2-CB 4.04Å; F454-R466 HydrophobicContact CZ-CB 3.95Å; F454-L469 HydrophobicContact CB-CB 4.01Å; F454-L469 HydrophobicContact CB-CD2 3.87Å; F454-L469 HydrophobicContact CB-CG 4.4Å
455	A	77.6	Confident	77.7	Confident	61 Å²	61	73.7 Å²	73.7	50%	0.504	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	143.7	171.8	0	0	0	0	0	111.4	P453 A462	P453-A455 PolarHBondContact O-N 2.92Å; A455-A462 HydrophobicContact CB-CB 4.33Å
456	C	81.5	Confident	77.7	Confident	10 Å²	10	73.4 Å²	73.4	7%	0.068	40%	0.397	C	S	.	.			trans	-72.5	137.7	164.5	-179.2	0	0	0	0	109.3	I458 C459 R461 L469 H472 M473 H476	C456-I458 VanDerWaalsContact C-N 3.3Å; C456-I458 PolarHBondContact SG-N 3.05Å; C456-C459 CarbonylContact C-O 3.57Å; C456-C459 WeakPolarHBondContact CB-O 3.47Å; C456-C459 PolarHBondContact SG-N 3.24Å; C456-C459 VanDerWaalsContact SG-N 3.42Å; C456-R461 WeakPolarHBondContact CB-O 3.49Å; C456-R461 PolarHBondContact N-O 3.05Å; C456-L469 HydrophobicContact CB-CD1 4.12Å; C456-H472 WeakPolarHBondContact CB-NE2 3.27Å; C456-H472 PolarHBondContact SG-NE2 3.4Å; C456-H472 VanDerWaalsContact SG-NE2 3.37Å; C456-M473 HydrophobicContact CB-SD 4.4Å; C456-H476 VanDerWaalsContact SG-CD2 3.51Å; C456-H476 PolarHBondContact SG-NE2 3.07Å
457	M	79.5	Confident	77.5	Confident	139 Å²	139	73.5 Å²	73.5	69%	0.685	41%	0.409	S	S	*	.	S	Bend	trans	-79.6	-16.2	176	-60.8	-173.4	-61	0	0	112.7
458	I	76.8	Confident	77.6	Confident	108 Å²	108	74.5 Å²	74.5	55%	0.554	41%	0.412	S	S	*	.	S	Bend	trans	-99.2	-26.6	-176.5	-55.8	170.9	0	0	0	111.1	C456 M473 H476	C456-I458 VanDerWaalsContact C-N 3.3Å; C456-I458 PolarHBondContact SG-N 3.05Å; I458-M473 HydrophobicContact CD1-CE 3.72Å; I458-M473 HydrophobicContact CG1-CE 4.21Å; I458-H476 HydrophobicContact CD1-CB 3.45Å; I458-H476 VanDerWaalsContact CD1-CB 3.45Å; I458-H476 HydrophobicContact CG2-CB 4.43Å; I458-H476 VanDerWaalsContact CG2-ND1 3.28Å; I458-H476 WeakPolarHBondContact CG2-ND1 3.48Å
459	C	80.1	Confident	77.7	Confident	39 Å²	39	72.6 Å²	72.6	26%	0.264	40%	0.403	S	S	.	.	S	Bend	trans	-140.9	164.7	175.5	74.1	0	0	0	0	112	C456 R461 H472 H476	C456-C459 CarbonylContact C-O 3.57Å; C456-C459 WeakPolarHBondContact CB-O 3.47Å; C456-C459 PolarHBondContact SG-N 3.24Å; C456-C459 VanDerWaalsContact SG-N 3.42Å; C459-R461 PolarHBondContact O-N 2.98Å; C459-H472 VanDerWaalsContact SG-CE1 3.52Å; C459-H472 PolarHBondContact SG-NE2 3.38Å; C459-H476 PolarHBondContact SG-NE2 3.32Å; C459-H476 VanDerWaalsContact SG-NE2 3.43Å
460	T	80.4	Confident	77.9	Confident	150 Å²	150	74.2 Å²	74.2	92%	0.92	40%	0.4	S	S	*	.	S	Bend	trans	-70.7	7	-176.5	57	0	0	0	0	114.7
461	R	79.6	Confident	78	Confident	164 Å²	164	73 Å²	73	62%	0.619	39%	0.385	S	S	*	.			trans	-79.3	127.1	-178.1	-75.8	-175.2	163	-174.5	-2.3	111.7	C456 C459 F463	C456-R461 WeakPolarHBondContact CB-O 3.49Å; C456-R461 PolarHBondContact N-O 3.05Å; C459-R461 PolarHBondContact O-N 2.98Å; R461-F463 HydrophobicContact CB-CE2 3.83Å; R461-F463 HydrophobicContact CB-CZ 4.01Å
462	A	79.8	Confident	78.5	Confident	25 Å²	25	67.8 Å²	67.8	21%	0.207	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	143.6	173.5	0	0	0	0	0	113	K452 F454 A455	K452-A462 HydrophobicContact CB-CB 3.54Å; K452-A462 HydrophobicContact CD-CB 4.45Å; K452-A462 WeakPolarHBondContact CD-O 3.44Å; K452-A462 HydrophobicContact CG-CB 4.47Å; K452-A462 WeakPolarHBondContact CG-O 3.46Å; K452-A462 PolarHBondContact NZ-O 3.36Å; K452-A462 WeakPolarHBondContact O-CB 3.43Å; F454-A462 CarbonylContact O-C 3.51Å; F454-A462 WeakPolarHBondContact O-CA 3.12Å; A455-A462 HydrophobicContact CB-CB 4.33Å
463	F	79	Confident	78.5	Confident	40 Å²	40	63 Å²	63	18%	0.175	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	146.8	-173.1	-58.9	-91.1	0	0	0	111.4	K452 F454 R461 N468 L469 H472	K452-F463 CarbonylContact C-O 3.59Å; K452-F463 WeakPolarHBondContact CA-O 3.4Å; F454-F463 HydrophobicContact CB-CB 4.42Å; F454-F463 WeakPolarHBondContact CB-O 3.49Å; F454-F463 PolarHBondContact N-O 3.42Å; F454-F463 VanDerWaalsContact N-O 3.11Å; F454-F463 PolarHBondContact O-N 2.81Å; R461-F463 HydrophobicContact CB-CE2 3.83Å; R461-F463 HydrophobicContact CB-CZ 4.01Å; F463-N468 HydrophobicContact CB-CB 4.25Å; F463-N468 HydrophobicContact CD1-CB 3.93Å; F463-N468 HydrophobicContact CG-CB 4.36Å; F463-L469 HydrophobicContact CB-CB 4.4Å; F463-L469 HydrophobicContact CD2-CB 4.22Å; F463-L469 HydrophobicContact CD2-CD1 3.8Å; F463-L469 HydrophobicContact CE2-CD1 4.19Å; F463-L469 HydrophobicContact CG-CB 4.49Å; F463-H472 HydrophobicContact CE1-CB 4.02Å; F463-H472 HydrophobicContact CE2-CB 3.79Å; F463-H472 AromaticContact CE2-CD2 3.13Å; F463-H472 WeakPolarHBondContact CE2-CD2 3.12Å; F463-H472 AromaticContact CE2-CG 3.49Å; F463-H472 VanDerWaalsContact CE2-CG 3.49Å; F463-H472 AromaticContact CE2-NE2 3.78Å; F463-H472 HydrophobicContact CZ-CB 3.44Å; F463-H472 VanDerWaalsContact CZ-CB 3.44Å; F463-H472 AromaticContact CZ-CD2 3.43Å; F463-H472 VanDerWaalsContact CZ-CD2 3.43Å; F463-H472 WeakPolarHBondContact CZ-CD2 3.39Å; F463-H472 AromaticContact CZ-CG 3.26Å; F463-H472 AromaticContact CZ-ND1 3.87Å; F463-H472 AromaticContact CZ-NE2 3.99Å
464	A	75.1	Confident	78.2	Confident	24 Å²	24	62.3 Å²	62.3	20%	0.198	33%	0.331	C	S	.	.	S	Bend	trans	-77.7	-25.7	178.9	0	0	0	0	0	113.2	R446	R446-A464 HydrophobicContact CB-CB 4.04Å; R446-A464 WeakPolarHBondContact CD-O 3.34Å; R446-A464 PolarHBondContact NH1-O 2.86Å; R446-A464 VanDerWaalsContact NH1-O 3.15Å
465	D	74.6	Confident	77.9	Confident	51 Å²	51	64 Å²	64	27%	0.273	35%	0.345	S	S	.	.	S	Bend	trans	-127.3	146.5	-178.4	-177	32.7	0	0	0	111.3	F454 S467 N468 L469	F454-D465 VanDerWaalsContact CD2-C 3.45Å; D465-S467 VanDerWaalsContact OD2-CB 3.23Å; D465-S467 WeakPolarHBondContact OD2-CB 3.32Å; D465-S467 PolarHBondContact OD2-OG 3.32Å; D465-N468 PolarHBondContact O-N 2.95Å; D465-L469 PolarHBondContact O-N 3.02Å
466	R	75.2	Confident	77.8	Confident	47 Å²	47	63.9 Å²	63.9	18%	0.177	33%	0.334	C	S	.	.	H	α-helix	trans	-67.6	-36.5	-177.7	-168.9	174.5	-171.8	123.5	8.3	112.2	A47 L48 L51 F454 N468 L469 R470	A47-R466 PolarHBondContact O-NH1 2.72Å; A47-R466 PolarHBondContact O-NH2 3.23Å; L48-R466 VanDerWaalsContact CA-NH2 3.26Å; L48-R466 PolarHBondContact O-NH2 3.14Å; L51-R466 VanDerWaalsContact CB-NE 3.32Å; F454-R466 HydrophobicContact CD2-CB 4.46Å; F454-R466 HydrophobicContact CE1-CB 4.26Å; F454-R466 HydrophobicContact CE1-CG 4.48Å; F454-R466 HydrophobicContact CE2-CB 4.04Å; F454-R466 HydrophobicContact CZ-CB 3.95Å; R466-N468 PolarHBondContact O-N 2.77Å; R466-L469 PolarHBondContact O-N 2.97Å; R466-R470 PolarHBondContact O-N 3Å
467	S	75.3	Confident	76.8	Confident	74 Å²	74	65.4 Å²	65.4	52%	0.517	34%	0.344	S	S	.	.	H	α-helix	trans	-59.5	-38.7	176.7	-40.1	0	0	0	0	111.1	D465 R470 A471	D465-S467 VanDerWaalsContact OD2-CB 3.23Å; D465-S467 WeakPolarHBondContact OD2-CB 3.32Å; D465-S467 PolarHBondContact OD2-OG 3.32Å; S467-R470 PolarHBondContact O-N 3.46Å; S467-A471 WeakPolarHBondContact O-CB 2.96Å; S467-A471 PolarHBondContact O-N 3.22Å
468	N	78.8	Confident	75.8	Confident	86 Å²	86	67.6 Å²	67.6	46%	0.46	35%	0.353	S	S	.	.	H	α-helix	trans	-71.7	-39.3	177.7	-71.2	-24.3	0	0	0	112.4	F463 D465 R466 H472	F463-N468 HydrophobicContact CB-CB 4.25Å; F463-N468 HydrophobicContact CD1-CB 3.93Å; F463-N468 HydrophobicContact CG-CB 4.36Å; D465-N468 PolarHBondContact O-N 2.95Å; R466-N468 PolarHBondContact O-N 2.77Å; N468-H472 VanDerWaalsContact O-CB 3.29Å; N468-H472 WeakPolarHBondContact O-CB 3.42Å; N468-H472 PolarHBondContact O-N 3.18Å
469	L	81.7	Confident	74.7	Confident	17 Å²	17	66.1 Å²	66.1	9%	0.089	35%	0.349	C	S	.	.	H	α-helix	trans	-60.3	-50.1	171.2	178.1	68.3	0	0	0	110.3	F454 C456 F463 D465 R466 A471 H472 M473	F454-L469 HydrophobicContact CB-CB 4.01Å; F454-L469 HydrophobicContact CB-CD2 3.87Å; F454-L469 HydrophobicContact CB-CG 4.4Å; C456-L469 HydrophobicContact CB-CD1 4.12Å; F463-L469 HydrophobicContact CB-CB 4.4Å; F463-L469 HydrophobicContact CD2-CB 4.22Å; F463-L469 HydrophobicContact CD2-CD1 3.8Å; F463-L469 HydrophobicContact CE2-CD1 4.19Å; F463-L469 HydrophobicContact CG-CB 4.49Å; D465-L469 PolarHBondContact O-N 3.02Å; R466-L469 PolarHBondContact O-N 2.97Å; L469-A471 VanDerWaalsContact C-N 3.33Å; L469-A471 PolarHBondContact O-N 3.32Å; L469-H472 CarbonylContact O-C 3.53Å; L469-H472 WeakPolarHBondContact O-CA 3.32Å; L469-H472 WeakPolarHBondContact O-CB 3.49Å; L469-H472 PolarHBondContact O-N 3.14Å; L469-M473 HydrophobicContact CD1-CG 4.36Å; L469-M473 HydrophobicContact CD1-SD 4.23Å; L469-M473 HydrophobicContact CG-CG 4.31Å; L469-M473 WeakPolarHBondContact O-CG 3.4Å; L469-M473 PolarHBondContact O-N 2.81Å
470	R	78.5	Confident	73.5	Confident	121 Å²	121	70.5 Å²	70.5	46%	0.457	36%	0.363	S	S	.	.	H	α-helix	trans	-56.3	-47.9	178.6	-176	-174.4	-72.3	176.7	-3.1	111.6	L51 R466 S467 H472 M473 Q474	L51-R470 PolarHBondContact O-NH2 3.06Å; R466-R470 PolarHBondContact O-N 3Å; S467-R470 PolarHBondContact O-N 3.46Å; R470-H472 PolarHBondContact O-N 3.44Å; R470-M473 PolarHBondContact O-N 2.77Å; R470-Q474 PolarHBondContact O-N 3.02Å
471	A	76.2	Confident	72.8	Confident	21 Å²	21	70 Å²	70	17%	0.174	35%	0.345	C	S	.	.	H	α-helix	trans	-64.5	-28.9	177.3	0	0	0	0	0	112.1	S467 L469 R493	S467-A471 WeakPolarHBondContact O-CB 2.96Å; S467-A471 PolarHBondContact O-N 3.22Å; L469-A471 VanDerWaalsContact C-N 3.33Å; L469-A471 PolarHBondContact O-N 3.32Å; A471-R493 VanDerWaalsContact CB-CZ 3.46Å; A471-R493 VanDerWaalsContact O-CZ 3.27Å; A471-R493 PolarHBondContact O-NE 3.48Å; A471-R493 PolarHBondContact O-NH2 3.04Å
472	H	82.9	Confident	72.2	Confident	8 Å²	8	65.7 Å²	65.7	4%	0.037	33%	0.329	C	S	.	.	H	α-helix	trans	-77.1	-36.6	173.7	166.7	59.9	0	0	0	112.4	C456 C459 F463 N468 L469 R470 Q474 T475 H476	C456-H472 WeakPolarHBondContact CB-NE2 3.27Å; C456-H472 PolarHBondContact SG-NE2 3.4Å; C456-H472 VanDerWaalsContact SG-NE2 3.37Å; C459-H472 VanDerWaalsContact SG-CE1 3.52Å; C459-H472 PolarHBondContact SG-NE2 3.38Å; F463-H472 HydrophobicContact CE1-CB 4.02Å; F463-H472 HydrophobicContact CE2-CB 3.79Å; F463-H472 AromaticContact CE2-CD2 3.13Å; F463-H472 WeakPolarHBondContact CE2-CD2 3.12Å; F463-H472 AromaticContact CE2-CG 3.49Å; F463-H472 VanDerWaalsContact CE2-CG 3.49Å; F463-H472 AromaticContact CE2-NE2 3.78Å; F463-H472 HydrophobicContact CZ-CB 3.44Å; F463-H472 VanDerWaalsContact CZ-CB 3.44Å; F463-H472 AromaticContact CZ-CD2 3.43Å; F463-H472 VanDerWaalsContact CZ-CD2 3.43Å; F463-H472 WeakPolarHBondContact CZ-CD2 3.39Å; F463-H472 AromaticContact CZ-CG 3.26Å; F463-H472 AromaticContact CZ-ND1 3.87Å; F463-H472 AromaticContact CZ-NE2 3.99Å; N468-H472 VanDerWaalsContact O-CB 3.29Å; N468-H472 WeakPolarHBondContact O-CB 3.42Å; N468-H472 PolarHBondContact O-N 3.18Å; L469-H472 CarbonylContact O-C 3.53Å; L469-H472 WeakPolarHBondContact O-CA 3.32Å; L469-H472 WeakPolarHBondContact O-CB 3.49Å; L469-H472 PolarHBondContact O-N 3.14Å; R470-H472 PolarHBondContact O-N 3.44Å; H472-Q474 PolarHBondContact O-N 3.17Å; H472-Q474 VanDerWaalsContact O-N 3.16Å; H472-T475 PolarHBondContact ND1-OG1 3.49Å; H472-T475 WeakPolarHBondContact O-CA 3.36Å; H472-T475 WeakPolarHBondContact O-CB 3.15Å; H472-T475 PolarHBondContact O-N 2.78Å; H472-T475 PolarHBondContact O-OG1 2.88Å; H472-H476 AromaticContact CE1-CD2 3.9Å; H472-H476 AromaticContact CE1-NE2 3.31Å; H472-H476 PolarHBondContact CE1-NE2 3.28Å; H472-H476 VanDerWaalsContact CE1-NE2 3.31Å; H472-H476 AromaticContact NE2-CD2 3.85Å; H472-H476 AromaticContact NE2-NE2 3.31Å; H472-H476 PolarHBondContact NE2-NE2 2.78Å
473	M	77.2	Confident	71.8	Confident	26 Å²	26	70 Å²	70	13%	0.128	35%	0.345	C	S	.	.	H	α-helix	trans	-59	-30.4	174.4	-65.4	-55.1	-67.4	0	0	111.8	F52 C456 I458 L469 R470 T475 H476 S477	F52-M473 HydrophobicContact CE2-CG 4.39Å; C456-M473 HydrophobicContact CB-SD 4.4Å; I458-M473 HydrophobicContact CD1-CE 3.72Å; I458-M473 HydrophobicContact CG1-CE 4.21Å; L469-M473 HydrophobicContact CD1-CG 4.36Å; L469-M473 HydrophobicContact CD1-SD 4.23Å; L469-M473 HydrophobicContact CG-CG 4.31Å; L469-M473 WeakPolarHBondContact O-CG 3.4Å; L469-M473 PolarHBondContact O-N 2.81Å; R470-M473 PolarHBondContact O-N 2.77Å; M473-T475 PolarHBondContact O-N 2.96Å; M473-T475 VanDerWaalsContact O-N 3.15Å; M473-H476 PolarHBondContact O-N 3.07Å; M473-S477 PolarHBondContact O-N 3.03Å; M473-S477 VanDerWaalsContact O-N 3.17Å
474	Q	73.1	Confident	71.8	Confident	60 Å²	60	68.3 Å²	68.3	28%	0.28	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-16.4	171.5	-66.7	175.6	-9.7	0	0	114.2	R470 H472 S477	R470-Q474 PolarHBondContact O-N 3.02Å; H472-Q474 PolarHBondContact O-N 3.17Å; H472-Q474 VanDerWaalsContact O-N 3.16Å; Q474-S477 WeakPolarHBondContact CA-OG 3.07Å; Q474-S477 VanDerWaalsContact O-O 3.05Å; Q474-S477 PolarHBondContact O-OG 3.28Å
475	T	73.7	Confident	71.8	Confident	74 Å²	74	73.1 Å²	73.1	45%	0.454	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-18.2	172.9	68.8	0	0	0	0	112.7	H472 M473	H472-T475 PolarHBondContact ND1-OG1 3.49Å; H472-T475 WeakPolarHBondContact O-CA 3.36Å; H472-T475 WeakPolarHBondContact O-CB 3.15Å; H472-T475 PolarHBondContact O-N 2.78Å; H472-T475 PolarHBondContact O-OG1 2.88Å; M473-T475 PolarHBondContact O-N 2.96Å; M473-T475 VanDerWaalsContact O-N 3.15Å
476	H	75.6	Confident	71.8	Confident	58 Å²	58	76.4 Å²	76.4	27%	0.269	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-34.5	173.5	-70.7	-66.2	0	0	0	112.2	C456 I458 C459 H472 M473 E478	C456-H476 VanDerWaalsContact SG-CD2 3.51Å; C456-H476 PolarHBondContact SG-NE2 3.07Å; I458-H476 HydrophobicContact CD1-CB 3.45Å; I458-H476 VanDerWaalsContact CD1-CB 3.45Å; I458-H476 HydrophobicContact CG2-CB 4.43Å; I458-H476 VanDerWaalsContact CG2-ND1 3.28Å; I458-H476 WeakPolarHBondContact CG2-ND1 3.48Å; C459-H476 PolarHBondContact SG-NE2 3.32Å; C459-H476 VanDerWaalsContact SG-NE2 3.43Å; H472-H476 AromaticContact CE1-CD2 3.9Å; H472-H476 AromaticContact CE1-NE2 3.31Å; H472-H476 PolarHBondContact CE1-NE2 3.28Å; H472-H476 VanDerWaalsContact CE1-NE2 3.31Å; H472-H476 AromaticContact NE2-CD2 3.85Å; H472-H476 AromaticContact NE2-NE2 3.31Å; H472-H476 PolarHBondContact NE2-NE2 2.78Å; M473-H476 PolarHBondContact O-N 3.07Å; H476-E478 PolarHBondContact O-N 3.44Å
477	S	60.9	Low	72	Confident	42 Å²	42	74.8 Å²	74.8	29%	0.294	37%	0.369	S	S	.	.	S	Bend	trans	-71.3	110.7	167.3	65.2	0	0	0	0	108.3	M473 Q474 V479	M473-S477 PolarHBondContact O-N 3.03Å; M473-S477 VanDerWaalsContact O-N 3.17Å; Q474-S477 WeakPolarHBondContact CA-OG 3.07Å; Q474-S477 VanDerWaalsContact O-O 3.05Å; Q474-S477 PolarHBondContact O-OG 3.28Å; S477-V479 PolarHBondContact O-N 3.38Å
478	E	56.6	Low	72	Confident	185 Å²	185	78.3 Å²	78.3	86%	0.864	38%	0.381	S	S	*	.			trans	-62.6	7.6	177	-63.5	-171.9	158.5	0	0	114.2	H476 K480	H476-E478 PolarHBondContact O-N 3.44Å; E478-K480 VanDerWaalsContact C-N 3.35Å; E478-K480 PolarHBondContact O-N 3.33Å
479	V	54	Low	71.7	Confident	77 Å²	77	80.8 Å²	80.8	47%	0.467	38%	0.384	S	S	.	.			trans	-71.6	85.4	175.4	-166	0	0	0	0	110.2	S477 R481	S477-V479 PolarHBondContact O-N 3.38Å; V479-R481 HydrophobicContact CG1-CG 3.71Å; V479-R481 PolarHBondContact O-N 3.37Å
480	K	55.4	Low	71.3	Confident	131 Å²	131	82.5 Å²	82.5	57%	0.57	40%	0.396	S	S	*	.			trans	-74.8	86.6	171.4	-57.2	178.7	-173.1	167.9	0	109.8	E478 Y482 T490	E478-K480 VanDerWaalsContact C-N 3.35Å; E478-K480 PolarHBondContact O-N 3.33Å; K480-Y482 VanDerWaalsContact C-N 3.32Å; K480-Y482 PolarHBondContact O-N 3.12Å; K480-T490 WeakPolarHBondContact CD-OG1 3.37Å
481	R	65.4	Low	71.1	Confident	140 Å²	140	78.4 Å²	78.4	53%	0.528	38%	0.381	S	S	.	.			trans	-70.8	-20.8	-174	-65.2	-176.1	-179.9	81.8	-0.7	114.9	V479	V479-R481 HydrophobicContact CG1-CG 3.71Å; V479-R481 PolarHBondContact O-N 3.37Å
482	Y	66.5	Low	70.8	Confident	73 Å²	73	78.7 Å²	78.7	29%	0.286	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	99.4	-167.2	-57.7	-69.7	0	0	0	111.5	K480 T490 F491 M494	K480-Y482 VanDerWaalsContact C-N 3.32Å; K480-Y482 PolarHBondContact O-N 3.12Å; Y482-T490 CarbonylContact O-C 3.39Å; Y482-T490 WeakPolarHBondContact O-CA 3.36Å; Y482-F491 WeakPolarHBondContact CB-O 3.41Å; Y482-F491 PolarHBondContact N-O 3.15Å; Y482-F491 PolarHBondContact O-N 3.24Å; Y482-M494 HydrophobicContact CD1-CB 4.47Å; Y482-M494 HydrophobicContact CD1-CE 3.44Å; Y482-M494 VanDerWaalsContact CD1-CE 3.44Å; Y482-M494 HydrophobicContact CD1-SD 3.88Å; Y482-M494 HydrophobicContact CE1-CB 4.27Å; Y482-M494 HydrophobicContact CE1-CE 3.3Å; Y482-M494 HydrophobicContact CE1-SD 4.18Å; Y482-M494 HydrophobicContact CE2-CB 4.37Å; Y482-M494 HydrophobicContact CG-SD 4.47Å
483	Q	71.4	Confident	70.2	Confident	116 Å²	116	82.5 Å²	82.5	54%	0.542	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	142.8	174.4	-170.9	173	3.6	0	0	111	T490	Q483-T490 HydrophobicContact CB-CG2 3.98Å; Q483-T490 HydrophobicContact CG-CG2 3.95Å
484	C	79.3	Confident	70.2	Confident	3 Å²	3	85.5 Å²	85.5	2%	0.02	41%	0.411	C	S	.	.			trans	-75.5	129.5	168.6	-175.4	0	0	0	0	110.5	H486 C487 R489 F491 L497 H500 C505	C484-H486 PolarHBondContact O-N 3.47Å; C484-H486 VanDerWaalsContact O-N 3.12Å; C484-C487 WeakPolarHBondContact CB-O 3.4Å; C484-C487 PolarHBondContact O-N 3.42Å; C484-R489 PolarHBondContact N-O 2.92Å; C484-F491 HydrophobicContact CB-CE2 4.29Å; C484-L497 HydrophobicContact CB-CD1 3.73Å; C484-H500 VanDerWaalsContact SG-CD2 3.55Å; C484-H500 PolarHBondContact SG-NE2 3.24Å; C484-C505 VanDerWaalsContact SG-SG 3.69Å
485	L	75.1	Confident	70.5	Confident	125 Å²	125	85.3 Å²	85.3	65%	0.654	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-11.7	177.1	-66.6	172.3	0	0	0	114.3	T67	T67-L485 HydrophobicContact CG2-CD1 4.34Å
486	H	74.7	Confident	70.7	Confident	120 Å²	120	85.7 Å²	85.7	56%	0.556	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	-6	-172.8	-64.8	-45.7	0	0	0	113.3	C484 C505 M509	C484-H486 PolarHBondContact O-N 3.47Å; C484-H486 VanDerWaalsContact O-N 3.12Å; H486-C505 WeakPolarHBondContact CB-SG 3.22Å; H486-M509 HydrophobicContact CB-CE 4.09Å
487	C	79.1	Confident	71	Confident	14 Å²	14	83.4 Å²	83.4	10%	0.095	41%	0.413	C	S	.	.	S	Bend	trans	-155.9	157.9	171.7	73.4	0	0	0	0	110.7	C484 R489 H500	C484-C487 WeakPolarHBondContact CB-O 3.4Å; C484-C487 PolarHBondContact O-N 3.42Å; C487-R489 PolarHBondContact O-N 3.1Å; C487-H500 VanDerWaalsContact SG-CE1 3.52Å; C487-H500 PolarHBondContact SG-NE2 2.77Å
488	D	75.1	Confident	71.8	Confident	147 Å²	147	84.8 Å²	84.8	79%	0.786	42%	0.42	S	S	*	.	S	Bend	trans	-72.2	16.7	-176	-54.4	-43.6	0	0	0	114.6
489	R	73.6	Confident	73	Confident	138 Å²	138	82.5 Å²	82.5	52%	0.521	41%	0.407	S	S	.	.			trans	-81.8	127.5	179.2	-65.3	-171.2	179.1	-155.6	0.6	110.9	C484 C487 F491 Q508	C484-R489 PolarHBondContact N-O 2.92Å; C487-R489 PolarHBondContact O-N 3.1Å; R489-F491 HydrophobicContact CB-CE2 3.75Å; R489-F491 HydrophobicContact CB-CZ 3.76Å; R489-F491 WeakPolarHBondContact O-CE2 3.48Å; R489-Q508 VanDerWaalsContact CZ-NE2 3.31Å; R489-Q508 VanDerWaalsContact NE-NE2 3.1Å
490	T	72.9	Confident	74.3	Confident	54 Å²	54	79.2 Å²	79.2	33%	0.331	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.2	177.8	48.7	0	0	0	0	110.5	K480 Y482 Q483	K480-T490 WeakPolarHBondContact CD-OG1 3.37Å; Y482-T490 CarbonylContact O-C 3.39Å; Y482-T490 WeakPolarHBondContact O-CA 3.36Å; Q483-T490 HydrophobicContact CB-CG2 3.98Å; Q483-T490 HydrophobicContact CG-CG2 3.95Å
491	F	74.2	Confident	75.4	Confident	35 Å²	35	76.1 Å²	76.1	15%	0.154	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	144.8	-172.4	-59.7	-85.1	0	0	0	110.3	Y482 C484 R489 L496 L497 H500	Y482-F491 WeakPolarHBondContact CB-O 3.41Å; Y482-F491 PolarHBondContact N-O 3.15Å; Y482-F491 PolarHBondContact O-N 3.24Å; C484-F491 HydrophobicContact CB-CE2 4.29Å; R489-F491 HydrophobicContact CB-CE2 3.75Å; R489-F491 HydrophobicContact CB-CZ 3.76Å; R489-F491 WeakPolarHBondContact O-CE2 3.48Å; F491-L496 HydrophobicContact CB-CB 4.26Å; F491-L496 HydrophobicContact CD1-CB 3.84Å; F491-L496 HydrophobicContact CG-CB 4.32Å; F491-L497 HydrophobicContact CB-CB 4.35Å; F491-L497 HydrophobicContact CD2-CB 3.98Å; F491-L497 HydrophobicContact CD2-CD1 3.85Å; F491-L497 HydrophobicContact CE2-CD1 4.03Å; F491-L497 HydrophobicContact CG-CB 4.3Å; F491-H500 HydrophobicContact CE1-CB 3.83Å; F491-H500 HydrophobicContact CE2-CB 3.85Å; F491-H500 AromaticContact CE2-CD2 3.59Å; F491-H500 AromaticContact CE2-CG 3.63Å; F491-H500 HydrophobicContact CZ-CB 3.34Å; F491-H500 AromaticContact CZ-CD2 3.62Å; F491-H500 AromaticContact CZ-CG 3.17Å; F491-H500 AromaticContact CZ-ND1 3.6Å
492	S	71	Confident	76	Confident	26 Å²	26	73.7 Å²	73.7	18%	0.182	38%	0.375	C	S	.	.	S	Bend	trans	-80.9	-16	177.2	53	0	0	0	0	113.5
493	R	69.5	Low	76.2	Confident	88 Å²	88	73.5 Å²	73.5	33%	0.332	38%	0.381	S	S	.	.	S	Bend	trans	-136.5	140.4	-179.1	-62.6	-175.8	-175.2	177.4	4	111.4	A471 G495 L496 L497	A471-R493 VanDerWaalsContact CB-CZ 3.46Å; A471-R493 VanDerWaalsContact O-CZ 3.27Å; A471-R493 PolarHBondContact O-NE 3.48Å; A471-R493 PolarHBondContact O-NH2 3.04Å; R493-G495 VanDerWaalsContact C-N 3.31Å; R493-G495 PolarHBondContact O-N 3.11Å; R493-L496 HydrophobicContact CB-CD1 4.29Å; R493-L496 HydrophobicContact CB-CG 4.28Å; R493-L496 WeakPolarHBondContact O-CB 3.43Å; R493-L496 PolarHBondContact O-N 3.03Å; R493-L496 VanDerWaalsContact O-N 3.09Å; R493-L497 PolarHBondContact O-N 3.24Å
494	M	77.1	Confident	76.1	Confident	90 Å²	90	69.9 Å²	69.9	44%	0.443	37%	0.369	S	S	.	.	H	α-helix	trans	-57	-41.8	176.5	-172.3	62.7	86	0	0	112.6	Y482 L496 L497 T498	Y482-M494 HydrophobicContact CD1-CB 4.47Å; Y482-M494 HydrophobicContact CD1-CE 3.44Å; Y482-M494 VanDerWaalsContact CD1-CE 3.44Å; Y482-M494 HydrophobicContact CD1-SD 3.88Å; Y482-M494 HydrophobicContact CE1-CB 4.27Å; Y482-M494 HydrophobicContact CE1-CE 3.3Å; Y482-M494 HydrophobicContact CE1-SD 4.18Å; Y482-M494 HydrophobicContact CE2-CB 4.37Å; Y482-M494 HydrophobicContact CG-SD 4.47Å; M494-L496 PolarHBondContact O-N 2.98Å; M494-L497 WeakPolarHBondContact O-CA 3.33Å; M494-L497 WeakPolarHBondContact O-CB 3.46Å; M494-L497 PolarHBondContact O-N 3.29Å; M494-L497 HydrophobicContact SD-CD2 3.94Å; M494-T498 PolarHBondContact O-N 3.05Å; M494-T498 PolarHBondContact O-OG1 3.28Å
495	G	78.8	Confident	75.5	Confident	55 Å²	55	69.9 Å²	69.9	57%	0.567	37%	0.369	S	S	*	.	H	α-helix	trans	-61.9	-27.9	178.9	0	0	0	0	0	114.2	R493 K499	R493-G495 VanDerWaalsContact C-N 3.31Å; R493-G495 PolarHBondContact O-N 3.11Å; G495-K499 WeakPolarHBondContact O-CB 3.42Å; G495-K499 PolarHBondContact O-N 3.14Å; G495-K499 VanDerWaalsContact O-N 3.08Å
496	L	78.7	Confident	74.9	Confident	82 Å²	82	68.7 Å²	68.7	43%	0.429	36%	0.363	S	S	.	.	H	α-helix	trans	-74.7	-38	173.2	-66.8	175.6	0	0	0	111.3	F491 R493 M494 K499 H500	F491-L496 HydrophobicContact CB-CB 4.26Å; F491-L496 HydrophobicContact CD1-CB 3.84Å; F491-L496 HydrophobicContact CG-CB 4.32Å; R493-L496 HydrophobicContact CB-CD1 4.29Å; R493-L496 HydrophobicContact CB-CG 4.28Å; R493-L496 WeakPolarHBondContact O-CB 3.43Å; R493-L496 PolarHBondContact O-N 3.03Å; R493-L496 VanDerWaalsContact O-N 3.09Å; M494-L496 PolarHBondContact O-N 2.98Å; L496-K499 PolarHBondContact O-N 2.99Å; L496-H500 VanDerWaalsContact O-CB 3.23Å; L496-H500 WeakPolarHBondContact O-CB 3.38Å; L496-H500 PolarHBondContact O-N 3.34Å
497	L	81	Confident	74.2	Confident	11 Å²	11	68.8 Å²	68.8	6%	0.058	36%	0.364	C	S	.	.	H	α-helix	trans	-62.2	-48.4	172.9	172.4	61.3	0	0	0	110.8	C484 F491 R493 M494 K499 H500 Q501	C484-L497 HydrophobicContact CB-CD1 3.73Å; F491-L497 HydrophobicContact CB-CB 4.35Å; F491-L497 HydrophobicContact CD2-CB 3.98Å; F491-L497 HydrophobicContact CD2-CD1 3.85Å; F491-L497 HydrophobicContact CE2-CD1 4.03Å; F491-L497 HydrophobicContact CG-CB 4.3Å; R493-L497 PolarHBondContact O-N 3.24Å; M494-L497 WeakPolarHBondContact O-CA 3.33Å; M494-L497 WeakPolarHBondContact O-CB 3.46Å; M494-L497 PolarHBondContact O-N 3.29Å; M494-L497 HydrophobicContact SD-CD2 3.94Å; L497-K499 VanDerWaalsContact C-N 3.34Å; L497-K499 PolarHBondContact O-N 2.98Å; L497-H500 CarbonylContact O-C 3.47Å; L497-H500 WeakPolarHBondContact O-CB 3.32Å; L497-H500 PolarHBondContact O-N 2.7Å; L497-H500 VanDerWaalsContact O-N 3.1Å; L497-Q501 HydrophobicContact CD1-CG 3.9Å; L497-Q501 HydrophobicContact CG-CG 4.38Å; L497-Q501 WeakPolarHBondContact O-CB 3.26Å; L497-Q501 WeakPolarHBondContact O-CG 3.28Å; L497-Q501 PolarHBondContact O-N 3.47Å
498	T	78.9	Confident	73.1	Confident	70 Å²	70	71 Å²	71	43%	0.429	37%	0.373	S	S	.	.	H	α-helix	trans	-59.8	-44	177.4	-49.5	0	0	0	0	111.5	M494 H500 Q501 T502	M494-T498 PolarHBondContact O-N 3.05Å; M494-T498 PolarHBondContact O-OG1 3.28Å; T498-H500 VanDerWaalsContact C-N 3.34Å; T498-H500 PolarHBondContact O-N 3.41Å; T498-Q501 PolarHBondContact O-N 3.27Å; T498-T502 WeakPolarHBondContact O-CB 3.39Å; T498-T502 WeakPolarHBondContact O-CG2 3.22Å; T498-T502 PolarHBondContact O-N 2.99Å; T498-T502 PolarHBondContact O-OG1 2.98Å
499	K	80.3	Confident	72	Confident	137 Å²	137	68.5 Å²	68.5	60%	0.596	36%	0.357	S	S	*	.	H	α-helix	trans	-63.2	-41.3	174.9	-168.8	174.8	-178.3	177.8	0	111.3	G495 L496 L497 T502 T503	G495-K499 WeakPolarHBondContact O-CB 3.42Å; G495-K499 PolarHBondContact O-N 3.14Å; G495-K499 VanDerWaalsContact O-N 3.08Å; L496-K499 PolarHBondContact O-N 2.99Å; L497-K499 VanDerWaalsContact C-N 3.34Å; L497-K499 PolarHBondContact O-N 2.98Å; K499-T502 WeakPolarHBondContact CA-OG1 3.47Å; K499-T502 PolarHBondContact O-N 2.75Å; K499-T502 PolarHBondContact O-OG1 3.47Å; K499-T503 HydrophobicContact CG-CG2 4.38Å; K499-T503 PolarHBondContact O-N 2.99Å; K499-T503 PolarHBondContact O-OG1 2.92Å
500	H	82.3	Confident	71	Confident	8 Å²	8	69.1 Å²	69.1	4%	0.037	36%	0.364	C	S	.	.	H	α-helix	trans	-63.7	-47.6	177.1	167.8	74.9	0	0	0	112.2	C484 C487 F491 L496 L497 T498 T502 T503 S504 C505	C484-H500 VanDerWaalsContact SG-CD2 3.55Å; C484-H500 PolarHBondContact SG-NE2 3.24Å; C487-H500 VanDerWaalsContact SG-CE1 3.52Å; C487-H500 PolarHBondContact SG-NE2 2.77Å; F491-H500 HydrophobicContact CE1-CB 3.83Å; F491-H500 HydrophobicContact CE2-CB 3.85Å; F491-H500 AromaticContact CE2-CD2 3.59Å; F491-H500 AromaticContact CE2-CG 3.63Å; F491-H500 HydrophobicContact CZ-CB 3.34Å; F491-H500 AromaticContact CZ-CD2 3.62Å; F491-H500 AromaticContact CZ-CG 3.17Å; F491-H500 AromaticContact CZ-ND1 3.6Å; L496-H500 VanDerWaalsContact O-CB 3.23Å; L496-H500 WeakPolarHBondContact O-CB 3.38Å; L496-H500 PolarHBondContact O-N 3.34Å; L497-H500 CarbonylContact O-C 3.47Å; L497-H500 WeakPolarHBondContact O-CB 3.32Å; L497-H500 PolarHBondContact O-N 2.7Å; L497-H500 VanDerWaalsContact O-N 3.1Å; T498-H500 VanDerWaalsContact C-N 3.34Å; T498-H500 PolarHBondContact O-N 3.41Å; H500-T502 VanDerWaalsContact C-N 3.29Å; H500-T502 PolarHBondContact O-N 3.2Å; H500-T503 PolarHBondContact O-N 2.87Å; H500-S504 CarbonylContact O-C 3.53Å; H500-S504 WeakPolarHBondContact O-CA 3.46Å; H500-S504 PolarHBondContact O-N 3Å; H500-C505 WeakPolarHBondContact O-CB 3.49Å; H500-C505 PolarHBondContact O-N 3.28Å
501	Q	79	Confident	70	Confident	66 Å²	66	73.9 Å²	73.9	31%	0.308	38%	0.38	S	S	.	.	I	π-helix	trans	-58.1	-43	176.8	-76	172.3	-33.5	0	0	111.1	L497 T498	L497-Q501 HydrophobicContact CD1-CG 3.9Å; L497-Q501 HydrophobicContact CG-CG 4.38Å; L497-Q501 WeakPolarHBondContact O-CB 3.26Å; L497-Q501 WeakPolarHBondContact O-CG 3.28Å; L497-Q501 PolarHBondContact O-N 3.47Å; T498-Q501 PolarHBondContact O-N 3.27Å
502	T	77	Confident	68.6	Low	89 Å²	89	75.1 Å²	75.1	55%	0.546	39%	0.393	S	S	.	.	I	π-helix	trans	-74.5	-40.4	-179.3	49.9	0	0	0	0	114	T498 K499 H500 L506	T498-T502 WeakPolarHBondContact O-CB 3.39Å; T498-T502 WeakPolarHBondContact O-CG2 3.22Å; T498-T502 PolarHBondContact O-N 2.99Å; T498-T502 PolarHBondContact O-OG1 2.98Å; K499-T502 WeakPolarHBondContact CA-OG1 3.47Å; K499-T502 PolarHBondContact O-N 2.75Å; K499-T502 PolarHBondContact O-OG1 3.47Å; H500-T502 VanDerWaalsContact C-N 3.29Å; H500-T502 PolarHBondContact O-N 3.2Å; T502-L506 WeakPolarHBondContact O-CD1 3.42Å
503	T	71	Confident	67.4	Low	69 Å²	69	78.2 Å²	78.2	42%	0.423	41%	0.411	S	S	.	.	I	π-helix	trans	-103.4	-33.4	-171.5	65.8	0	0	0	0	115.3	K499 H500 Q507	K499-T503 HydrophobicContact CG-CG2 4.38Å; K499-T503 PolarHBondContact O-N 2.99Å; K499-T503 PolarHBondContact O-OG1 2.92Å; H500-T503 PolarHBondContact O-N 2.87Å; T503-Q507 PolarHBondContact O-NE2 3.37Å; T503-Q507 VanDerWaalsContact O-NE2 3.1Å
504	S	69.6	Low	66.2	Low	41 Å²	41	83 Å²	83	29%	0.287	43%	0.434	S	S	.	.	I	π-helix	trans	-121	-29.6	-161.2	-61.4	0	0	0	0	113.4	H500 Q507 Q508	H500-S504 CarbonylContact O-C 3.53Å; H500-S504 WeakPolarHBondContact O-CA 3.46Å; H500-S504 PolarHBondContact O-N 3Å; S504-Q507 PolarHBondContact O-N 2.55Å; S504-Q508 PolarHBondContact O-N 2.97Å
505	C	66.6	Low	64.3	Low	2 Å²	2	84 Å²	84	1%	0.014	45%	0.449	C	S	.	.	I	π-helix	trans	-66	-41	177.7	-165.1	0	0	0	0	111.9	C484 H486 H500 Q507 Q508 M509	C484-C505 VanDerWaalsContact SG-SG 3.69Å; H486-C505 WeakPolarHBondContact CB-SG 3.22Å; H500-C505 WeakPolarHBondContact O-CB 3.49Å; H500-C505 PolarHBondContact O-N 3.28Å; C505-Q507 PolarHBondContact O-N 3.31Å; C505-Q507 VanDerWaalsContact O-N 3.15Å; C505-Q508 PolarHBondContact O-N 3.26Å; C505-M509 PolarHBondContact O-N 2.93Å; C505-M509 VanDerWaalsContact O-N 3.11Å
506	L	62.6	Low	62.3	Low	101 Å²	101	88.9 Å²	88.9	53%	0.529	45%	0.451	S	S	.	.	H	α-helix	trans	-57	-28.7	172.8	-82.3	125.7	0	0	0	113.5	T502 K510	T502-L506 WeakPolarHBondContact O-CD1 3.42Å; L506-K510 WeakPolarHBondContact O-CG 3.3Å; L506-K510 PolarHBondContact O-N 3.32Å
507	Q	60.8	Low	60.1	Low	122 Å²	122	92.6 Å²	92.6	57%	0.57	47%	0.471	S	S	*	.	H	α-helix	trans	-78.5	-32.2	178.4	-61.3	-179.6	21.7	0	0	112.2	T503 S504 C505 K510 K511	T503-Q507 PolarHBondContact O-NE2 3.37Å; T503-Q507 VanDerWaalsContact O-NE2 3.1Å; S504-Q507 PolarHBondContact O-N 2.55Å; C505-Q507 PolarHBondContact O-N 3.31Å; C505-Q507 VanDerWaalsContact O-N 3.15Å; Q507-K510 PolarHBondContact O-N 3.09Å; Q507-K511 PolarHBondContact O-N 3.08Å
508	Q	55.8	Low	57.9	Low	61 Å²	61	99.7 Å²	99.7	29%	0.285	51%	0.508	S	S	.	.	H	α-helix	trans	-71.5	-35.2	174.8	-66.5	-176.3	18.4	0	0	111.2	R489 S504 C505 K510 K511 S512	R489-Q508 VanDerWaalsContact CZ-NE2 3.31Å; R489-Q508 VanDerWaalsContact NE-NE2 3.1Å; S504-Q508 PolarHBondContact O-N 2.97Å; C505-Q508 PolarHBondContact O-N 3.26Å; Q508-K510 VanDerWaalsContact C-N 3.33Å; Q508-K510 PolarHBondContact O-N 2.84Å; Q508-K511 PolarHBondContact O-N 3.18Å; Q508-S512 WeakPolarHBondContact O-CB 3.48Å; Q508-S512 PolarHBondContact O-N 3.36Å
509	M	50.7	Low	55.8	Low	94 Å²	94	100.1 Å²	100.1	46%	0.463	51%	0.513	S	S	.	.	H	α-helix	trans	-60	-41.8	170.4	-68.5	-161.3	143.7	0	0	112	H486 C505 K511 S512 T513	H486-M509 HydrophobicContact CB-CE 4.09Å; C505-M509 PolarHBondContact O-N 2.93Å; C505-M509 VanDerWaalsContact O-N 3.11Å; M509-K511 VanDerWaalsContact C-N 3.33Å; M509-K511 PolarHBondContact O-N 3.05Å; M509-S512 PolarHBondContact O-N 3.49Å; M509-T513 WeakPolarHBondContact O-CB 3.31Å; M509-T513 WeakPolarHBondContact O-CG2 3.32Å; M509-T513 PolarHBondContact O-N 3.45Å; M509-T513 PolarHBondContact O-OG1 2.92Å; M509-T513 VanDerWaalsContact O-OG1 3.04Å
510	K	53.8	Low	54	Low	150 Å²	150	103.7 Å²	103.7	65%	0.652	53%	0.529	S	S	*	.	H	α-helix	trans	-70	-23.1	178	-70.4	179.9	-178.6	-175	0	114.8	L506 Q507 Q508 T513	L506-K510 WeakPolarHBondContact O-CG 3.3Å; L506-K510 PolarHBondContact O-N 3.32Å; Q507-K510 PolarHBondContact O-N 3.09Å; Q508-K510 VanDerWaalsContact C-N 3.33Å; Q508-K510 PolarHBondContact O-N 2.84Å; K510-T513 WeakPolarHBondContact CA-OG1 3.41Å; K510-T513 PolarHBondContact O-OG1 3.22Å
511	K	50.2	Low	51.9	Low	155 Å²	155	107.4 Å²	107.4	67%	0.674	55%	0.552	S	S	*	*	H	α-helix	trans	-86.9	-35.5	175.1	-70.3	-174.2	177.9	-167	0	112	Q507 Q508 M509 K514	Q507-K511 PolarHBondContact O-N 3.08Å; Q508-K511 PolarHBondContact O-N 3.18Å; M509-K511 VanDerWaalsContact C-N 3.33Å; M509-K511 PolarHBondContact O-N 3.05Å; K511-K514 PolarHBondContact O-N 3.32Å
512	S	46.2	Very low	50	Low	61 Å²	61	107.3 Å²	107.3	43%	0.427	57%	0.568	S	S	.	*	H	α-helix	trans	-67.5	-33.7	172.7	169.5	0	0	0	0	112.7	Q508 M509 K514	Q508-S512 WeakPolarHBondContact O-CB 3.48Å; Q508-S512 PolarHBondContact O-N 3.36Å; M509-S512 PolarHBondContact O-N 3.49Å; S512-K514 VanDerWaalsContact C-N 3.26Å; S512-K514 PolarHBondContact O-N 3.3Å
513	T	45.5	Very low	48	Very low	90 Å²	90	108.9 Å²	108.9	55%	0.552	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-10	179.2	52.9	0	0	0	0	114.6	M509 K510	M509-T513 WeakPolarHBondContact O-CB 3.31Å; M509-T513 WeakPolarHBondContact O-CG2 3.32Å; M509-T513 PolarHBondContact O-N 3.45Å; M509-T513 PolarHBondContact O-OG1 2.92Å; M509-T513 VanDerWaalsContact O-OG1 3.04Å; K510-T513 WeakPolarHBondContact CA-OG1 3.41Å; K510-T513 PolarHBondContact O-OG1 3.22Å
514	K	43.2	Very low	46.4	Very low	190 Å²	190	113 Å²	113	83%	0.826	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-8.7	177.9	-94.4	-175.4	173.9	-174.4	0	114.6	K511 S512	K511-K514 PolarHBondContact O-N 3.32Å; S512-K514 VanDerWaalsContact C-N 3.26Å; S512-K514 PolarHBondContact O-N 3.3Å
515	S	38.4	Very low	45	Very low	109 Å²	109	116.1 Å²	116.1	76%	0.762	59%	0.591	S	S	*	*	S	Bend	trans	-112.7	6.4	177.1	-77	0	0	0	0	114.4	N517	S515-N517 PolarHBondContact O-N 3.42Å
516	R	35.7	Very low	43.9	Very low	158 Å²	158	121.9 Å²	121.9	60%	0.596	62%	0.616	S	S	*	*			trans	-89.6	94.2	171	-77.1	-177.2	-179.2	152.7	0.9	109.3	I518	R516-I518 PolarHBondContact O-N 2.92Å; R516-I518 VanDerWaalsContact O-N 3.09Å
517	N	33	Very low	42.9	Very low	160 Å²	160	123.6 Å²	123.6	86%	0.856	63%	0.626	S	S	*	*			trans	-48.5	115.7	163.1	-81.4	-35.8	0	0	0	108.5	S515 S519	S515-N517 PolarHBondContact O-N 3.42Å; N517-S519 VanDerWaalsContact C-N 3.27Å; N517-S519 PolarHBondContact O-N 3.14Å
518	I	35.9	Very low	42.2	Very low	161 Å²	161	125.4 Å²	125.4	83%	0.826	64%	0.639	S	S	*	*			trans	-65.4	92.4	168	-64.5	163.9	0	0	0	105.6	R516 K520	R516-I518 PolarHBondContact O-N 2.92Å; R516-I518 VanDerWaalsContact O-N 3.09Å; I518-K520 PolarHBondContact O-N 3.19Å
519	S	33.3	Very low	41.8	Very low	79 Å²	79	129.8 Å²	129.8	55%	0.552	66%	0.657	S	S	*	*			trans	-62.6	131.3	157.1	47.3	0	0	0	0	106.7	N517 T521	N517-S519 VanDerWaalsContact C-N 3.27Å; N517-S519 PolarHBondContact O-N 3.14Å; S519-T521 PolarHBondContact O-N 3.08Å
520	K	42.9	Very low	41.8	Very low	212 Å²	212	130.4 Å²	130.4	92%	0.922	66%	0.661	S	S	*	*	S	Bend	trans	-66.5	27.8	-177	-76.2	176.9	171.3	176.8	0	114.3	I518	I518-K520 PolarHBondContact O-N 3.19Å
521	T	39	Very low	41.5	Very low	86 Å²	86	125.6 Å²	125.6	53%	0.528	65%	0.645	S	S	.	*	S	Bend	trans	-134.2	119.5	178.4	50.5	0	0	0	0	106.9	S519 E523	S519-T521 PolarHBondContact O-N 3.08Å; T521-E523 PolarHBondContact O-N 3.33Å
522	G	37.7	Very low	41.3	Very low	63 Å²	63	121.8 Å²	121.8	65%	0.649	64%	0.636	S	S	*	*			trans	-70.2	48.8	-166.4	0	0	0	0	0	116.2
523	E	36.4	Very low	41.2	Very low	122 Å²	122	124.5 Å²	124.5	57%	0.57	64%	0.642	S	S	*	*			trans	-104.9	121.4	-176.8	-68.6	-175.8	165.8	0	0	111.1	T521 I530	T521-E523 PolarHBondContact O-N 3.33Å; E523-I530 HydrophobicContact CB-CG2 4.05Å; E523-I530 HydrophobicContact CG-CG2 4.15Å
524	Y	37.4	Very low	41.2	Very low	156 Å²	156	125.2 Å²	125.2	61%	0.612	65%	0.65	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.2	131.2	176	-118.8	-96.1	0	0	0	109.7	V531	Y524-V531 PolarHBondContact O-N 2.83Å
525	I	39.8	Very low	41.5	Very low	106 Å²	106	122.1 Å²	122.1	54%	0.544	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.7	123.2	172.7	-56.8	174.5	0	0	0	109.1	K529 I530	I525-K529 WeakPolarHBondContact CA-O 3.14Å; I525-I530 HydrophobicContact CG1-CG1 4.34Å
526	F	42.7	Very low	41.9	Very low	124 Å²	124	122.7 Å²	122.7	54%	0.544	63%	0.626	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.4	126.2	171.6	-162.9	-87	0	0	0	108.2	N528 K529 V531	F526-N528 PolarHBondContact O-N 3.3Å; F526-K529 PolarHBondContact N-O 3.41Å; F526-K529 WeakPolarHBondContact O-CB 3.38Å; F526-K529 PolarHBondContact O-N 2.73Å; F526-V531 HydrophobicContact CB-CG2 4.45Å
527	D	42.8	Very low	42.2	Very low	136 Å²	136	122.9 Å²	122.9	73%	0.727	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	45.5	51.9	-174.1	-71.3	-21.6	0	0	0	114.2	K529	D527-K529 PolarHBondContact O-N 3.45Å
528	N	46.5	Very low	42.5	Very low	161 Å²	161	123.6 Å²	123.6	86%	0.861	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.9	20	-176.4	-69.4	-15.6	0	0	0	115.1	F526	F526-N528 PolarHBondContact O-N 3.3Å
529	K	45.8	Very low	42.6	Very low	152 Å²	152	122.7 Å²	122.7	66%	0.661	62%	0.62	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-114.5	130.2	174.6	-65.6	176.8	-177.4	176.2	0	110.7	I525 F526 D527 V531	I525-K529 WeakPolarHBondContact CA-O 3.14Å; F526-K529 PolarHBondContact N-O 3.41Å; F526-K529 WeakPolarHBondContact O-CB 3.38Å; F526-K529 PolarHBondContact O-N 2.73Å; D527-K529 PolarHBondContact O-N 3.45Å; K529-V531 PolarHBondContact O-N 3.37Å
530	I	52.1	Low	43	Very low	107 Å²	107	126 Å²	126	55%	0.549	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.3	117.7	172.8	-61.1	170.1	0	0	0	108	E523 I525	E523-I530 HydrophobicContact CB-CG2 4.05Å; E523-I530 HydrophobicContact CG-CG2 4.15Å; I525-I530 HydrophobicContact CG1-CG1 4.34Å
531	V	47.7	Very low	42.5	Very low	50 Å²	50	122 Å²	122	30%	0.303	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.2	120	179.7	-176.7	0	0	0	0	109.4	Y524 F526 K529 K535	Y524-V531 PolarHBondContact O-N 2.83Å; F526-V531 HydrophobicContact CB-CG2 4.45Å; K529-V531 PolarHBondContact O-N 3.37Å; V531-K535 HydrophobicContact CG1-CB 3.95Å; V531-K535 HydrophobicContact CG1-CD 4.13Å
532	P	45.1	Very low	42.7	Very low	75 Å²	75	123.8 Å²	123.8	49%	0.487	61%	0.614	S	S	.	*			trans	-63.6	146.2	175.8	-20.6	31.5	0	0	0	112.4	S534 K535	P532-S534 PolarHBondContact O-N 2.74Å; P532-K535 PolarHBondContact O-N 3.13Å; P532-K535 VanDerWaalsContact O-N 3.11Å
533	E	43.5	Very low	42.9	Very low	117 Å²	117	127 Å²	127	55%	0.547	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-57.9	-19.5	-176.3	-166.5	158	-158.2	0	0	114.2	K535 K536	E533-K535 PolarHBondContact O-N 3.33Å; E533-K535 VanDerWaalsContact O-N 3.14Å; E533-K536 HydrophobicContact CG-CD 4.08Å; E533-K536 WeakPolarHBondContact O-CB 3.22Å; E533-K536 PolarHBondContact O-N 3.34Å; E533-K536 IonicContact OE1-NZ 2.7Å; E533-K536 PolarHBondContact OE1-NZ 3.32Å
534	S	47.4	Very low	43.3	Very low	105 Å²	105	127.3 Å²	127.3	73%	0.734	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-66.2	-9.3	175.6	61.6	0	0	0	0	115	P532	P532-S534 PolarHBondContact O-N 2.74Å
535	K	49.3	Very low	43.7	Very low	125 Å²	125	125.6 Å²	125.6	54%	0.543	62%	0.615	S	S	.	*	G	3₁₀ helix	trans	-100.3	3.3	177.9	-66.5	-173.9	179	178.3	0	114.5	V531 P532 E533 L537 R538	V531-K535 HydrophobicContact CG1-CB 3.95Å; V531-K535 HydrophobicContact CG1-CD 4.13Å; P532-K535 PolarHBondContact O-N 3.13Å; P532-K535 VanDerWaalsContact O-N 3.11Å; E533-K535 PolarHBondContact O-N 3.33Å; E533-K535 VanDerWaalsContact O-N 3.14Å; K535-L537 PolarHBondContact O-N 2.72Å; K535-R538 PolarHBondContact O-N 3Å
536	K	45.4	Very low	43.9	Very low	121 Å²	121	126.8 Å²	126.8	53%	0.526	62%	0.62	S	S	.	*	T	Hydrogen-bonded Turn	trans	-52.3	-29.1	-177.8	-115	175	-179.3	167.6	0	115.2	E533	E533-K536 HydrophobicContact CG-CD 4.08Å; E533-K536 WeakPolarHBondContact O-CB 3.22Å; E533-K536 PolarHBondContact O-N 3.34Å; E533-K536 IonicContact OE1-NZ 2.7Å; E533-K536 PolarHBondContact OE1-NZ 3.32Å
537	L	42.2	Very low	44	Very low	163 Å²	163	127 Å²	127	85%	0.853	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.6	-7.8	-171.8	-77.1	162.6	0	0	0	115.1	K535	K535-L537 PolarHBondContact O-N 2.72Å
538	R	39.1	Very low	44.1	Very low	175 Å²	175	126.4 Å²	126.4	66%	0.66	62%	0.617	S	S	*	*	S	Bend	trans	-97	5	-178	-95.1	-171	-84.4	-130.9	-4.3	115.2	K535	K535-R538 PolarHBondContact O-N 3Å
539	H	38.4	Very low	43.9	Very low	142 Å²	142	123.7 Å²	123.7	66%	0.657	60%	0.599	S	S	*	*	S	Bend	trans	-126.4	10.1	-174.2	-123.6	54.1	0	0	0	114.1
540	I	42.2	Very low	43.7	Very low	147 Å²	147	121.3 Å²	121.3	75%	0.754	59%	0.593	S	S	*	*			trans	-116.6	5.4	-177.4	-57	179.9	0	0	0	112.1
541	Y	32.4	Very low	43	Very low	129 Å²	129	122.6 Å²	122.6	51%	0.506	60%	0.597	S	S	.	*			trans	-122	0	171.9	-126.4	-125.2	0	0	0	107.1	Q69	Q69-Y541 HydrophobicContact CB-CD1 3.21Å; Q69-Y541 HydrophobicContact CB-CE1 3.7Å; Q69-Y541 HydrophobicContact CB-CG 3.65Å; Q69-Y541 WeakPolarHBondContact CB-O 3.08Å; Q69-Y541 VanDerWaalsContact CD-CD1 3.41Å; Q69-Y541 VanDerWaalsContact CD-CE2 3.41Å; Q69-Y541 HydrophobicContact CG-CD1 3.27Å; Q69-Y541 HydrophobicContact CG-CD2 4.38Å; Q69-Y541 HydrophobicContact CG-CE1 3.15Å; Q69-Y541 HydrophobicContact CG-CE2 4.31Å; Q69-Y541 HydrophobicContact CG-CG 3.87Å; Q69-Y541 PolarHBondContact N-O 3.11Å; Q69-Y541 VanDerWaalsContact NE2-CE2 3.32Å; Q69-Y541 PolarHBondContact NE2-OH 3.43Å; Q69-Y541 VanDerWaalsContact NE2-OH 3.09Å; Q69-Y541 VanDerWaalsContact O-CD1 3.28Å; Q69-Y541 WeakPolarHBondContact O-CD1 3.32Å; Q69-Y541 VanDerWaalsContact OE1-CG 3.29Å

Retrieved 541 of 541 residues in 191.9 ms (Link to these results)

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