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26S proteasome non-ATPase regulatory subunit 8

Component of the 26S proteasome, a multiprotein complex involved in the ATP-dependent degradation of ubiquitinated proteins. This complex plays a key role in the maintenance of protein homeostasis by removing misfolded or damaged proteins, which could impair cellular functions, and by removing proteins whose functions are no longer required. Therefore, the proteasome participates in numerous cellular processes, including cell cycle progression, apoptosis, or DNA damage repair.

AlphaFold DB , UniProt , Accession A0A060YRV1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene psmd8, Length 267 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	39.5	Very low	50.4	Low	181 Å²	181	74.7 Å²	74.7	89%	0.892	43%	0.426	S	S	*	.				0	-50.5	0	-74.3	-151.6	-89.4	0	0	113.5	L5	M1-L5 PolarHBondContact O-N 2.79Å
2	A	37.8	Very low	51	Low	77 Å²	77	70.3 Å²	70.3	64%	0.636	40%	0.397	S	S	*	.	H	α-helix	trans	-73.8	-27.1	178.4	0	0	0	0	0	115.1	L5 K6	A2-L5 WeakPolarHBondContact O-CB 3.44Å; A2-K6 PolarHBondContact O-N 3.39Å
3	S	45.9	Very low	51.8	Low	75 Å²	75	75.1 Å²	75.1	52%	0.524	41%	0.414	S	S	.	.	H	α-helix	trans	-69.6	-47.9	175.6	49	0	0	0	0	112.3	L5 K6 E7	S3-L5 PolarHBondContact O-N 3.26Å; S3-K6 PolarHBondContact O-N 2.93Å; S3-K6 VanDerWaalsContact O-N 3.08Å; S3-E7 PolarHBondContact O-N 3.3Å
4	V	49.5	Very low	52.5	Low	28 Å²	28	74.4 Å²	74.4	17%	0.17	41%	0.413	C	S	.	.	H	α-helix	trans	-59.7	-33.6	174.9	-175.6	0	0	0	0	111.1	E7 T8 L43	V4-E7 PolarHBondContact O-N 3.27Å; V4-T8 HydrophobicContact CG1-CG2 4.33Å; V4-T8 WeakPolarHBondContact O-CB 3.28Å; V4-T8 VanDerWaalsContact O-CG2 3.28Å; V4-T8 WeakPolarHBondContact O-CG2 3.38Å; V4-T8 PolarHBondContact O-N 3.46Å; V4-T8 PolarHBondContact O-OG1 2.89Å; V4-L43 HydrophobicContact CG1-CD1 4.38Å; V4-L43 HydrophobicContact CG1-CG 4.49Å
5	L	48.5	Very low	52.9	Low	51 Å²	51	69.7 Å²	69.7	27%	0.267	39%	0.387	S	S	.	.	H	α-helix	trans	-67.1	-39.1	175.4	-122	160.4	0	0	0	112.9	M1 A2 S3 T8 A9 Q57	M1-L5 PolarHBondContact O-N 2.79Å; A2-L5 WeakPolarHBondContact O-CB 3.44Å; S3-L5 PolarHBondContact O-N 3.26Å; L5-T8 VanDerWaalsContact CA-OG1 3.28Å; L5-T8 WeakPolarHBondContact CA-OG1 3.3Å; L5-T8 PolarHBondContact O-OG1 2.93Å; L5-T8 VanDerWaalsContact O-OG1 3.05Å; L5-A9 VanDerWaalsContact O-CB 3.22Å; L5-A9 WeakPolarHBondContact O-CB 3.45Å; L5-A9 PolarHBondContact O-N 2.88Å; L5-Q57 HydrophobicContact CD1-CG 3.82Å; L5-Q57 HydrophobicContact CD2-CG 3.86Å; L5-Q57 HydrophobicContact CG-CG 3.95Å
6	K	53.3	Low	53.5	Low	175 Å²	175	71 Å²	71	76%	0.761	39%	0.388	S	S	*	.	H	α-helix	trans	-73.4	-35.7	174.2	-83.1	-174.1	173.4	-176.7	0	112.4	A2 S3 G10	A2-K6 PolarHBondContact O-N 3.39Å; S3-K6 PolarHBondContact O-N 2.93Å; S3-K6 VanDerWaalsContact O-N 3.08Å; K6-G10 PolarHBondContact O-N 3Å
7	E	54.7	Low	53.9	Low	121 Å²	121	71.6 Å²	71.6	57%	0.565	39%	0.394	S	S	*	.	H	α-helix	trans	-69.3	-41.7	175.2	-73.6	175.2	174.2	0	0	111.6	S3 V4 G10 L11	S3-E7 PolarHBondContact O-N 3.3Å; V4-E7 PolarHBondContact O-N 3.27Å; E7-G10 PolarHBondContact O-N 3.42Å; E7-L11 VanDerWaalsContact O-CB 3.29Å; E7-L11 WeakPolarHBondContact O-CB 3.42Å; E7-L11 WeakPolarHBondContact O-CG 2.97Å; E7-L11 PolarHBondContact O-N 2.91Å
8	T	54.1	Low	54.1	Low	3 Å²	3	70.1 Å²	70.1	2%	0.018	38%	0.384	C	S	.	.	H	α-helix	trans	-67.3	-37.8	173.8	47	0	0	0	0	112.4	V4 L5 Y12 L36	V4-T8 HydrophobicContact CG1-CG2 4.33Å; V4-T8 WeakPolarHBondContact O-CB 3.28Å; V4-T8 VanDerWaalsContact O-CG2 3.28Å; V4-T8 WeakPolarHBondContact O-CG2 3.38Å; V4-T8 PolarHBondContact O-N 3.46Å; V4-T8 PolarHBondContact O-OG1 2.89Å; L5-T8 VanDerWaalsContact CA-OG1 3.28Å; L5-T8 WeakPolarHBondContact CA-OG1 3.3Å; L5-T8 PolarHBondContact O-OG1 2.93Å; L5-T8 VanDerWaalsContact O-OG1 3.05Å; T8-Y12 WeakPolarHBondContact O-CB 3.23Å; T8-Y12 PolarHBondContact O-N 2.7Å; T8-L36 HydrophobicContact CG2-CD2 4.19Å
9	A	55.7	Low	54.2	Low	33 Å²	33	70.3 Å²	70.3	27%	0.273	38%	0.378	S	S	.	.	H	α-helix	trans	-66.9	-40.4	171.7	0	0	0	0	0	112.6	L5 Y12 E13 L60	L5-A9 VanDerWaalsContact O-CB 3.22Å; L5-A9 WeakPolarHBondContact O-CB 3.45Å; L5-A9 PolarHBondContact O-N 2.88Å; A9-Y12 WeakPolarHBondContact O-CB 3.29Å; A9-Y12 PolarHBondContact O-N 3.4Å; A9-E13 PolarHBondContact O-N 2.9Å; A9-L60 HydrophobicContact CB-CD1 4.2Å
10	G	56.9	Low	54.5	Low	33 Å²	33	73.5 Å²	73.5	34%	0.34	40%	0.395	S	S	.	.	H	α-helix	trans	-67.5	-36.6	174.8	0	0	0	0	0	113.1	K6 E7 T14	K6-G10 PolarHBondContact O-N 3Å; E7-G10 PolarHBondContact O-N 3.42Å; G10-T14 PolarHBondContact O-N 2.86Å; G10-T14 PolarHBondContact O-OG1 2.72Å
11	L	59.1	Low	54.4	Low	45 Å²	45	77.1 Å²	77.1	24%	0.236	41%	0.407	C	S	.	.	H	α-helix	trans	-67.6	-35.3	171.2	-75.1	167.3	0	0	0	111.8	E7 T14 L15 I32 L36	E7-L11 VanDerWaalsContact O-CB 3.29Å; E7-L11 WeakPolarHBondContact O-CB 3.42Å; E7-L11 WeakPolarHBondContact O-CG 2.97Å; E7-L11 PolarHBondContact O-N 2.91Å; L11-T14 WeakPolarHBondContact CA-OG1 3.5Å; L11-T14 PolarHBondContact O-OG1 3.26Å; L11-L15 WeakPolarHBondContact O-CB 3.22Å; L11-L15 PolarHBondContact O-N 2.97Å; L11-I32 HydrophobicContact CD2-CG2 4.34Å; L11-L36 HydrophobicContact CB-CD1 4.28Å; L11-L36 HydrophobicContact CB-CD2 4.26Å; L11-L36 HydrophobicContact CB-CG 4.18Å; L11-L36 HydrophobicContact CD1-CG 4.47Å
12	Y	57.5	Low	54.7	Low	22 Å²	22	78.5 Å²	78.5	9%	0.086	41%	0.408	C	S	.	.	H	α-helix	trans	-71.9	-37.6	175.5	175.3	-104.7	0	0	0	112.6	T8 A9 L15 K16 L60 D63 V64 I67	T8-Y12 WeakPolarHBondContact O-CB 3.23Å; T8-Y12 PolarHBondContact O-N 2.7Å; A9-Y12 WeakPolarHBondContact O-CB 3.29Å; A9-Y12 PolarHBondContact O-N 3.4Å; Y12-L15 PolarHBondContact O-N 2.96Å; Y12-K16 HydrophobicContact CD1-CD 4.31Å; Y12-K16 HydrophobicContact CE1-CD 3.77Å; Y12-K16 VanDerWaalsContact CE1-CE 3.43Å; Y12-K16 HydrophobicContact CE1-CG 4.46Å; Y12-K16 VanDerWaalsContact CE1-NZ 3.26Å; Y12-K16 VanDerWaalsContact CZ-NZ 3.34Å; Y12-K16 WeakPolarHBondContact O-CB 3.28Å; Y12-K16 PolarHBondContact O-N 3.34Å; Y12-K16 WeakPolarHBondContact OH-CE 3.49Å; Y12-K16 PolarHBondContact OH-NZ 3.08Å; Y12-L60 HydrophobicContact CD1-CD1 4.18Å; Y12-L60 HydrophobicContact CD1-CG 4.39Å; Y12-L60 HydrophobicContact CD2-CG 4.48Å; Y12-L60 HydrophobicContact CG-CD1 4.35Å; Y12-L60 HydrophobicContact CG-CG 4.23Å; Y12-D63 HydrophobicContact CE2-CB 3.57Å; Y12-D63 VanDerWaalsContact OH-CB 3.23Å; Y12-D63 WeakPolarHBondContact OH-CB 3.24Å; Y12-D63 PolarHBondContact OH-OD2 3.43Å; Y12-V64 HydrophobicContact CD2-CG2 3.55Å; Y12-V64 HydrophobicContact CE2-CG2 4.18Å; Y12-V64 HydrophobicContact CG-CG2 4.43Å; Y12-I67 HydrophobicContact CE2-CD1 4.19Å
13	E	61.3	Low	54.8	Low	132 Å²	132	81.6 Å²	81.6	62%	0.617	42%	0.415	S	S	*	.	H	α-helix	trans	-67.5	-39.1	172	-77.1	-177.5	170.5	0	0	112	A9 L15 K16 T17	A9-E13 PolarHBondContact O-N 2.9Å; E13-L15 VanDerWaalsContact C-N 3.34Å; E13-K16 PolarHBondContact O-N 2.81Å; E13-T17 WeakPolarHBondContact O-CB 3.41Å; E13-T17 VanDerWaalsContact O-CG2 3.3Å; E13-T17 WeakPolarHBondContact O-CG2 3.19Å; E13-T17 PolarHBondContact O-N 3.23Å; E13-T17 PolarHBondContact O-OG1 3.37Å
14	T	60.9	Low	55.1	Low	65 Å²	65	79.7 Å²	79.7	40%	0.399	40%	0.4	S	S	.	.	H	α-helix	trans	-65.6	-37.9	171.5	34.2	0	0	0	0	111.8	G10 L11 T17 E18	G10-T14 PolarHBondContact O-N 2.86Å; G10-T14 PolarHBondContact O-OG1 2.72Å; L11-T14 WeakPolarHBondContact CA-OG1 3.5Å; L11-T14 PolarHBondContact O-OG1 3.26Å; T14-T17 VanDerWaalsContact CA-OG1 3.28Å; T14-T17 WeakPolarHBondContact CA-OG1 3.36Å; T14-T17 PolarHBondContact O-N 3.27Å; T14-T17 PolarHBondContact O-OG1 2.78Å; T14-E18 WeakPolarHBondContact O-CB 3.19Å; T14-E18 WeakPolarHBondContact O-CG 3.19Å; T14-E18 PolarHBondContact O-N 2.84Å
15	L	58.7	Low	55.2	Low	4 Å²	4	83 Å²	83	2%	0.021	42%	0.417	C	S	.	.	H	α-helix	trans	-68.9	-37.7	175.2	-170	133.3	0	0	0	112.4	L11 Y12 E13 E18 W19 I32 L33 L36 I67	L11-L15 WeakPolarHBondContact O-CB 3.22Å; L11-L15 PolarHBondContact O-N 2.97Å; Y12-L15 PolarHBondContact O-N 2.96Å; E13-L15 VanDerWaalsContact C-N 3.34Å; L15-E18 PolarHBondContact O-N 2.87Å; L15-W19 VanDerWaalsContact O-CB 3.24Å; L15-W19 WeakPolarHBondContact O-CB 3.22Å; L15-W19 PolarHBondContact O-N 3.02Å; L15-I32 HydrophobicContact CB-CG2 4.45Å; L15-I32 HydrophobicContact CD1-CG2 3.79Å; L15-L33 HydrophobicContact CD1-CD2 4.13Å; L15-L33 HydrophobicContact CD1-CG 4.22Å; L15-L36 HydrophobicContact CD1-CD1 4.02Å; L15-I67 HydrophobicContact CD2-CB 3.8Å; L15-I67 HydrophobicContact CD2-CD1 3.53Å; L15-I67 HydrophobicContact CD2-CG1 4.26Å; L15-I67 HydrophobicContact CD2-CG2 3.44Å; L15-I67 VanDerWaalsContact CD2-CG2 3.44Å; L15-I67 HydrophobicContact CG-CG2 4.43Å
16	K	62.6	Low	55.7	Low	91 Å²	91	83.2 Å²	83.2	40%	0.396	42%	0.418	S	S	.	.	H	α-helix	trans	-65.5	-40.5	171.5	-87	-175.4	167.5	170.4	0	112.8	Y12 E13 W19 N20	Y12-K16 HydrophobicContact CD1-CD 4.31Å; Y12-K16 HydrophobicContact CE1-CD 3.77Å; Y12-K16 VanDerWaalsContact CE1-CE 3.43Å; Y12-K16 HydrophobicContact CE1-CG 4.46Å; Y12-K16 VanDerWaalsContact CE1-NZ 3.26Å; Y12-K16 VanDerWaalsContact CZ-NZ 3.34Å; Y12-K16 WeakPolarHBondContact O-CB 3.28Å; Y12-K16 PolarHBondContact O-N 3.34Å; Y12-K16 WeakPolarHBondContact OH-CE 3.49Å; Y12-K16 PolarHBondContact OH-NZ 3.08Å; E13-K16 PolarHBondContact O-N 2.81Å; K16-W19 PolarHBondContact O-N 3.05Å; K16-N20 WeakPolarHBondContact O-CB 3.29Å; K16-N20 PolarHBondContact O-N 2.67Å; K16-N20 PolarHBondContact O-ND2 2.86Å
17	T	60.4	Low	56.1	Low	82 Å²	82	80.9 Å²	80.9	50%	0.503	41%	0.414	S	S	.	.	H	α-helix	trans	-72.7	-29.7	177.9	51.2	0	0	0	0	112.3	E13 T14	E13-T17 WeakPolarHBondContact O-CB 3.41Å; E13-T17 VanDerWaalsContact O-CG2 3.3Å; E13-T17 WeakPolarHBondContact O-CG2 3.19Å; E13-T17 PolarHBondContact O-N 3.23Å; E13-T17 PolarHBondContact O-OG1 3.37Å; T14-T17 VanDerWaalsContact CA-OG1 3.28Å; T14-T17 WeakPolarHBondContact CA-OG1 3.36Å; T14-T17 PolarHBondContact O-N 3.27Å; T14-T17 PolarHBondContact O-OG1 2.78Å
18	E	57.9	Low	56.4	Low	43 Å²	43	80.6 Å²	80.6	20%	0.201	41%	0.411	C	S	.	.	H	α-helix	trans	-73.5	-36.5	169.1	-74.4	-165.1	157.5	0	0	112.5	T14 L15 K21 I32	T14-E18 WeakPolarHBondContact O-CB 3.19Å; T14-E18 WeakPolarHBondContact O-CG 3.19Å; T14-E18 PolarHBondContact O-N 2.84Å; L15-E18 PolarHBondContact O-N 2.87Å; E18-K21 PolarHBondContact O-N 2.81Å; E18-I32 WeakPolarHBondContact OE2-CD1 3.42Å
19	W	56.1	Low	56.6	Low	74 Å²	74	80.7 Å²	80.7	28%	0.28	41%	0.411	S	S	.	.	H	α-helix	trans	-69.7	-36.2	176.8	-166.4	-101.3	0	0	0	112.9	L15 K16 K21 I67 L70 W71 L74	L15-W19 VanDerWaalsContact O-CB 3.24Å; L15-W19 WeakPolarHBondContact O-CB 3.22Å; L15-W19 PolarHBondContact O-N 3.02Å; K16-W19 PolarHBondContact O-N 3.05Å; W19-K21 PolarHBondContact O-N 3.37Å; W19-I67 HydrophobicContact CD2-CG2 3.8Å; W19-I67 HydrophobicContact CE3-CG2 3.65Å; W19-I67 HydrophobicContact CG-CG2 4.26Å; W19-I67 HydrophobicContact CZ3-CG2 4.1Å; W19-L70 HydrophobicContact CH2-CB 3.47Å; W19-L70 VanDerWaalsContact CH2-CB 3.47Å; W19-L70 HydrophobicContact CZ2-CB 3.52Å; W19-L70 HydrophobicContact CZ2-CD1 3.89Å; W19-L70 HydrophobicContact CZ2-CG 4.33Å; W19-W71 HydrophobicContact CZ3-CB 4.05Å; W19-L74 HydrophobicContact CH2-CD1 3.66Å; W19-L74 HydrophobicContact CZ3-CD1 4Å
20	N	58.8	Low	56.9	Low	135 Å²	135	79.8 Å²	79.8	72%	0.722	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-10.9	174.6	-77.3	-30.2	0	0	0	113.3	K16	K16-N20 WeakPolarHBondContact O-CB 3.29Å; K16-N20 PolarHBondContact O-N 2.67Å; K16-N20 PolarHBondContact O-ND2 2.86Å
21	K	54.3	Low	57.5	Low	149 Å²	149	84.1 Å²	84.1	65%	0.648	42%	0.417	S	S	*	.	S	Bend	trans	-81.8	121.6	169.3	-76.3	177.1	179.7	175.3	0	108.7	E18 W19 N23	E18-K21 PolarHBondContact O-N 2.81Å; W19-K21 PolarHBondContact O-N 3.37Å; K21-N23 CarbonylContact O-C 3.52Å; K21-N23 PolarHBondContact O-N 2.85Å
22	K	45.3	Very low	57.8	Low	210 Å²	210	83.2 Å²	83.2	91%	0.913	41%	0.412	S	S	*	.	S	Bend	trans	-48.7	-11.1	-179.6	-107.2	178.5	174.4	-178.5	0	116.9
23	N	39.2	Very low	58.3	Low	143 Å²	143	82.4 Å²	82.4	77%	0.765	41%	0.409	S	S	*	.	S	Bend	trans	-131	94.9	171.6	-74	-51.7	0	0	0	109.2	K21 N25	K21-N23 CarbonylContact O-C 3.52Å; K21-N23 PolarHBondContact O-N 2.85Å; N23-N25 PolarHBondContact O-N 2.84Å
24	P	52.2	Low	58.6	Low	34 Å²	34	79.3 Å²	79.3	22%	0.221	40%	0.402	C	S	.	.			trans	-64.2	127.4	176.9	-20.3	32.2	0	0	0	110.4	L26 L74	P24-L26 VanDerWaalsContact C-N 3.31Å; P24-L26 PolarHBondContact O-N 3.46Å; P24-L74 HydrophobicContact CG-CD1 4.11Å
25	N	51.3	Low	58.9	Low	99 Å²	99	82.2 Å²	82.2	53%	0.529	41%	0.409	S	S	.	.			trans	-71.9	91.5	168.1	-82.8	-48	0	0	0	108.3	N23 N27 K28 C29	N23-N25 PolarHBondContact O-N 2.84Å; N25-N27 PolarHBondContact O-N 3.16Å; N25-K28 HydrophobicContact CB-CB 4Å; N25-K28 HydrophobicContact CB-CD 4.22Å; N25-K28 HydrophobicContact CB-CG 4.18Å; N25-K28 PolarHBondContact O-N 2.94Å; N25-C29 PolarHBondContact O-N 3.37Å; N25-C29 PolarHBondContact O-SG 3.31Å
26	L	58.9	Low	59.3	Low	54 Å²	54	82 Å²	82	28%	0.283	41%	0.408	S	S	.	.	H	α-helix	trans	-51.1	-38.2	-174.5	-95.5	92	0	0	0	112.9	P24 G30 W71 K75	P24-L26 VanDerWaalsContact C-N 3.31Å; P24-L26 PolarHBondContact O-N 3.46Å; L26-G30 PolarHBondContact O-N 2.71Å; L26-W71 VanDerWaalsContact CA-NE1 3.35Å; L26-W71 VanDerWaalsContact O-CE2 3.28Å; L26-W71 WeakPolarHBondContact O-CZ2 3.01Å; L26-W71 PolarHBondContact O-NE1 2.91Å; L26-K75 VanDerWaalsContact CD2-CA 3.41Å; L26-K75 HydrophobicContact CD2-CB 3.42Å; L26-K75 VanDerWaalsContact CD2-CB 3.42Å; L26-K75 HydrophobicContact CD2-CD 4.2Å; L26-K75 HydrophobicContact CD2-CG 3.62Å
27	N	61.3	Low	59.6	Low	127 Å²	127	81.3 Å²	81.3	68%	0.679	41%	0.405	S	S	*	.	H	α-helix	trans	-72.2	-37.1	-178.5	-68.1	-19.3	0	0	0	113.2	N25 G30 E31	N25-N27 PolarHBondContact O-N 3.16Å; N27-G30 PolarHBondContact O-N 3.06Å; N27-E31 PolarHBondContact O-N 3.39Å; N27-E31 VanDerWaalsContact O-N 3.08Å
28	K	61.3	Low	60.1	Low	115 Å²	115	82.2 Å²	82.2	50%	0.5	41%	0.406	S	S	.	.	H	α-helix	trans	-70.2	-41.6	176.5	-72.2	-173.1	175.2	-176.3	0	111.3	N25 G30 E31 I32	N25-K28 HydrophobicContact CB-CB 4Å; N25-K28 HydrophobicContact CB-CD 4.22Å; N25-K28 HydrophobicContact CB-CG 4.18Å; N25-K28 PolarHBondContact O-N 2.94Å; K28-G30 VanDerWaalsContact C-N 3.27Å; K28-G30 PolarHBondContact O-N 3.09Å; K28-E31 PolarHBondContact O-N 3.05Å; K28-I32 WeakPolarHBondContact O-CB 3.28Å; K28-I32 WeakPolarHBondContact O-CD1 3.34Å; K28-I32 VanDerWaalsContact O-CG1 3.24Å; K28-I32 WeakPolarHBondContact O-CG1 3.38Å; K28-I32 PolarHBondContact O-N 2.73Å
29	C	58.8	Low	60.2	Low	4 Å²	4	81.2 Å²	81.2	3%	0.027	40%	0.403	C	S	.	.	H	α-helix	trans	-63.2	-35.1	173.7	-56.7	0	0	0	0	111.4	N25 I32 L33 W71	N25-C29 PolarHBondContact O-N 3.37Å; N25-C29 PolarHBondContact O-SG 3.31Å; C29-I32 PolarHBondContact O-N 3.13Å; C29-L33 WeakPolarHBondContact O-CB 3.18Å; C29-L33 WeakPolarHBondContact O-CD1 3.2Å; C29-L33 WeakPolarHBondContact O-CG 3.04Å; C29-L33 PolarHBondContact O-N 3.11Å; C29-W71 HydrophobicContact CB-CG 4.4Å
30	G	61.8	Low	60.6	Low	14 Å²	14	78.2 Å²	78.2	14%	0.144	39%	0.393	C	S	.	.	H	α-helix	trans	-64.1	-41.5	173.7	0	0	0	0	0	113.9	L26 N27 K28 S34	L26-G30 PolarHBondContact O-N 2.71Å; N27-G30 PolarHBondContact O-N 3.06Å; K28-G30 VanDerWaalsContact C-N 3.27Å; K28-G30 PolarHBondContact O-N 3.09Å; G30-S34 WeakPolarHBondContact O-CB 3.47Å; G30-S34 PolarHBondContact O-N 3.19Å; G30-S34 PolarHBondContact O-OG 3.28Å
31	E	69.1	Low	60.8	Low	125 Å²	125	77.3 Å²	77.3	58%	0.584	39%	0.387	S	S	*	.	H	α-helix	trans	-68.8	-42.2	174.5	-73.8	-177	-177.6	0	0	112.2	N27 K28 S34 K35	N27-E31 PolarHBondContact O-N 3.39Å; N27-E31 VanDerWaalsContact O-N 3.08Å; K28-E31 PolarHBondContact O-N 3.05Å; E31-S34 PolarHBondContact O-N 3.44Å; E31-K35 WeakPolarHBondContact O-CG 3.23Å; E31-K35 PolarHBondContact O-N 3.13Å
32	I	67	Low	61.2	Low	26 Å²	26	76.8 Å²	76.8	13%	0.133	39%	0.387	C	S	.	.	H	α-helix	trans	-65.2	-42	177.4	-67.9	164.2	0	0	0	110.5	L11 L15 E18 K28 C29 S34 K35 L36	L11-I32 HydrophobicContact CD2-CG2 4.34Å; L15-I32 HydrophobicContact CB-CG2 4.45Å; L15-I32 HydrophobicContact CD1-CG2 3.79Å; E18-I32 WeakPolarHBondContact OE2-CD1 3.42Å; K28-I32 WeakPolarHBondContact O-CB 3.28Å; K28-I32 WeakPolarHBondContact O-CD1 3.34Å; K28-I32 VanDerWaalsContact O-CG1 3.24Å; K28-I32 WeakPolarHBondContact O-CG1 3.38Å; K28-I32 PolarHBondContact O-N 2.73Å; C29-I32 PolarHBondContact O-N 3.13Å; I32-S34 VanDerWaalsContact C-N 3.34Å; I32-S34 PolarHBondContact O-N 3.3Å; I32-K35 PolarHBondContact O-N 3.45Å; I32-L36 HydrophobicContact CG2-CD1 3.83Å; I32-L36 WeakPolarHBondContact O-CB 3.14Å; I32-L36 PolarHBondContact O-N 3.26Å
33	L	67.1	Low	61.8	Low	5 Å²	5	68.3 Å²	68.3	3%	0.026	35%	0.352	C	S	.	.	H	α-helix	trans	-64.4	-37	174.4	-77.3	168	0	0	0	112.2	L15 C29 L36 K37 V64 W71	L15-L33 HydrophobicContact CD1-CD2 4.13Å; L15-L33 HydrophobicContact CD1-CG 4.22Å; C29-L33 WeakPolarHBondContact O-CB 3.18Å; C29-L33 WeakPolarHBondContact O-CD1 3.2Å; C29-L33 WeakPolarHBondContact O-CG 3.04Å; C29-L33 PolarHBondContact O-N 3.11Å; L33-L36 PolarHBondContact O-N 3.48Å; L33-K37 WeakPolarHBondContact O-CB 3.19Å; L33-K37 VanDerWaalsContact O-CG 3.29Å; L33-K37 WeakPolarHBondContact O-CG 3.43Å; L33-K37 PolarHBondContact O-N 2.93Å; L33-V64 HydrophobicContact CD2-CG1 4.24Å; L33-W71 HydrophobicContact CD1-CB 4.38Å; L33-W71 HydrophobicContact CD1-CD2 3.94Å; L33-W71 HydrophobicContact CD1-CE3 3.83Å; L33-W71 HydrophobicContact CD1-CG 4.19Å; L33-W71 HydrophobicContact CD1-CZ3 4.41Å
34	S	68.6	Low	62.3	Low	67 Å²	67	66.8 Å²	66.8	47%	0.469	34%	0.343	S	S	.	.	H	α-helix	trans	-67.7	-42.1	176.7	-59	0	0	0	0	111.4	G30 E31 I32 K37 I38	G30-S34 WeakPolarHBondContact O-CB 3.47Å; G30-S34 PolarHBondContact O-N 3.19Å; G30-S34 PolarHBondContact O-OG 3.28Å; E31-S34 PolarHBondContact O-N 3.44Å; I32-S34 VanDerWaalsContact C-N 3.34Å; I32-S34 PolarHBondContact O-N 3.3Å; S34-K37 PolarHBondContact O-N 2.75Å; S34-I38 WeakPolarHBondContact O-CG1 3.2Å; S34-I38 PolarHBondContact O-N 2.67Å; S34-I38 VanDerWaalsContact O-N 3.14Å
35	K	67.3	Low	62.3	Low	125 Å²	125	68.7 Å²	68.7	54%	0.543	35%	0.349	S	S	.	.	H	α-helix	trans	-64.6	-43.5	173.3	-71.5	176	-178.4	175.9	0	111.8	E31 I32 K37 I38 S39	E31-K35 WeakPolarHBondContact O-CG 3.23Å; E31-K35 PolarHBondContact O-N 3.13Å; I32-K35 PolarHBondContact O-N 3.45Å; K35-K37 VanDerWaalsContact C-N 3.35Å; K35-K37 PolarHBondContact O-N 3.44Å; K35-I38 PolarHBondContact O-N 3.18Å; K35-S39 PolarHBondContact O-N 3.03Å; K35-S39 PolarHBondContact O-OG 3.45Å
36	L	67	Low	62.2	Low	1 Å²	1	70.1 Å²	70.1	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-61.2	-41	174.2	-91	157.8	0	0	0	112	T8 L11 L15 I32 L33 I38 S39 L40 V64	T8-L36 HydrophobicContact CG2-CD2 4.19Å; L11-L36 HydrophobicContact CB-CD1 4.28Å; L11-L36 HydrophobicContact CB-CD2 4.26Å; L11-L36 HydrophobicContact CB-CG 4.18Å; L11-L36 HydrophobicContact CD1-CG 4.47Å; L15-L36 HydrophobicContact CD1-CD1 4.02Å; I32-L36 HydrophobicContact CG2-CD1 3.83Å; I32-L36 WeakPolarHBondContact O-CB 3.14Å; I32-L36 PolarHBondContact O-N 3.26Å; L33-L36 PolarHBondContact O-N 3.48Å; L36-I38 VanDerWaalsContact C-N 3.31Å; L36-I38 PolarHBondContact O-N 3.05Å; L36-S39 PolarHBondContact O-N 3.47Å; L36-L40 VanDerWaalsContact O-CB 3.24Å; L36-L40 WeakPolarHBondContact O-CB 3.48Å; L36-L40 WeakPolarHBondContact O-CD1 3.49Å; L36-L40 WeakPolarHBondContact O-CG 3.38Å; L36-L40 PolarHBondContact O-N 3.13Å; L36-V64 HydrophobicContact CB-CG1 4.35Å; L36-V64 HydrophobicContact CD1-CG1 4.07Å; L36-V64 HydrophobicContact CD1-CG2 4.45Å; L36-V64 HydrophobicContact CD2-CG1 4.42Å; L36-V64 HydrophobicContact CD2-CG2 4.24Å
37	K	68.7	Low	61.6	Low	75 Å²	75	71 Å²	71	33%	0.326	36%	0.364	S	S	.	.	H	α-helix	trans	-59.8	-41.6	174.8	-82.1	178.3	177.4	-177.9	0	112	L33 S34 K35 L41 Y84	L33-K37 WeakPolarHBondContact O-CB 3.19Å; L33-K37 VanDerWaalsContact O-CG 3.29Å; L33-K37 WeakPolarHBondContact O-CG 3.43Å; L33-K37 PolarHBondContact O-N 2.93Å; S34-K37 PolarHBondContact O-N 2.75Å; K35-K37 VanDerWaalsContact C-N 3.35Å; K35-K37 PolarHBondContact O-N 3.44Å; K37-L41 WeakPolarHBondContact O-CB 3.31Å; K37-L41 PolarHBondContact O-N 3.34Å; K37-Y84 VanDerWaalsContact CE-CZ 3.47Å; K37-Y84 WeakPolarHBondContact CE-OH 3.4Å; K37-Y84 PolarHBondContact NZ-OH 3.36Å
38	I	70.6	Confident	60.6	Low	102 Å²	102	68.8 Å²	68.8	52%	0.523	36%	0.355	S	S	.	.	H	α-helix	trans	-66.1	-49.1	177.2	-64	163.7	0	0	0	110.1	S34 K35 L36 L40 L41 E42	S34-I38 WeakPolarHBondContact O-CG1 3.2Å; S34-I38 PolarHBondContact O-N 2.67Å; S34-I38 VanDerWaalsContact O-N 3.14Å; K35-I38 PolarHBondContact O-N 3.18Å; L36-I38 VanDerWaalsContact C-N 3.31Å; L36-I38 PolarHBondContact O-N 3.05Å; I38-L40 VanDerWaalsContact C-N 3.27Å; I38-L40 PolarHBondContact O-N 3.06Å; I38-L41 WeakPolarHBondContact O-CB 3.47Å; I38-L41 PolarHBondContact O-N 2.97Å; I38-L41 VanDerWaalsContact O-N 3.12Å; I38-E42 PolarHBondContact O-N 3.37Å; I38-E42 VanDerWaalsContact O-N 3.14Å
39	S	59.8	Low	59.8	Low	21 Å²	21	70.7 Å²	70.7	15%	0.147	38%	0.377	C	S	.	.	H	α-helix	trans	-64.2	-30.2	178.2	-61.8	0	0	0	0	113.5	K35 L36 L43	K35-S39 PolarHBondContact O-N 3.03Å; K35-S39 PolarHBondContact O-OG 3.45Å; L36-S39 PolarHBondContact O-N 3.47Å; S39-L43 WeakPolarHBondContact O-CG 3.47Å
40	L	63.3	Low	59.1	Low	11 Å²	11	73.5 Å²	73.5	6%	0.058	41%	0.406	C	S	.	.	H	α-helix	trans	-80.3	-28.7	174.9	-68.3	165.5	0	0	0	112.2	L36 I38 E42 L43 F45 A61 V64	L36-L40 VanDerWaalsContact O-CB 3.24Å; L36-L40 WeakPolarHBondContact O-CB 3.48Å; L36-L40 WeakPolarHBondContact O-CD1 3.49Å; L36-L40 WeakPolarHBondContact O-CG 3.38Å; L36-L40 PolarHBondContact O-N 3.13Å; I38-L40 VanDerWaalsContact C-N 3.27Å; I38-L40 PolarHBondContact O-N 3.06Å; L40-E42 VanDerWaalsContact C-N 3.31Å; L40-L43 HydrophobicContact CD2-CD1 4.23Å; L40-L43 WeakPolarHBondContact O-CB 3.42Å; L40-L43 PolarHBondContact O-N 3.43Å; L40-L43 VanDerWaalsContact O-N 3.1Å; L40-F45 HydrophobicContact CB-CE1 3.63Å; L40-F45 HydrophobicContact CB-CE2 3.52Å; L40-F45 HydrophobicContact CB-CZ 3.01Å; L40-F45 HydrophobicContact CD1-CE1 4.36Å; L40-F45 HydrophobicContact CD1-CZ 3.98Å; L40-F45 HydrophobicContact CG-CE1 4.44Å; L40-F45 HydrophobicContact CG-CZ 4.06Å; L40-F45 WeakPolarHBondContact O-CD2 3.35Å; L40-F45 WeakPolarHBondContact O-CE2 3.22Å; L40-A61 HydrophobicContact CD2-CB 4.01Å; L40-V64 HydrophobicContact CD1-CG1 4.22Å
41	L	65.1	Low	58.1	Low	116 Å²	116	77.4 Å²	77.4	61%	0.607	43%	0.428	S	S	*	.	H	α-helix	trans	-62.6	-40.1	171.5	-104.9	146	0	0	0	111.2	K37 I38 L43 N44 F45	K37-L41 WeakPolarHBondContact O-CB 3.31Å; K37-L41 PolarHBondContact O-N 3.34Å; I38-L41 WeakPolarHBondContact O-CB 3.47Å; I38-L41 PolarHBondContact O-N 2.97Å; I38-L41 VanDerWaalsContact O-N 3.12Å; L41-L43 PolarHBondContact O-N 2.91Å; L41-N44 PolarHBondContact O-N 3.06Å; L41-N44 VanDerWaalsContact O-N 3.14Å; L41-F45 VanDerWaalsContact CA-CD2 3.49Å; L41-F45 HydrophobicContact CB-CD2 4.29Å; L41-F45 HydrophobicContact CB-CE2 4.18Å; L41-F45 HydrophobicContact CG-CD2 3.92Å; L41-F45 HydrophobicContact CG-CE2 3.91Å
42	E	61.3	Low	57	Low	138 Å²	138	81.8 Å²	81.8	65%	0.645	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-21.1	174	-68.6	177.8	173.2	0	0	113.3	I38 L40 N44	I38-E42 PolarHBondContact O-N 3.37Å; I38-E42 VanDerWaalsContact O-N 3.14Å; L40-E42 VanDerWaalsContact C-N 3.31Å; E42-N44 VanDerWaalsContact C-N 3.26Å; E42-N44 PolarHBondContact O-N 2.83Å
43	L	57.5	Low	56.2	Low	32 Å²	32	84.2 Å²	84.2	17%	0.168	46%	0.457	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	4.6	176.6	-71	164.6	0	0	0	113.5	V4 S39 L40 L41	V4-L43 HydrophobicContact CG1-CD1 4.38Å; V4-L43 HydrophobicContact CG1-CG 4.49Å; S39-L43 WeakPolarHBondContact O-CG 3.47Å; L40-L43 HydrophobicContact CD2-CD1 4.23Å; L40-L43 WeakPolarHBondContact O-CB 3.42Å; L40-L43 PolarHBondContact O-N 3.43Å; L40-L43 VanDerWaalsContact O-N 3.1Å; L41-L43 PolarHBondContact O-N 2.91Å
44	N	51.1	Low	55.7	Low	111 Å²	111	87 Å²	87	59%	0.594	48%	0.475	S	S	*	.			trans	59.5	85.2	176.2	-136.2	19.9	0	0	0	112.9	L41 E42 L46	L41-N44 PolarHBondContact O-N 3.06Å; L41-N44 VanDerWaalsContact O-N 3.14Å; E42-N44 VanDerWaalsContact C-N 3.26Å; E42-N44 PolarHBondContact O-N 2.83Å; N44-L46 PolarHBondContact O-N 3.3Å
45	F	51.4	Low	55.3	Low	75 Å²	75	88.6 Å²	88.6	33%	0.329	47%	0.473	S	S	.	.			trans	-66.6	-5.8	-176.2	-82	-64	0	0	0	117.4	L40 L41 Y91	L40-F45 HydrophobicContact CB-CE1 3.63Å; L40-F45 HydrophobicContact CB-CE2 3.52Å; L40-F45 HydrophobicContact CB-CZ 3.01Å; L40-F45 HydrophobicContact CD1-CE1 4.36Å; L40-F45 HydrophobicContact CD1-CZ 3.98Å; L40-F45 HydrophobicContact CG-CE1 4.44Å; L40-F45 HydrophobicContact CG-CZ 4.06Å; L40-F45 WeakPolarHBondContact O-CD2 3.35Å; L40-F45 WeakPolarHBondContact O-CE2 3.22Å; L41-F45 VanDerWaalsContact CA-CD2 3.49Å; L41-F45 HydrophobicContact CB-CD2 4.29Å; L41-F45 HydrophobicContact CB-CE2 4.18Å; L41-F45 HydrophobicContact CG-CD2 3.92Å; L41-F45 HydrophobicContact CG-CE2 3.91Å; F45-Y91 VanDerWaalsContact CD1-OH 3.26Å; F45-Y91 WeakPolarHBondContact CD1-OH 3.48Å
46	L	49.3	Very low	55.1	Low	129 Å²	129	89.4 Å²	89.4	68%	0.675	48%	0.479	S	S	*	.	S	Bend	trans	-77	135.3	179.2	-70.9	163.4	0	0	0	108.3	N44 T48	N44-L46 PolarHBondContact O-N 3.3Å; L46-T48 PolarHBondContact O-N 3.49Å
47	P	47	Very low	55	Low	71 Å²	71	90.6 Å²	90.6	46%	0.461	48%	0.484	S	S	.	.			trans	-64.4	80.1	166.5	18.8	-16.3	0	0	0	107.9	T49	P47-T49 PolarHBondContact O-N 2.88Å; P47-T49 VanDerWaalsContact O-N 3.12Å
48	T	39.9	Very low	54.9	Low	81 Å²	81	88.2 Å²	88.2	50%	0.497	48%	0.475	S	S	.	.			trans	-73.1	101.8	165.1	-68.9	0	0	0	0	104.6	L46 G50	L46-T48 PolarHBondContact O-N 3.49Å; T48-G50 PolarHBondContact O-N 3.42Å
49	T	45.1	Very low	55	Low	156 Å²	156	85.9 Å²	85.9	96%	0.957	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	11.9	176.5	34.6	0	0	0	0	115.1	P47	P47-T49 PolarHBondContact O-N 2.88Å; P47-T49 VanDerWaalsContact O-N 3.12Å
50	G	42.5	Very low	55.6	Low	62 Å²	62	86.1 Å²	86.1	64%	0.639	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-13.7	-167.2	0	0	0	0	0	116.8	T48	T48-G50 PolarHBondContact O-N 3.42Å
51	T	42.5	Very low	56	Low	97 Å²	97	85.9 Å²	85.9	60%	0.595	46%	0.462	S	S	*	.	S	Bend	trans	-135.6	126.1	-178.2	26.3	0	0	0	0	110.4	L53	T51-L53 PolarHBondContact O-N 2.87Å
52	K	45.3	Very low	56.5	Low	216 Å²	216	81.2 Å²	81.2	94%	0.939	44%	0.437	S	S	*	.			trans	-58.1	76.8	167.3	-75.2	177.3	174.4	175.9	0	109.4
53	L	50.3	Low	57.2	Low	77 Å²	77	76 Å²	76	40%	0.403	41%	0.413	S	S	.	.			trans	-65.6	136.6	167.6	-119	114.2	0	0	0	107.1	T51 K55	T51-L53 PolarHBondContact O-N 2.87Å; L53-K55 PolarHBondContact O-N 2.88Å; L53-K55 VanDerWaalsContact O-N 3.13Å
54	T	57.1	Low	58.1	Low	63 Å²	63	74.7 Å²	74.7	39%	0.387	41%	0.406	S	S	.	.			trans	-48.6	118.1	-170.6	-38.8	0	0	0	0	110.1	Q56 Q57 L58	T54-Q56 HydrophobicContact CG2-CB 3.97Å; T54-Q56 HydrophobicContact CG2-CG 4.39Å; T54-Q56 PolarHBondContact O-N 3.46Å; T54-Q57 WeakPolarHBondContact O-CA 3.43Å; T54-Q57 WeakPolarHBondContact O-CB 3.29Å; T54-Q57 PolarHBondContact O-N 3.41Å; T54-Q57 PolarHBondContact OG1-OE1 2.81Å; T54-L58 PolarHBondContact O-N 2.8Å
55	K	60	Low	59.3	Low	101 Å²	101	69.6 Å²	69.6	44%	0.439	38%	0.379	S	S	.	.	H	α-helix	trans	-46.7	-32.2	176.8	-61.7	-171.6	178.3	-154.2	0	112.6	L53 L58 I59 E98	L53-K55 PolarHBondContact O-N 2.88Å; L53-K55 VanDerWaalsContact O-N 3.13Å; K55-L58 PolarHBondContact O-N 3.34Å; K55-I59 WeakPolarHBondContact O-CD1 3.47Å; K55-I59 WeakPolarHBondContact O-CG1 3.2Å; K55-I59 PolarHBondContact O-N 3.37Å; K55-E98 VanDerWaalsContact CE-CD 3.47Å; K55-E98 WeakPolarHBondContact CE-OE1 3.14Å; K55-E98 VanDerWaalsContact CE-OE2 3.23Å; K55-E98 WeakPolarHBondContact CE-OE2 3.24Å; K55-E98 IonicContact NZ-OE1 2.61Å; K55-E98 PolarHBondContact NZ-OE1 3.14Å; K55-E98 IonicContact NZ-OE2 3.53Å
56	Q	62.4	Low	60.5	Low	143 Å²	143	66.5 Å²	66.5	67%	0.668	37%	0.366	S	S	*	.	H	α-helix	trans	-66.6	-34.4	175.7	-63.2	176	-21.7	0	0	114.3	T54 L60	T54-Q56 HydrophobicContact CG2-CB 3.97Å; T54-Q56 HydrophobicContact CG2-CG 4.39Å; T54-Q56 PolarHBondContact O-N 3.46Å; Q56-L60 VanDerWaalsContact O-CB 3.29Å; Q56-L60 WeakPolarHBondContact O-CB 3.31Å; Q56-L60 PolarHBondContact O-N 2.88Å
57	Q	64.7	Low	61.8	Low	25 Å²	25	61.4 Å²	61.4	12%	0.117	34%	0.339	C	S	.	.	H	α-helix	trans	-69.3	-40.5	175.5	-71.8	169.7	-56.2	0	0	111.3	L5 T54 L60 A61	L5-Q57 HydrophobicContact CD1-CG 3.82Å; L5-Q57 HydrophobicContact CD2-CG 3.86Å; L5-Q57 HydrophobicContact CG-CG 3.95Å; T54-Q57 WeakPolarHBondContact O-CA 3.43Å; T54-Q57 WeakPolarHBondContact O-CB 3.29Å; T54-Q57 PolarHBondContact O-N 3.41Å; T54-Q57 PolarHBondContact OG1-OE1 2.81Å; Q57-L60 PolarHBondContact O-N 2.82Å; Q57-A61 VanDerWaalsContact O-CB 3.31Å; Q57-A61 WeakPolarHBondContact O-CB 3.5Å; Q57-A61 PolarHBondContact O-N 3.29Å
58	L	67.1	Low	63.2	Low	26 Å²	26	58 Å²	58	14%	0.136	32%	0.317	C	S	.	.	H	α-helix	trans	-67.2	-41.9	176.2	-72.4	167.3	0	0	0	111.7	T54 K55 A61 R62 Y91 Y95	T54-L58 PolarHBondContact O-N 2.8Å; K55-L58 PolarHBondContact O-N 3.34Å; L58-A61 PolarHBondContact O-N 2.92Å; L58-R62 WeakPolarHBondContact O-CB 3.33Å; L58-R62 PolarHBondContact O-N 3.04Å; L58-Y91 HydrophobicContact CD2-CD1 4.46Å; L58-Y91 HydrophobicContact CD2-CE1 4.03Å; L58-Y95 HydrophobicContact CD1-CD1 4.05Å; L58-Y95 HydrophobicContact CD1-CE1 3.37Å; L58-Y95 HydrophobicContact CD1-CE2 4.27Å; L58-Y95 VanDerWaalsContact CD1-CZ 3.49Å; L58-Y95 HydrophobicContact CD2-CE2 3.98Å
59	I	71.4	Confident	65	Low	52 Å²	52	54.1 Å²	54.1	27%	0.267	29%	0.293	S	S	.	.	H	α-helix	trans	-60.8	-46.3	173.3	-68.4	163.7	0	0	0	110.6	K55 A61 R62 D63 L99	K55-I59 WeakPolarHBondContact O-CD1 3.47Å; K55-I59 WeakPolarHBondContact O-CG1 3.2Å; K55-I59 PolarHBondContact O-N 3.37Å; I59-A61 PolarHBondContact O-N 3.48Å; I59-R62 WeakPolarHBondContact O-CB 3.48Å; I59-R62 PolarHBondContact O-N 3.02Å; I59-D63 PolarHBondContact O-N 3.25Å; I59-L99 HydrophobicContact CD1-CD2 3.77Å; I59-L99 HydrophobicContact CG1-CD2 3.3Å
60	L	72.3	Confident	66.5	Low	27 Å²	27	47.5 Å²	47.5	14%	0.141	25%	0.252	C	S	.	.	H	α-helix	trans	-65.7	-40.9	-179.8	-167.1	143	0	0	0	111.7	A9 Y12 Q56 Q57 D63 V64	A9-L60 HydrophobicContact CB-CD1 4.2Å; Y12-L60 HydrophobicContact CD1-CD1 4.18Å; Y12-L60 HydrophobicContact CD1-CG 4.39Å; Y12-L60 HydrophobicContact CD2-CG 4.48Å; Y12-L60 HydrophobicContact CG-CD1 4.35Å; Y12-L60 HydrophobicContact CG-CG 4.23Å; Q56-L60 VanDerWaalsContact O-CB 3.29Å; Q56-L60 WeakPolarHBondContact O-CB 3.31Å; Q56-L60 PolarHBondContact O-N 2.88Å; Q57-L60 PolarHBondContact O-N 2.82Å; L60-D63 PolarHBondContact O-N 3.38Å; L60-V64 HydrophobicContact CD2-CG2 4.12Å; L60-V64 WeakPolarHBondContact O-CB 3.48Å; L60-V64 WeakPolarHBondContact O-CG2 3.39Å; L60-V64 PolarHBondContact O-N 3.49Å
61	A	72.3	Confident	68.2	Low	5 Å²	5	45.3 Å²	45.3	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-62.5	-43.8	174.4	0	0	0	0	0	111.8	L40 Q57 L58 I59 V64 L65	L40-A61 HydrophobicContact CD2-CB 4.01Å; Q57-A61 VanDerWaalsContact O-CB 3.31Å; Q57-A61 WeakPolarHBondContact O-CB 3.5Å; Q57-A61 PolarHBondContact O-N 3.29Å; L58-A61 PolarHBondContact O-N 2.92Å; I59-A61 PolarHBondContact O-N 3.48Å; A61-V64 PolarHBondContact O-N 2.92Å; A61-L65 VanDerWaalsContact O-CG 3.28Å; A61-L65 WeakPolarHBondContact O-CG 3.42Å; A61-L65 PolarHBondContact O-N 3.45Å
62	R	75.7	Confident	69.8	Low	19 Å²	19	40.7 Å²	40.7	7%	0.072	20%	0.196	C	C	.	.	H	α-helix	trans	-57.9	-52.3	174.9	-177.3	-170.4	68.4	-176.6	1.8	110.9	L58 I59 V64 L65 E66 L88 Y92 P100	L58-R62 WeakPolarHBondContact O-CB 3.33Å; L58-R62 PolarHBondContact O-N 3.04Å; I59-R62 WeakPolarHBondContact O-CB 3.48Å; I59-R62 PolarHBondContact O-N 3.02Å; R62-V64 VanDerWaalsContact C-N 3.3Å; R62-V64 PolarHBondContact O-N 2.96Å; R62-L65 CarbonylContact O-C 3.59Å; R62-L65 WeakPolarHBondContact O-CB 3.32Å; R62-L65 PolarHBondContact O-N 3.07Å; R62-E66 HydrophobicContact CG-CG 4.42Å; R62-E66 IonicContact NE-OE1 3.56Å; R62-E66 WeakPolarHBondContact O-CG 3.42Å; R62-E66 PolarHBondContact O-N 3.48Å; R62-L88 HydrophobicContact CG-CD2 4.4Å; R62-Y92 HydrophobicContact CG-CE1 4.45Å; R62-P100 PolarHBondContact NH1-O 3.37Å
63	D	75.8	Confident	71.2	Confident	28 Å²	28	30.8 Å²	30.8	15%	0.15	15%	0.153	C	C	.	.	H	α-helix	trans	-63.8	-35.9	-177.8	-64.2	-1.5	0	0	0	111.9	Y12 I59 L60 E66 I67	Y12-D63 HydrophobicContact CE2-CB 3.57Å; Y12-D63 VanDerWaalsContact OH-CB 3.23Å; Y12-D63 WeakPolarHBondContact OH-CB 3.24Å; Y12-D63 PolarHBondContact OH-OD2 3.43Å; I59-D63 PolarHBondContact O-N 3.25Å; L60-D63 PolarHBondContact O-N 3.38Å; D63-E66 PolarHBondContact O-N 2.89Å; D63-I67 VanDerWaalsContact O-CG1 3.29Å; D63-I67 WeakPolarHBondContact O-CG1 3.24Å; D63-I67 PolarHBondContact O-N 3.5Å
64	V	76.6	Confident	72.3	Confident	4 Å²	4	31.1 Å²	31.1	2%	0.024	16%	0.155	C	C	.	.	H	α-helix	trans	-63	-42.3	172.7	169.4	0	0	0	0	111.2	Y12 L33 L36 L40 L60 A61 R62 G68	Y12-V64 HydrophobicContact CD2-CG2 3.55Å; Y12-V64 HydrophobicContact CE2-CG2 4.18Å; Y12-V64 HydrophobicContact CG-CG2 4.43Å; L33-V64 HydrophobicContact CD2-CG1 4.24Å; L36-V64 HydrophobicContact CB-CG1 4.35Å; L36-V64 HydrophobicContact CD1-CG1 4.07Å; L36-V64 HydrophobicContact CD1-CG2 4.45Å; L36-V64 HydrophobicContact CD2-CG1 4.42Å; L36-V64 HydrophobicContact CD2-CG2 4.24Å; L40-V64 HydrophobicContact CD1-CG1 4.22Å; L60-V64 HydrophobicContact CD2-CG2 4.12Å; L60-V64 WeakPolarHBondContact O-CB 3.48Å; L60-V64 WeakPolarHBondContact O-CG2 3.39Å; L60-V64 PolarHBondContact O-N 3.49Å; A61-V64 PolarHBondContact O-N 2.92Å; R62-V64 VanDerWaalsContact C-N 3.3Å; R62-V64 PolarHBondContact O-N 2.96Å; V64-G68 PolarHBondContact O-N 2.89Å
65	L	76.3	Confident	73.2	Confident	5 Å²	5	32.7 Å²	32.7	3%	0.026	16%	0.156	C	C	.	.	H	α-helix	trans	-69.5	-37.3	177.8	-69.2	170.7	0	0	0	112.1	A61 R62 G68 A69 Y84 Q87 L88 Y91	A61-L65 VanDerWaalsContact O-CG 3.28Å; A61-L65 WeakPolarHBondContact O-CG 3.42Å; A61-L65 PolarHBondContact O-N 3.45Å; R62-L65 CarbonylContact O-C 3.59Å; R62-L65 WeakPolarHBondContact O-CB 3.32Å; R62-L65 PolarHBondContact O-N 3.07Å; L65-G68 PolarHBondContact O-N 3.26Å; L65-A69 WeakPolarHBondContact O-CB 3.31Å; L65-A69 PolarHBondContact O-N 3.3Å; L65-Y84 HydrophobicContact CD2-CD1 3.85Å; L65-Y84 HydrophobicContact CD2-CE1 4.16Å; L65-Q87 HydrophobicContact CD1-CB 4.46Å; L65-L88 HydrophobicContact CB-CD2 3.55Å; L65-L88 HydrophobicContact CB-CG 3.92Å; L65-Y91 HydrophobicContact CD1-CD2 3.75Å; L65-Y91 HydrophobicContact CD1-CE2 3.3Å
66	E	77.6	Confident	73.8	Confident	9 Å²	9	34.4 Å²	34.4	4%	0.042	16%	0.164	C	C	.	.	H	α-helix	trans	-60	-48.3	174	-73.5	177.4	-174.1	0	0	110.8	R62 D63 G68 A69 L70 L88 Y92 L108	R62-E66 HydrophobicContact CG-CG 4.42Å; R62-E66 IonicContact NE-OE1 3.56Å; R62-E66 WeakPolarHBondContact O-CG 3.42Å; R62-E66 PolarHBondContact O-N 3.48Å; D63-E66 PolarHBondContact O-N 2.89Å; E66-G68 VanDerWaalsContact C-N 3.32Å; E66-G68 PolarHBondContact O-N 3.46Å; E66-A69 PolarHBondContact O-N 2.75Å; E66-L70 WeakPolarHBondContact O-CG 3.27Å; E66-L70 PolarHBondContact O-N 3.11Å; E66-L88 HydrophobicContact CG-CD2 3.97Å; E66-Y92 PolarHBondContact OE1-OH 3.25Å; E66-Y92 VanDerWaalsContact OE1-OH 3.13Å; E66-L108 HydrophobicContact CB-CD1 4.19Å; E66-L108 HydrophobicContact CB-CD2 4.31Å; E66-L108 HydrophobicContact CG-CD1 4.18Å; E66-L108 HydrophobicContact CG-CD2 4.28Å
67	I	76.9	Confident	74.5	Confident	22 Å²	22	29.9 Å²	29.9	11%	0.113	14%	0.144	C	C	.	.	H	α-helix	trans	-67.6	-36.3	176.9	-58.9	165.1	0	0	0	110.8	Y12 L15 W19 D63 A69 L70 W71	Y12-I67 HydrophobicContact CE2-CD1 4.19Å; L15-I67 HydrophobicContact CD2-CB 3.8Å; L15-I67 HydrophobicContact CD2-CD1 3.53Å; L15-I67 HydrophobicContact CD2-CG1 4.26Å; L15-I67 HydrophobicContact CD2-CG2 3.44Å; L15-I67 VanDerWaalsContact CD2-CG2 3.44Å; L15-I67 HydrophobicContact CG-CG2 4.43Å; W19-I67 HydrophobicContact CD2-CG2 3.8Å; W19-I67 HydrophobicContact CE3-CG2 3.65Å; W19-I67 HydrophobicContact CG-CG2 4.26Å; W19-I67 HydrophobicContact CZ3-CG2 4.1Å; D63-I67 VanDerWaalsContact O-CG1 3.29Å; D63-I67 WeakPolarHBondContact O-CG1 3.24Å; D63-I67 PolarHBondContact O-N 3.5Å; I67-A69 VanDerWaalsContact C-N 3.33Å; I67-A69 PolarHBondContact O-N 3.23Å; I67-L70 PolarHBondContact O-N 3.09Å; I67-W71 WeakPolarHBondContact O-CB 3.37Å; I67-W71 PolarHBondContact O-N 2.83Å
68	G	75.2	Confident	75.1	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.7	-39.3	173.9	0	0	0	0	0	113.3	V64 L65 E66 A72	V64-G68 PolarHBondContact O-N 2.89Å; L65-G68 PolarHBondContact O-N 3.26Å; E66-G68 VanDerWaalsContact C-N 3.32Å; E66-G68 PolarHBondContact O-N 3.46Å; G68-A72 WeakPolarHBondContact O-CB 3.38Å; G68-A72 PolarHBondContact O-N 3.45Å
69	A	77.6	Confident	75.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-68.5	-44.2	175.2	0	0	0	0	0	111.7	L65 E66 I67 W71 A72 I73 F81 L88 L108	L65-A69 WeakPolarHBondContact O-CB 3.31Å; L65-A69 PolarHBondContact O-N 3.3Å; E66-A69 PolarHBondContact O-N 2.75Å; I67-A69 VanDerWaalsContact C-N 3.33Å; I67-A69 PolarHBondContact O-N 3.23Å; A69-W71 VanDerWaalsContact C-N 3.32Å; A69-W71 PolarHBondContact O-N 3.47Å; A69-A72 WeakPolarHBondContact O-CB 3.49Å; A69-A72 PolarHBondContact O-N 3.22Å; A69-A72 VanDerWaalsContact O-N 3.17Å; A69-I73 WeakPolarHBondContact O-CG1 3.4Å; A69-I73 PolarHBondContact O-N 3.5Å; A69-F81 HydrophobicContact CB-CD2 4.25Å; A69-F81 HydrophobicContact CB-CE2 4.17Å; A69-L88 HydrophobicContact CB-CD1 4Å; A69-L108 HydrophobicContact CB-CD2 3.79Å
70	L	76.7	Confident	76	Confident	17 Å²	17	33.6 Å²	33.6	9%	0.089	17%	0.172	C	C	.	.	H	α-helix	trans	-62.3	-39.3	175.2	-68	172.2	0	0	0	112.1	W19 E66 I67 I73 L74 L111	W19-L70 HydrophobicContact CH2-CB 3.47Å; W19-L70 VanDerWaalsContact CH2-CB 3.47Å; W19-L70 HydrophobicContact CZ2-CB 3.52Å; W19-L70 HydrophobicContact CZ2-CD1 3.89Å; W19-L70 HydrophobicContact CZ2-CG 4.33Å; E66-L70 WeakPolarHBondContact O-CG 3.27Å; E66-L70 PolarHBondContact O-N 3.11Å; I67-L70 PolarHBondContact O-N 3.09Å; L70-I73 HydrophobicContact CD2-CD1 4.34Å; L70-I73 WeakPolarHBondContact O-CB 3.48Å; L70-I73 PolarHBondContact O-N 2.94Å; L70-L74 PolarHBondContact O-N 3.3Å; L70-L74 VanDerWaalsContact O-N 3.12Å; L70-L111 HydrophobicContact CD2-CD1 3.91Å
71	W	78.2	Confident	76.4	Confident	15 Å²	15	32.4 Å²	32.4	6%	0.057	17%	0.165	C	C	.	.	H	α-helix	trans	-63.4	-41.3	173	174.7	86.8	0	0	0	112.2	W19 L26 C29 L33 I67 A69 I73 L74 K75	W19-W71 HydrophobicContact CZ3-CB 4.05Å; L26-W71 VanDerWaalsContact CA-NE1 3.35Å; L26-W71 VanDerWaalsContact O-CE2 3.28Å; L26-W71 WeakPolarHBondContact O-CZ2 3.01Å; L26-W71 PolarHBondContact O-NE1 2.91Å; C29-W71 HydrophobicContact CB-CG 4.4Å; L33-W71 HydrophobicContact CD1-CB 4.38Å; L33-W71 HydrophobicContact CD1-CD2 3.94Å; L33-W71 HydrophobicContact CD1-CE3 3.83Å; L33-W71 HydrophobicContact CD1-CG 4.19Å; L33-W71 HydrophobicContact CD1-CZ3 4.41Å; I67-W71 WeakPolarHBondContact O-CB 3.37Å; I67-W71 PolarHBondContact O-N 2.83Å; A69-W71 VanDerWaalsContact C-N 3.32Å; A69-W71 PolarHBondContact O-N 3.47Å; W71-I73 VanDerWaalsContact C-N 3.25Å; W71-I73 PolarHBondContact O-N 3.47Å; W71-L74 PolarHBondContact O-N 3.3Å; W71-L74 VanDerWaalsContact O-N 3.17Å; W71-K75 HydrophobicContact CH2-CD 3.39Å; W71-K75 HydrophobicContact CZ2-CD 3.54Å; W71-K75 HydrophobicContact CZ3-CD 4.03Å; W71-K75 PolarHBondContact O-N 2.94Å
72	A	76.7	Confident	76.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.5	-35.7	176.9	0	0	0	0	0	111.9	G68 A69 K75 K76 D77 F81 Y84	G68-A72 WeakPolarHBondContact O-CB 3.38Å; G68-A72 PolarHBondContact O-N 3.45Å; A69-A72 WeakPolarHBondContact O-CB 3.49Å; A69-A72 PolarHBondContact O-N 3.22Å; A69-A72 VanDerWaalsContact O-N 3.17Å; A72-K75 PolarHBondContact O-N 2.92Å; A72-K76 PolarHBondContact O-N 3.38Å; A72-D77 PolarHBondContact O-N 3.38Å; A72-F81 HydrophobicContact CB-CB 4.16Å; A72-Y84 HydrophobicContact CB-CD2 4.18Å; A72-Y84 HydrophobicContact CB-CE2 4.38Å
73	I	75.1	Confident	77.2	Confident	8 Å²	8	44 Å²	44	4%	0.041	21%	0.212	C	C	.	.	H	α-helix	trans	-64.5	-46.7	173.4	-64	161.7	0	0	0	110.9	A69 L70 W71 K75 K76 F81 L111 F176	A69-I73 WeakPolarHBondContact O-CG1 3.4Å; A69-I73 PolarHBondContact O-N 3.5Å; L70-I73 HydrophobicContact CD2-CD1 4.34Å; L70-I73 WeakPolarHBondContact O-CB 3.48Å; L70-I73 PolarHBondContact O-N 2.94Å; W71-I73 VanDerWaalsContact C-N 3.25Å; W71-I73 PolarHBondContact O-N 3.47Å; I73-K75 VanDerWaalsContact C-N 3.26Å; I73-K75 PolarHBondContact O-N 2.92Å; I73-K76 PolarHBondContact O-N 3.32Å; I73-F81 HydrophobicContact CD1-CD2 3.91Å; I73-F81 HydrophobicContact CD1-CE2 3.46Å; I73-F81 VanDerWaalsContact CD1-CE2 3.46Å; I73-F81 HydrophobicContact CD1-CZ 4.19Å; I73-F81 HydrophobicContact CG1-CD2 3.56Å; I73-F81 HydrophobicContact CG1-CE2 3.66Å; I73-F81 HydrophobicContact CG1-CG 4.32Å; I73-F81 HydrophobicContact CG1-CZ 4.47Å; I73-L111 HydrophobicContact CD1-CD1 3.7Å; I73-L111 HydrophobicContact CD1-CD2 3.71Å; I73-L111 HydrophobicContact CD1-CG 4.17Å; I73-F176 HydrophobicContact CB-CE2 4.46Å; I73-F176 HydrophobicContact CD1-CE2 4.16Å; I73-F176 HydrophobicContact CG1-CE2 3.85Å; I73-F176 HydrophobicContact CG1-CZ 4.09Å; I73-F176 HydrophobicContact CG2-CE2 3.81Å; I73-F176 HydrophobicContact CG2-CZ 4.4Å
74	L	73.3	Confident	77.5	Confident	85 Å²	85	43.2 Å²	43.2	45%	0.445	21%	0.207	S	C	.	.	H	α-helix	trans	-62.3	-34.8	176.6	-69.3	175.6	0	0	0	112.3	W19 P24 L70 W71 K76	W19-L74 HydrophobicContact CH2-CD1 3.66Å; W19-L74 HydrophobicContact CZ3-CD1 4Å; P24-L74 HydrophobicContact CG-CD1 4.11Å; L70-L74 PolarHBondContact O-N 3.3Å; L70-L74 VanDerWaalsContact O-N 3.12Å; W71-L74 PolarHBondContact O-N 3.3Å; W71-L74 VanDerWaalsContact O-N 3.17Å; L74-K76 PolarHBondContact O-N 3.15Å
75	K	74.7	Confident	77.6	Confident	96 Å²	96	43.2 Å²	43.2	42%	0.417	21%	0.207	S	C	.	.	H	α-helix	trans	-74.9	-11.6	174.8	-162.4	168	176.1	-173.4	0	113.4	L26 W71 A72 I73 D77	L26-K75 VanDerWaalsContact CD2-CA 3.41Å; L26-K75 HydrophobicContact CD2-CB 3.42Å; L26-K75 VanDerWaalsContact CD2-CB 3.42Å; L26-K75 HydrophobicContact CD2-CD 4.2Å; L26-K75 HydrophobicContact CD2-CG 3.62Å; W71-K75 HydrophobicContact CH2-CD 3.39Å; W71-K75 HydrophobicContact CZ2-CD 3.54Å; W71-K75 HydrophobicContact CZ3-CD 4.03Å; W71-K75 PolarHBondContact O-N 2.94Å; A72-K75 PolarHBondContact O-N 2.92Å; I73-K75 VanDerWaalsContact C-N 3.26Å; I73-K75 PolarHBondContact O-N 2.92Å; K75-D77 PolarHBondContact O-N 2.88Å
76	K	72.8	Confident	77.7	Confident	137 Å²	137	45.5 Å²	45.5	60%	0.596	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.8	33.1	-174.8	-52.6	-179.2	171.9	-172	0	112.9	A72 I73 L74 I78 F175	A72-K76 PolarHBondContact O-N 3.38Å; I73-K76 PolarHBondContact O-N 3.32Å; L74-K76 PolarHBondContact O-N 3.15Å; K76-I78 PolarHBondContact O-N 3.26Å; K76-F175 HydrophobicContact CB-CE1 4.16Å; K76-F175 HydrophobicContact CB-CE2 4.18Å; K76-F175 HydrophobicContact CB-CZ 3.61Å; K76-F175 HydrophobicContact CD-CD2 4.11Å; K76-F175 HydrophobicContact CD-CE2 3.35Å; K76-F175 HydrophobicContact CD-CZ 3.71Å; K76-F175 HydrophobicContact CG-CD2 4.18Å; K76-F175 HydrophobicContact CG-CE1 4.07Å; K76-F175 HydrophobicContact CG-CE2 3.55Å; K76-F175 HydrophobicContact CG-CZ 3.47Å; K76-F175 VanDerWaalsContact CG-CZ 3.47Å
77	D	77.9	Confident	77.7	Confident	47 Å²	47	49 Å²	49	25%	0.251	24%	0.243	S	C	.	.			trans	-97.5	92.8	-179.9	-172.4	-5.7	0	0	0	110.5	A72 K75 P79 S80 F81	A72-D77 PolarHBondContact O-N 3.38Å; K75-D77 PolarHBondContact O-N 2.88Å; D77-P79 VanDerWaalsContact OD1-CD 3.31Å; D77-P79 WeakPolarHBondContact OD1-CD 3.32Å; D77-S80 PolarHBondContact O-N 2.9Å; D77-S80 PolarHBondContact OD1-N 3.33Å; D77-S80 WeakPolarHBondContact OD2-CB 3.38Å; D77-S80 PolarHBondContact OD2-OG 3.39Å; D77-F81 WeakPolarHBondContact O-CB 2.92Å; D77-F81 PolarHBondContact O-N 3.2Å
78	I	76.3	Confident	77.8	Confident	70 Å²	70	47.9 Å²	47.9	36%	0.359	24%	0.237	S	C	.	.	H	α-helix	trans	-59	-51.6	-176.9	-71.6	162.6	0	0	0	112.1	K76 S80 F81 E82 F115	K76-I78 PolarHBondContact O-N 3.26Å; I78-S80 PolarHBondContact O-N 2.72Å; I78-F81 PolarHBondContact O-N 3.21Å; I78-E82 PolarHBondContact O-N 3.29Å; I78-E82 VanDerWaalsContact O-N 3.09Å; I78-F115 HydrophobicContact CB-CE2 4.39Å; I78-F115 HydrophobicContact CG1-CE2 4.43Å; I78-F115 HydrophobicContact CG2-CE2 3.59Å; I78-F115 HydrophobicContact CG2-CZ 3.82Å
79	P	80.4	Confident	77.7	Confident	80 Å²	80	49.8 Å²	49.8	52%	0.519	25%	0.245	S	C	.	.	H	α-helix	trans	-62.1	-39.8	178.3	-24.4	32.3	0	0	0	113.8	D77 F81 E82 R83	D77-P79 VanDerWaalsContact OD1-CD 3.31Å; D77-P79 WeakPolarHBondContact OD1-CD 3.32Å; P79-F81 VanDerWaalsContact C-N 3.34Å; P79-E82 PolarHBondContact O-N 3.48Å; P79-R83 WeakPolarHBondContact O-CG 3.18Å; P79-R83 PolarHBondContact O-N 3.06Å
80	S	77.9	Confident	77.4	Confident	32 Å²	32	53 Å²	53	22%	0.224	27%	0.267	C	S	.	.	H	α-helix	trans	-66.3	-39.4	177.9	-71.5	0	0	0	0	111.6	D77 I78 R83 Y84	D77-S80 PolarHBondContact O-N 2.9Å; D77-S80 PolarHBondContact OD1-N 3.33Å; D77-S80 WeakPolarHBondContact OD2-CB 3.38Å; D77-S80 PolarHBondContact OD2-OG 3.39Å; I78-S80 PolarHBondContact O-N 2.72Å; S80-R83 PolarHBondContact O-N 3.26Å; S80-Y84 WeakPolarHBondContact O-CD2 3.23Å; S80-Y84 PolarHBondContact O-N 2.98Å; S80-Y84 VanDerWaalsContact O-N 3.08Å
81	F	80.9	Confident	77.1	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.009	27%	0.268	C	S	.	.	H	α-helix	trans	-60.6	-46.3	175.7	177.1	-104	0	0	0	111.9	A69 A72 I73 D77 I78 P79 R83 Y84 M85 L111 F115 F176	A69-F81 HydrophobicContact CB-CD2 4.25Å; A69-F81 HydrophobicContact CB-CE2 4.17Å; A72-F81 HydrophobicContact CB-CB 4.16Å; I73-F81 HydrophobicContact CD1-CD2 3.91Å; I73-F81 HydrophobicContact CD1-CE2 3.46Å; I73-F81 VanDerWaalsContact CD1-CE2 3.46Å; I73-F81 HydrophobicContact CD1-CZ 4.19Å; I73-F81 HydrophobicContact CG1-CD2 3.56Å; I73-F81 HydrophobicContact CG1-CE2 3.66Å; I73-F81 HydrophobicContact CG1-CG 4.32Å; I73-F81 HydrophobicContact CG1-CZ 4.47Å; D77-F81 WeakPolarHBondContact O-CB 2.92Å; D77-F81 PolarHBondContact O-N 3.2Å; I78-F81 PolarHBondContact O-N 3.21Å; P79-F81 VanDerWaalsContact C-N 3.34Å; F81-R83 VanDerWaalsContact C-N 3.31Å; F81-R83 PolarHBondContact O-N 2.99Å; F81-Y84 PolarHBondContact O-N 3.24Å; F81-M85 WeakPolarHBondContact O-CB 3.38Å; F81-M85 PolarHBondContact O-N 3.44Å; F81-L111 HydrophobicContact CZ-CB 4.4Å; F81-F115 HydrophobicContact CD1-CD1 4.33Å; F81-F115 HydrophobicContact CD1-CD2 4.08Å; F81-F115 HydrophobicContact CD1-CE1 4.49Å; F81-F115 HydrophobicContact CD1-CE2 4.24Å; F81-F115 HydrophobicContact CD1-CG 4.08Å; F81-F115 HydrophobicContact CD1-CZ 4.39Å; F81-F115 HydrophobicContact CE1-CB 3.9Å; F81-F115 HydrophobicContact CE1-CD1 4.16Å; F81-F115 HydrophobicContact CE1-CD2 4.24Å; F81-F115 AromaticContact CE1-CG 3.85Å; F81-F115 HydrophobicContact CE1-CG 3.85Å; F81-F176 HydrophobicContact CD1-CZ 4.48Å; F81-F176 HydrophobicContact CE1-CZ 4.48Å
82	E	81.9	Confident	76.6	Confident	87 Å²	87	53.8 Å²	53.8	41%	0.407	27%	0.269	S	S	.	.	H	α-helix	trans	-57.6	-43.2	177.2	-174.4	178.9	-177.1	0	0	111.8	I78 P79 M85 A86 F115	I78-E82 PolarHBondContact O-N 3.29Å; I78-E82 VanDerWaalsContact O-N 3.09Å; P79-E82 PolarHBondContact O-N 3.48Å; E82-M85 PolarHBondContact O-N 3.12Å; E82-A86 WeakPolarHBondContact O-CB 3.14Å; E82-A86 PolarHBondContact O-N 2.98Å; E82-F115 HydrophobicContact CB-CE1 4.34Å; E82-F115 HydrophobicContact CB-CZ 4.29Å; E82-F115 HydrophobicContact CG-CE1 4.49Å
83	R	83.1	Confident	76	Confident	180 Å²	180	57 Å²	57	68%	0.679	28%	0.284	S	S	*	.	H	α-helix	trans	-63.5	-44.8	177.3	-68.4	177.6	79.7	-176.7	7.8	112.5	P79 S80 F81 M85 A86 Q87	P79-R83 WeakPolarHBondContact O-CG 3.18Å; P79-R83 PolarHBondContact O-N 3.06Å; S80-R83 PolarHBondContact O-N 3.26Å; F81-R83 VanDerWaalsContact C-N 3.31Å; F81-R83 PolarHBondContact O-N 2.99Å; R83-M85 VanDerWaalsContact C-N 3.31Å; R83-A86 PolarHBondContact O-N 3.27Å; R83-Q87 WeakPolarHBondContact O-CG 3.32Å; R83-Q87 PolarHBondContact O-N 3.14Å
84	Y	80.6	Confident	75.5	Confident	11 Å²	11	61.4 Å²	61.4	4%	0.043	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-38.6	176.4	-75.1	-64.3	0	0	0	111.5	K37 L65 A72 S80 F81 Q87 L88	K37-Y84 VanDerWaalsContact CE-CZ 3.47Å; K37-Y84 WeakPolarHBondContact CE-OH 3.4Å; K37-Y84 PolarHBondContact NZ-OH 3.36Å; L65-Y84 HydrophobicContact CD2-CD1 3.85Å; L65-Y84 HydrophobicContact CD2-CE1 4.16Å; A72-Y84 HydrophobicContact CB-CD2 4.18Å; A72-Y84 HydrophobicContact CB-CE2 4.38Å; S80-Y84 WeakPolarHBondContact O-CD2 3.23Å; S80-Y84 PolarHBondContact O-N 2.98Å; S80-Y84 VanDerWaalsContact O-N 3.08Å; F81-Y84 PolarHBondContact O-N 3.24Å; Y84-Q87 PolarHBondContact O-N 3.32Å; Y84-L88 WeakPolarHBondContact O-CB 3.48Å; Y84-L88 WeakPolarHBondContact O-CG 3.34Å; Y84-L88 PolarHBondContact O-N 3.07Å
85	M	79.7	Confident	74.7	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.02	30%	0.295	C	S	.	.	H	α-helix	trans	-67	-41.5	178	-168.2	64.8	-164.3	0	0	111.9	F81 E82 R83 Q87 L88 K89 L109 N112	F81-M85 WeakPolarHBondContact O-CB 3.38Å; F81-M85 PolarHBondContact O-N 3.44Å; E82-M85 PolarHBondContact O-N 3.12Å; R83-M85 VanDerWaalsContact C-N 3.31Å; M85-Q87 VanDerWaalsContact C-N 3.28Å; M85-Q87 PolarHBondContact O-N 3.17Å; M85-L88 PolarHBondContact O-N 2.86Å; M85-K89 HydrophobicContact CE-CG 4.11Å; M85-K89 WeakPolarHBondContact O-CB 3.08Å; M85-K89 VanDerWaalsContact O-CG 3.29Å; M85-K89 WeakPolarHBondContact O-CG 3.28Å; M85-K89 PolarHBondContact O-N 3.48Å; M85-L109 HydrophobicContact CE-CD2 4.18Å; M85-N112 HydrophobicContact CE-CB 3.42Å; M85-N112 VanDerWaalsContact CE-CB 3.42Å; M85-N112 HydrophobicContact CG-CB 3.98Å; M85-N112 HydrophobicContact SD-CB 3.81Å
86	A	79	Confident	73.8	Confident	54 Å²	54	60.2 Å²	60.2	45%	0.446	30%	0.297	S	S	.	.	H	α-helix	trans	-58.8	-41.5	175	0	0	0	0	0	111.8	E82 R83 C90	E82-A86 WeakPolarHBondContact O-CB 3.14Å; E82-A86 PolarHBondContact O-N 2.98Å; R83-A86 PolarHBondContact O-N 3.27Å; A86-C90 PolarHBondContact O-N 3.28Å; A86-C90 PolarHBondContact O-SG 3.35Å
87	Q	78	Confident	72.9	Confident	81 Å²	81	61.7 Å²	61.7	38%	0.379	31%	0.312	S	S	.	.	H	α-helix	trans	-66.5	-45.9	175.2	-68.9	175.9	-8.4	0	0	111.9	L65 R83 Y84 M85 K89 C90 Y91	L65-Q87 HydrophobicContact CD1-CB 4.46Å; R83-Q87 WeakPolarHBondContact O-CG 3.32Å; R83-Q87 PolarHBondContact O-N 3.14Å; Y84-Q87 PolarHBondContact O-N 3.32Å; M85-Q87 VanDerWaalsContact C-N 3.28Å; M85-Q87 PolarHBondContact O-N 3.17Å; Q87-K89 VanDerWaalsContact C-N 3.3Å; Q87-K89 PolarHBondContact O-N 3.1Å; Q87-C90 WeakPolarHBondContact O-CB 3.26Å; Q87-C90 PolarHBondContact O-N 3.12Å; Q87-Y91 WeakPolarHBondContact O-CD2 3.38Å; Q87-Y91 PolarHBondContact O-N 3.36Å
88	L	77.3	Confident	71.3	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.6	-37.8	177.3	-78.3	168.2	0	0	0	112.5	R62 L65 E66 A69 Y84 M85 C90 Y91 Y92 L108	R62-L88 HydrophobicContact CG-CD2 4.4Å; L65-L88 HydrophobicContact CB-CD2 3.55Å; L65-L88 HydrophobicContact CB-CG 3.92Å; E66-L88 HydrophobicContact CG-CD2 3.97Å; A69-L88 HydrophobicContact CB-CD1 4Å; Y84-L88 WeakPolarHBondContact O-CB 3.48Å; Y84-L88 WeakPolarHBondContact O-CG 3.34Å; Y84-L88 PolarHBondContact O-N 3.07Å; M85-L88 PolarHBondContact O-N 2.86Å; L88-C90 VanDerWaalsContact C-N 3.34Å; L88-C90 PolarHBondContact O-N 2.9Å; L88-Y91 PolarHBondContact O-N 2.9Å; L88-Y91 VanDerWaalsContact O-N 3.1Å; L88-Y92 HydrophobicContact CB-CD2 4.37Å; L88-Y92 HydrophobicContact CB-CE2 3.89Å; L88-Y92 HydrophobicContact CD2-CE2 4.5Å; L88-Y92 WeakPolarHBondContact O-CD2 3.46Å; L88-Y92 PolarHBondContact O-N 3.17Å; L88-L108 HydrophobicContact CD1-CD2 3.64Å
89	K	73.6	Confident	70.2	Confident	39 Å²	39	62.5 Å²	62.5	17%	0.17	31%	0.313	C	S	.	.	H	α-helix	trans	-57	-46.7	175.3	-76	173.4	179.6	-173.9	0	111	M85 Q87 Y91 Y92 F93 N112 E128	M85-K89 HydrophobicContact CE-CG 4.11Å; M85-K89 WeakPolarHBondContact O-CB 3.08Å; M85-K89 VanDerWaalsContact O-CG 3.29Å; M85-K89 WeakPolarHBondContact O-CG 3.28Å; M85-K89 PolarHBondContact O-N 3.48Å; Q87-K89 VanDerWaalsContact C-N 3.3Å; Q87-K89 PolarHBondContact O-N 3.1Å; K89-Y91 VanDerWaalsContact C-N 3.26Å; K89-Y91 PolarHBondContact O-N 3.44Å; K89-Y92 PolarHBondContact O-N 2.98Å; K89-Y92 VanDerWaalsContact O-N 3.1Å; K89-F93 HydrophobicContact CB-CD2 4.28Å; K89-F93 HydrophobicContact CB-CE2 4.07Å; K89-F93 HydrophobicContact CG-CE2 4.29Å; K89-F93 WeakPolarHBondContact O-CD2 3.48Å; K89-F93 PolarHBondContact O-N 2.86Å; K89-N112 WeakPolarHBondContact CE-ND2 3.38Å; K89-E128 VanDerWaalsContact CE-OE1 3.31Å; K89-E128 WeakPolarHBondContact CE-OE1 3.39Å; K89-E128 IonicContact NZ-OE1 3.71Å; K89-E128 PolarHBondContact NZ-OE1 3.5Å; K89-E128 IonicContact NZ-OE2 2.72Å
90	C	71.9	Confident	68.8	Low	69 Å²	69	63.2 Å²	63.2	47%	0.466	32%	0.318	S	S	.	.	H	α-helix	trans	-55.3	-42.6	175.7	-59	0	0	0	0	111.8	A86 Q87 L88 Y92 D94	A86-C90 PolarHBondContact O-N 3.28Å; A86-C90 PolarHBondContact O-SG 3.35Å; Q87-C90 WeakPolarHBondContact O-CB 3.26Å; Q87-C90 PolarHBondContact O-N 3.12Å; L88-C90 VanDerWaalsContact C-N 3.34Å; L88-C90 PolarHBondContact O-N 2.9Å; C90-Y92 PolarHBondContact O-N 2.92Å; C90-D94 VanDerWaalsContact O-CB 3.28Å; C90-D94 WeakPolarHBondContact O-CB 3.44Å; C90-D94 VanDerWaalsContact O-CG 3.28Å; C90-D94 PolarHBondContact O-N 2.82Å
91	Y	69.1	Low	67.7	Low	28 Å²	28	66.6 Å²	66.6	11%	0.11	33%	0.33	C	S	.	.	H	α-helix	trans	-68.4	-32.3	177.9	-67.9	-71	0	0	0	114.2	F45 L58 L65 Q87 L88 K89 Y95	F45-Y91 VanDerWaalsContact CD1-OH 3.26Å; F45-Y91 WeakPolarHBondContact CD1-OH 3.48Å; L58-Y91 HydrophobicContact CD2-CD1 4.46Å; L58-Y91 HydrophobicContact CD2-CE1 4.03Å; L65-Y91 HydrophobicContact CD1-CD2 3.75Å; L65-Y91 HydrophobicContact CD1-CE2 3.3Å; Q87-Y91 WeakPolarHBondContact O-CD2 3.38Å; Q87-Y91 PolarHBondContact O-N 3.36Å; L88-Y91 PolarHBondContact O-N 2.9Å; L88-Y91 VanDerWaalsContact O-N 3.1Å; K89-Y91 VanDerWaalsContact C-N 3.26Å; K89-Y91 PolarHBondContact O-N 3.44Å; Y91-Y95 HydrophobicContact CD1-CD2 4.15Å; Y91-Y95 AromaticContact CD1-CE2 3.99Å; Y91-Y95 HydrophobicContact CD1-CE2 3.99Å; Y91-Y95 HydrophobicContact CE1-CE2 4.45Å
92	Y	69	Low	66.5	Low	20 Å²	20	67.6 Å²	67.6	8%	0.078	34%	0.337	C	S	.	.	H	α-helix	trans	-77.1	-31.9	178.9	-64.8	-46.7	0	0	0	113.3	R62 E66 L88 K89 C90 M105	R62-Y92 HydrophobicContact CG-CE1 4.45Å; E66-Y92 PolarHBondContact OE1-OH 3.25Å; E66-Y92 VanDerWaalsContact OE1-OH 3.13Å; L88-Y92 HydrophobicContact CB-CD2 4.37Å; L88-Y92 HydrophobicContact CB-CE2 3.89Å; L88-Y92 HydrophobicContact CD2-CE2 4.5Å; L88-Y92 WeakPolarHBondContact O-CD2 3.46Å; L88-Y92 PolarHBondContact O-N 3.17Å; K89-Y92 PolarHBondContact O-N 2.98Å; K89-Y92 VanDerWaalsContact O-N 3.1Å; C90-Y92 PolarHBondContact O-N 2.92Å; Y92-M105 HydrophobicContact CD1-CG 3.78Å; Y92-M105 HydrophobicContact CD1-SD 3.71Å; Y92-M105 HydrophobicContact CE1-CB 4Å; Y92-M105 HydrophobicContact CE1-CG 3.48Å; Y92-M105 VanDerWaalsContact CE1-CG 3.48Å; Y92-M105 HydrophobicContact CE1-SD 3.95Å; Y92-M105 HydrophobicContact CE2-CG 4.34Å; Y92-M105 HydrophobicContact CG-CG 4.34Å; Y92-M105 HydrophobicContact CG-SD 4.38Å
93	F	63.9	Low	65.5	Low	68 Å²	68	67.5 Å²	67.5	30%	0.298	35%	0.351	S	S	.	.	H	α-helix	trans	-88.2	-40.5	-179.4	-64.9	-63	0	0	0	113.2	K89 Y95 R131	K89-F93 HydrophobicContact CB-CD2 4.28Å; K89-F93 HydrophobicContact CB-CE2 4.07Å; K89-F93 HydrophobicContact CG-CE2 4.29Å; K89-F93 WeakPolarHBondContact O-CD2 3.48Å; K89-F93 PolarHBondContact O-N 2.86Å; F93-Y95 PolarHBondContact O-N 3.47Å; F93-R131 HydrophobicContact CD1-CG 4.11Å; F93-R131 HydrophobicContact CE1-CG 3.38Å; F93-R131 VanDerWaalsContact CE2-NE 3.27Å; F93-R131 VanDerWaalsContact CZ-CD 3.43Å; F93-R131 HydrophobicContact CZ-CG 3.78Å
94	D	63.8	Low	64.6	Low	99 Å²	99	65.2 Å²	65.2	53%	0.529	34%	0.343	S	S	.	.	H	α-helix	trans	-77.7	-22.7	-174.2	-62.3	-24.3	0	0	0	112.8	C90	C90-D94 VanDerWaalsContact O-CB 3.28Å; C90-D94 WeakPolarHBondContact O-CB 3.44Å; C90-D94 VanDerWaalsContact O-CG 3.28Å; C90-D94 PolarHBondContact O-N 2.82Å
95	Y	56.8	Low	64.1	Low	52 Å²	52	65.8 Å²	65.8	20%	0.204	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	18.1	-176.1	-65.7	-77.7	0	0	0	114.7	L58 Y91 F93 D97 E98 L99	L58-Y95 HydrophobicContact CD1-CD1 4.05Å; L58-Y95 HydrophobicContact CD1-CE1 3.37Å; L58-Y95 HydrophobicContact CD1-CE2 4.27Å; L58-Y95 VanDerWaalsContact CD1-CZ 3.49Å; L58-Y95 HydrophobicContact CD2-CE2 3.98Å; Y91-Y95 HydrophobicContact CD1-CD2 4.15Å; Y91-Y95 AromaticContact CD1-CE2 3.99Å; Y91-Y95 HydrophobicContact CD1-CE2 3.99Å; Y91-Y95 HydrophobicContact CE1-CE2 4.45Å; F93-Y95 PolarHBondContact O-N 3.47Å; Y95-D97 PolarHBondContact O-N 3.42Å; Y95-D97 VanDerWaalsContact O-N 3.09Å; Y95-E98 PolarHBondContact O-N 3.21Å; Y95-L99 VanDerWaalsContact CB-CD1 3.48Å; Y95-L99 HydrophobicContact CG-CD1 4.18Å; Y95-L99 PolarHBondContact O-N 3.47Å
96	K	55.9	Low	63.8	Low	104 Å²	104	66.5 Å²	66.5	45%	0.452	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-26.4	-178.1	-153.7	174.5	-177	-177.3	0	113.2
97	D	53.1	Low	63.6	Low	169 Å²	169	65.3 Å²	65.3	90%	0.904	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-14.2	179.5	-66.3	-45.5	0	0	0	114.7	Y95	Y95-D97 PolarHBondContact O-N 3.42Å; Y95-D97 VanDerWaalsContact O-N 3.09Å
98	E	46	Very low	63.6	Low	103 Å²	103	61.5 Å²	61.5	48%	0.481	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-11.8	-173.2	-77.8	-129	125.4	0	0	115.1	K55 Y95	K55-E98 VanDerWaalsContact CE-CD 3.47Å; K55-E98 WeakPolarHBondContact CE-OE1 3.14Å; K55-E98 VanDerWaalsContact CE-OE2 3.23Å; K55-E98 WeakPolarHBondContact CE-OE2 3.24Å; K55-E98 IonicContact NZ-OE1 2.61Å; K55-E98 PolarHBondContact NZ-OE1 3.14Å; K55-E98 IonicContact NZ-OE2 3.53Å; Y95-E98 PolarHBondContact O-N 3.21Å
99	L	51.5	Low	63.6	Low	30 Å²	30	62 Å²	62	16%	0.157	32%	0.32	C	S	.	.	S	Bend	trans	-121.5	140.1	-171	-72	169	0	0	0	113	I59 Y95	I59-L99 HydrophobicContact CD1-CD2 3.77Å; I59-L99 HydrophobicContact CG1-CD2 3.3Å; Y95-L99 VanDerWaalsContact CB-CD1 3.48Å; Y95-L99 HydrophobicContact CG-CD1 4.18Å; Y95-L99 PolarHBondContact O-N 3.47Å
100	P	51.2	Low	63.9	Low	95 Å²	95	60.1 Å²	60.1	62%	0.617	31%	0.312	S	S	*	.	P	Polyproline II helix	trans	-68.4	137.5	166.4	28.2	-31.1	0	0	0	110	R62 S102	R62-P100 PolarHBondContact NH1-O 3.37Å; P100-S102 PolarHBondContact O-N 2.81Å
101	E	56.2	Low	64.4	Low	104 Å²	104	56.8 Å²	56.8	49%	0.486	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-61.6	121.1	174.8	-68.1	-178.1	164.6	0	0	109.9	M105 H106	E101-M105 HydrophobicContact CG-CE 4.16Å; E101-H106 IonicContact OE2-CE1 3.4Å
102	S	55.6	Low	65	Low	23 Å²	23	55.8 Å²	55.8	16%	0.161	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-77.5	143.2	177.3	-178.8	0	0	0	0	110.2	P100 Y104 M105	P100-S102 PolarHBondContact O-N 2.81Å; S102-Y104 PolarHBondContact O-N 3.35Å; S102-Y104 PolarHBondContact OG-N 3.14Å; S102-M105 WeakPolarHBondContact O-CB 3.34Å; S102-M105 PolarHBondContact O-N 2.96Å
103	A	59.8	Low	65.7	Low	84 Å²	84	54.9 Å²	54.9	69%	0.694	28%	0.283	S	S	*	.	H	α-helix	trans	-59	-28.6	173.7	0	0	0	0	0	112.5
104	Y	64.5	Low	66.5	Low	132 Å²	132	51.8 Å²	51.8	52%	0.518	27%	0.269	S	S	.	.	H	α-helix	trans	-79.3	-20.7	177.3	-68.1	-69.4	0	0	0	113.8	S102 H106 Q107 L108	S102-Y104 PolarHBondContact O-N 3.35Å; S102-Y104 PolarHBondContact OG-N 3.14Å; Y104-H106 VanDerWaalsContact C-N 3.28Å; Y104-H106 PolarHBondContact O-N 3Å; Y104-Q107 PolarHBondContact O-N 2.76Å; Y104-Q107 VanDerWaalsContact O-N 3.11Å; Y104-L108 WeakPolarHBondContact O-CD1 3.45Å; Y104-L108 PolarHBondContact O-N 3.32Å
105	M	70.1	Confident	67.4	Low	24 Å²	24	47.3 Å²	47.3	12%	0.118	25%	0.245	C	C	.	.	H	α-helix	trans	-54.9	-47.8	178.7	179.9	179.7	103.5	0	0	110.8	Y92 E101 S102 Q107 L108 L109	Y92-M105 HydrophobicContact CD1-CG 3.78Å; Y92-M105 HydrophobicContact CD1-SD 3.71Å; Y92-M105 HydrophobicContact CE1-CB 4Å; Y92-M105 HydrophobicContact CE1-CG 3.48Å; Y92-M105 VanDerWaalsContact CE1-CG 3.48Å; Y92-M105 HydrophobicContact CE1-SD 3.95Å; Y92-M105 HydrophobicContact CE2-CG 4.34Å; Y92-M105 HydrophobicContact CG-CG 4.34Å; Y92-M105 HydrophobicContact CG-SD 4.38Å; E101-M105 HydrophobicContact CG-CE 4.16Å; S102-M105 WeakPolarHBondContact O-CB 3.34Å; S102-M105 PolarHBondContact O-N 2.96Å; M105-Q107 PolarHBondContact O-N 3.01Å; M105-L108 PolarHBondContact O-N 3.32Å; M105-L109 HydrophobicContact CE-CD1 4.1Å; M105-L109 HydrophobicContact CG-CD1 3.71Å; M105-L109 WeakPolarHBondContact O-CB 3.14Å; M105-L109 WeakPolarHBondContact O-CD1 3.39Å; M105-L109 WeakPolarHBondContact O-CG 3.29Å; M105-L109 PolarHBondContact O-N 3.29Å
106	H	73.3	Confident	68.6	Low	18 Å²	18	45.1 Å²	45.1	8%	0.083	24%	0.237	C	C	.	.	H	α-helix	trans	-68.3	-34.2	-179.4	-60.2	90.8	0	0	0	112.9	E101 Y104 G110 N140 I143	E101-H106 IonicContact OE2-CE1 3.4Å; Y104-H106 VanDerWaalsContact C-N 3.28Å; Y104-H106 PolarHBondContact O-N 3Å; H106-G110 PolarHBondContact O-N 3.08Å; H106-N140 WeakPolarHBondContact CB-ND2 3.2Å; H106-I143 HydrophobicContact CB-CD1 4.19Å
107	Q	75.8	Confident	69.8	Low	30 Å²	30	40.6 Å²	40.6	14%	0.14	22%	0.217	C	C	.	.	H	α-helix	trans	-67.5	-44.6	176	-171.7	-178	-6.1	0	0	111	Y104 M105 G110 L111 Y173	Y104-Q107 PolarHBondContact O-N 2.76Å; Y104-Q107 VanDerWaalsContact O-N 3.11Å; M105-Q107 PolarHBondContact O-N 3.01Å; Q107-G110 PolarHBondContact O-N 3.4Å; Q107-L111 PolarHBondContact O-N 2.96Å; Q107-Y173 WeakPolarHBondContact CA-OH 3.34Å; Q107-Y173 WeakPolarHBondContact CG-OH 3.06Å; Q107-Y173 PolarHBondContact O-OH 3.14Å
108	L	77.5	Confident	71.1	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-67.2	-37.6	175.8	-87	100.2	0	0	0	112.5	E66 A69 L88 Y104 M105 L111 N112	E66-L108 HydrophobicContact CB-CD1 4.19Å; E66-L108 HydrophobicContact CB-CD2 4.31Å; E66-L108 HydrophobicContact CG-CD1 4.18Å; E66-L108 HydrophobicContact CG-CD2 4.28Å; A69-L108 HydrophobicContact CB-CD2 3.79Å; L88-L108 HydrophobicContact CD1-CD2 3.64Å; Y104-L108 WeakPolarHBondContact O-CD1 3.45Å; Y104-L108 PolarHBondContact O-N 3.32Å; M105-L108 PolarHBondContact O-N 3.32Å; L108-L111 WeakPolarHBondContact O-CB 3.44Å; L108-L111 PolarHBondContact O-N 3.43Å; L108-N112 PolarHBondContact O-N 2.97Å
109	L	77.4	Confident	72.8	Confident	9 Å²	9	31.3 Å²	31.3	5%	0.047	17%	0.171	C	C	.	.	H	α-helix	trans	-63	-45.5	172.6	-78.9	158.5	0	0	0	111.2	M85 M105 L111 N112 L113 L132	M85-L109 HydrophobicContact CE-CD2 4.18Å; M105-L109 HydrophobicContact CE-CD1 4.1Å; M105-L109 HydrophobicContact CG-CD1 3.71Å; M105-L109 WeakPolarHBondContact O-CB 3.14Å; M105-L109 WeakPolarHBondContact O-CD1 3.39Å; M105-L109 WeakPolarHBondContact O-CG 3.29Å; M105-L109 PolarHBondContact O-N 3.29Å; L109-L111 VanDerWaalsContact C-N 3.27Å; L109-L111 PolarHBondContact O-N 3.25Å; L109-N112 PolarHBondContact O-N 2.97Å; L109-L113 WeakPolarHBondContact O-CG 3.14Å; L109-L113 PolarHBondContact O-N 3.46Å; L109-L132 HydrophobicContact CD1-CD2 4.1Å
110	G	79.2	Confident	74.2	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.6	-37.3	172.9	0	0	0	0	0	112.8	H106 Q107 L113 L114	H106-G110 PolarHBondContact O-N 3.08Å; Q107-G110 PolarHBondContact O-N 3.4Å; G110-L113 PolarHBondContact O-N 3.11Å; G110-L114 PolarHBondContact O-N 3.14Å
111	L	81.9	Confident	75.7	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.2	-43.9	174.2	-88.8	157.2	0	0	0	111.5	L70 I73 F81 Q107 L108 L109 L113 L114 F115 Y173 F176	L70-L111 HydrophobicContact CD2-CD1 3.91Å; I73-L111 HydrophobicContact CD1-CD1 3.7Å; I73-L111 HydrophobicContact CD1-CD2 3.71Å; I73-L111 HydrophobicContact CD1-CG 4.17Å; F81-L111 HydrophobicContact CZ-CB 4.4Å; Q107-L111 PolarHBondContact O-N 2.96Å; L108-L111 WeakPolarHBondContact O-CB 3.44Å; L108-L111 PolarHBondContact O-N 3.43Å; L109-L111 VanDerWaalsContact C-N 3.27Å; L109-L111 PolarHBondContact O-N 3.25Å; L111-L113 VanDerWaalsContact C-N 3.35Å; L111-L114 PolarHBondContact O-N 3.15Å; L111-F115 WeakPolarHBondContact O-CB 3.19Å; L111-F115 PolarHBondContact O-N 3.11Å; L111-Y173 HydrophobicContact CB-CE1 4.17Å; L111-Y173 HydrophobicContact CD1-CE1 4.48Å; L111-Y173 HydrophobicContact CD2-CD1 3.71Å; L111-Y173 HydrophobicContact CD2-CE1 3.87Å; L111-Y173 HydrophobicContact CG-CD1 3.88Å; L111-Y173 HydrophobicContact CG-CE1 3.46Å; L111-Y173 VanDerWaalsContact CG-CE1 3.46Å; L111-F176 HydrophobicContact CD2-CD2 3.78Å; L111-F176 HydrophobicContact CD2-CE2 3.74Å
112	N	83.6	Confident	76.8	Confident	6 Å²	6	31.9 Å²	31.9	3%	0.032	17%	0.166	C	C	.	.	H	α-helix	trans	-64	-39.7	175.6	176.1	58	0	0	0	112.1	M85 K89 L108 L109 F115 L116	M85-N112 HydrophobicContact CE-CB 3.42Å; M85-N112 VanDerWaalsContact CE-CB 3.42Å; M85-N112 HydrophobicContact CG-CB 3.98Å; M85-N112 HydrophobicContact SD-CB 3.81Å; K89-N112 WeakPolarHBondContact CE-ND2 3.38Å; L108-N112 PolarHBondContact O-N 2.97Å; L109-N112 PolarHBondContact O-N 2.97Å; N112-F115 WeakPolarHBondContact O-CB 3.34Å; N112-F115 PolarHBondContact O-N 3.37Å; N112-L116 WeakPolarHBondContact O-CG 3.42Å; N112-L116 PolarHBondContact O-N 2.9Å
113	L	81.8	Confident	78.1	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.01	19%	0.19	C	C	.	.	H	α-helix	trans	-61.3	-45.2	174.7	-72.5	176.8	0	0	0	111.4	L109 G110 L111 F115 L116 L117 F125 E128 L132 I143 P146	L109-L113 WeakPolarHBondContact O-CG 3.14Å; L109-L113 PolarHBondContact O-N 3.46Å; G110-L113 PolarHBondContact O-N 3.11Å; L111-L113 VanDerWaalsContact C-N 3.35Å; L113-F115 VanDerWaalsContact C-N 3.32Å; L113-F115 PolarHBondContact O-N 3.26Å; L113-L116 PolarHBondContact O-N 3.4Å; L113-L117 WeakPolarHBondContact O-CG 3.12Å; L113-L117 PolarHBondContact O-N 3.06Å; L113-L117 VanDerWaalsContact O-N 3.14Å; L113-F125 HydrophobicContact CB-CD2 4.12Å; L113-F125 HydrophobicContact CB-CE2 3.75Å; L113-F125 HydrophobicContact CD2-CD2 3.69Å; L113-F125 HydrophobicContact CD2-CE2 3.75Å; L113-F125 HydrophobicContact CD2-CG 4.39Å; L113-F125 HydrophobicContact CD2-CZ 4.44Å; L113-F125 HydrophobicContact CG-CD2 4.48Å; L113-F125 HydrophobicContact CG-CE2 4.2Å; L113-E128 HydrophobicContact CD2-CB 4.25Å; L113-L132 HydrophobicContact CD1-CD1 4.46Å; L113-I143 HydrophobicContact CD1-CG2 4.13Å; L113-P146 HydrophobicContact CB-CB 4.02Å; L113-P146 HydrophobicContact CB-CG 4.49Å
114	L	81.4	Confident	79.2	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-64.9	-35.8	174.8	-77.5	164.6	0	0	0	113	G110 L111 L117 S118 P146 L149 Y173 F176 I177	G110-L114 PolarHBondContact O-N 3.14Å; L111-L114 PolarHBondContact O-N 3.15Å; L114-L117 HydrophobicContact CD2-CD1 4.47Å; L114-L117 PolarHBondContact O-N 3.02Å; L114-S118 PolarHBondContact O-N 3.41Å; L114-P146 HydrophobicContact CD1-CG 4.12Å; L114-P146 HydrophobicContact CD2-CB 4.37Å; L114-P146 HydrophobicContact CD2-CG 4.45Å; L114-P146 HydrophobicContact CG-CB 4.13Å; L114-P146 HydrophobicContact CG-CG 3.9Å; L114-L149 HydrophobicContact CD2-CD2 3.64Å; L114-Y173 HydrophobicContact CD1-CD1 3.15Å; L114-Y173 HydrophobicContact CD1-CE1 3.64Å; L114-Y173 HydrophobicContact CD1-CG 3.82Å; L114-F176 HydrophobicContact CB-CB 4.37Å; L114-I177 HydrophobicContact CD2-CD1 3.72Å
115	F	83	Confident	80.2	Confident	5 Å²	5	28.9 Å²	28.9	2%	0.022	15%	0.151	C	C	.	.	H	α-helix	trans	-60.9	-46.8	174.5	174.1	-110	0	0	0	111.8	I78 F81 E82 L111 N112 L113 L117 S118 Q119 F176	I78-F115 HydrophobicContact CB-CE2 4.39Å; I78-F115 HydrophobicContact CG1-CE2 4.43Å; I78-F115 HydrophobicContact CG2-CE2 3.59Å; I78-F115 HydrophobicContact CG2-CZ 3.82Å; F81-F115 HydrophobicContact CD1-CD1 4.33Å; F81-F115 HydrophobicContact CD1-CD2 4.08Å; F81-F115 HydrophobicContact CD1-CE1 4.49Å; F81-F115 HydrophobicContact CD1-CE2 4.24Å; F81-F115 HydrophobicContact CD1-CG 4.08Å; F81-F115 HydrophobicContact CD1-CZ 4.39Å; F81-F115 HydrophobicContact CE1-CB 3.9Å; F81-F115 HydrophobicContact CE1-CD1 4.16Å; F81-F115 HydrophobicContact CE1-CD2 4.24Å; F81-F115 AromaticContact CE1-CG 3.85Å; F81-F115 HydrophobicContact CE1-CG 3.85Å; E82-F115 HydrophobicContact CB-CE1 4.34Å; E82-F115 HydrophobicContact CB-CZ 4.29Å; E82-F115 HydrophobicContact CG-CE1 4.49Å; L111-F115 WeakPolarHBondContact O-CB 3.19Å; L111-F115 PolarHBondContact O-N 3.11Å; N112-F115 WeakPolarHBondContact O-CB 3.34Å; N112-F115 PolarHBondContact O-N 3.37Å; L113-F115 VanDerWaalsContact C-N 3.32Å; L113-F115 PolarHBondContact O-N 3.26Å; F115-L117 VanDerWaalsContact C-N 3.3Å; F115-L117 PolarHBondContact O-N 2.76Å; F115-S118 PolarHBondContact O-N 3.01Å; F115-S118 VanDerWaalsContact O-N 3.14Å; F115-S118 PolarHBondContact O-OG 3.34Å; F115-Q119 HydrophobicContact CE2-CG 4.37Å; F115-Q119 VanDerWaalsContact CE2-NE2 3.3Å; F115-Q119 HydrophobicContact CZ-CG 4.43Å; F115-Q119 PolarHBondContact O-N 3.3Å; F115-Q119 VanDerWaalsContact O-N 3.15Å; F115-F176 HydrophobicContact CB-CE1 4.39Å; F115-F176 HydrophobicContact CD2-CD1 4.34Å; F115-F176 AromaticContact CD2-CE1 3.67Å; F115-F176 HydrophobicContact CD2-CE1 3.67Å; F115-F176 HydrophobicContact CD2-CZ 4.28Å; F115-F176 HydrophobicContact CE2-CE1 4.47Å
116	L	82	Confident	80.8	Confident	6 Å²	6	31.5 Å²	31.5	3%	0.031	16%	0.163	C	C	.	.	H	α-helix	trans	-61.3	-39.4	177.1	-67.7	171.5	0	0	0	112	N112 L113 Q119 N120 R121 E124 F125 E128	N112-L116 WeakPolarHBondContact O-CG 3.42Å; N112-L116 PolarHBondContact O-N 2.9Å; L113-L116 PolarHBondContact O-N 3.4Å; L116-Q119 PolarHBondContact O-N 3.32Å; L116-N120 PolarHBondContact O-N 2.94Å; L116-R121 PolarHBondContact O-N 3.38Å; L116-E124 HydrophobicContact CD1-CB 4.39Å; L116-E124 HydrophobicContact CD2-CB 4Å; L116-E124 VanDerWaalsContact CD2-OE2 3.31Å; L116-E124 WeakPolarHBondContact CD2-OE2 3.34Å; L116-F125 HydrophobicContact CB-CB 4.31Å; L116-E128 HydrophobicContact CD1-CB 4.42Å; L116-E128 HydrophobicContact CD1-CG 3.97Å
117	L	82.1	Confident	81.4	Confident	9 Å²	9	35 Å²	35	5%	0.047	19%	0.186	C	C	.	.	H	α-helix	trans	-64	-41.8	173.9	-66.9	174.8	0	0	0	112.1	L113 L114 F115 Q119 N120 F125 E150 L180	L113-L117 WeakPolarHBondContact O-CG 3.12Å; L113-L117 PolarHBondContact O-N 3.06Å; L113-L117 VanDerWaalsContact O-N 3.14Å; L114-L117 HydrophobicContact CD2-CD1 4.47Å; L114-L117 PolarHBondContact O-N 3.02Å; F115-L117 VanDerWaalsContact C-N 3.3Å; F115-L117 PolarHBondContact O-N 2.76Å; L117-Q119 PolarHBondContact O-N 3.42Å; L117-N120 PolarHBondContact O-N 3.01Å; L117-F125 HydrophobicContact CD1-CD2 4.3Å; L117-F125 HydrophobicContact CD1-CE2 3.82Å; L117-F125 HydrophobicContact CD1-CZ 4.46Å; L117-F125 HydrophobicContact CD2-CD2 3.88Å; L117-F125 HydrophobicContact CD2-CE2 4.06Å; L117-F125 HydrophobicContact CD2-CG 4.19Å; L117-F125 HydrophobicContact CG-CD2 3.8Å; L117-F125 HydrophobicContact CG-CE2 3.84Å; L117-E150 HydrophobicContact CD1-CB 4.03Å; L117-E150 HydrophobicContact CD1-CG 4.47Å; L117-E150 HydrophobicContact CD2-CB 3.99Å; L117-E150 HydrophobicContact CD2-CG 3.52Å; L117-L180 HydrophobicContact CB-CD1 3.58Å
118	S	79.9	Confident	81.4	Confident	19 Å²	19	34.8 Å²	34.8	13%	0.133	18%	0.184	C	C	.	.	H	α-helix	trans	-64.3	-25.7	178	74	0	0	0	0	113.5	L114 F115 N120	L114-S118 PolarHBondContact O-N 3.41Å; F115-S118 PolarHBondContact O-N 3.01Å; F115-S118 VanDerWaalsContact O-N 3.14Å; F115-S118 PolarHBondContact O-OG 3.34Å; S118-N120 VanDerWaalsContact C-N 3.34Å
119	Q	82.1	Confident	81.6	Confident	58 Å²	58	36.9 Å²	36.9	27%	0.271	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	4	175	-65.3	-160.1	1.6	0	0	113.8	F115 L116 L117 R121	F115-Q119 HydrophobicContact CE2-CG 4.37Å; F115-Q119 VanDerWaalsContact CE2-NE2 3.3Å; F115-Q119 HydrophobicContact CZ-CG 4.43Å; F115-Q119 PolarHBondContact O-N 3.3Å; F115-Q119 VanDerWaalsContact O-N 3.15Å; L116-Q119 PolarHBondContact O-N 3.32Å; L117-Q119 PolarHBondContact O-N 3.42Å; Q119-R121 HydrophobicContact CB-CG 4.06Å; Q119-R121 PolarHBondContact O-N 2.91Å; Q119-R121 VanDerWaalsContact OE1-CZ 3.28Å
120	N	79.6	Confident	81.7	Confident	102 Å²	102	44.4 Å²	44.4	55%	0.545	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	28.5	-174.3	-156.1	8.7	0	0	0	113.5	L116 L117 S118 V122	L116-N120 PolarHBondContact O-N 2.94Å; L117-N120 PolarHBondContact O-N 3.01Å; S118-N120 VanDerWaalsContact C-N 3.34Å; N120-V122 PolarHBondContact O-N 3.17Å
121	R	82.1	Confident	81.5	Confident	96 Å²	96	49 Å²	49	36%	0.362	25%	0.248	S	C	.	.			trans	-96.7	66.8	177.8	-63.3	-167.2	-169.6	175.5	9.8	111	L116 Q119 S123 E124 F125	L116-R121 PolarHBondContact O-N 3.38Å; Q119-R121 HydrophobicContact CB-CG 4.06Å; Q119-R121 PolarHBondContact O-N 2.91Å; Q119-R121 VanDerWaalsContact OE1-CZ 3.28Å; R121-S123 VanDerWaalsContact C-N 3.29Å; R121-S123 PolarHBondContact O-N 2.86Å; R121-E124 HydrophobicContact CB-CB 4.32Å; R121-E124 HydrophobicContact CB-CG 4.46Å; R121-E124 WeakPolarHBondContact CD-OE1 3.37Å; R121-E124 WeakPolarHBondContact CD-OE2 3.32Å; R121-E124 IonicContact NH1-OE1 3.19Å; R121-E124 PolarHBondContact NH1-OE1 3.1Å; R121-E124 IonicContact NH1-OE2 3.47Å; R121-E124 PolarHBondContact NH1-OE2 2.99Å; R121-E124 PolarHBondContact O-N 3.46Å; R121-F125 PolarHBondContact O-N 3.28Å
122	V	80.3	Confident	81	Confident	43 Å²	43	50.3 Å²	50.3	26%	0.261	25%	0.254	S	S	.	.	H	α-helix	trans	-64.2	-32.7	-176.5	-177	0	0	0	0	112.4	N120 F125 H126	N120-V122 PolarHBondContact O-N 3.17Å; V122-F125 VanDerWaalsContact O-CB 3.32Å; V122-F125 WeakPolarHBondContact O-CB 3.48Å; V122-F125 PolarHBondContact O-N 3.1Å; V122-H126 WeakPolarHBondContact CG1-NE2 3.37Å; V122-H126 PolarHBondContact O-CD2 2.65Å; V122-H126 VanDerWaalsContact O-CD2 3.31Å; V122-H126 PolarHBondContact O-N 3.46Å
123	S	83.4	Confident	80	Confident	95 Å²	95	53.2 Å²	53.2	66%	0.664	27%	0.273	S	S	*	.	H	α-helix	trans	-64.7	-43	178	-48.9	0	0	0	0	113	R121 F125 H126 T127	R121-S123 VanDerWaalsContact C-N 3.29Å; R121-S123 PolarHBondContact O-N 2.86Å; S123-F125 VanDerWaalsContact C-N 3.28Å; S123-F125 PolarHBondContact O-N 3.41Å; S123-H126 PolarHBondContact O-N 3.23Å; S123-T127 PolarHBondContact O-N 2.93Å; S123-T127 VanDerWaalsContact O-N 3.15Å; S123-T127 PolarHBondContact O-OG1 3.4Å
124	E	82.9	Confident	79	Confident	82 Å²	82	56.2 Å²	56.2	38%	0.383	30%	0.297	S	S	.	.	H	α-helix	trans	-66.5	-34.9	175.5	-69	179.5	-166.7	0	0	110.8	L116 R121 T127 E128	L116-E124 HydrophobicContact CD1-CB 4.39Å; L116-E124 HydrophobicContact CD2-CB 4Å; L116-E124 VanDerWaalsContact CD2-OE2 3.31Å; L116-E124 WeakPolarHBondContact CD2-OE2 3.34Å; R121-E124 HydrophobicContact CB-CB 4.32Å; R121-E124 HydrophobicContact CB-CG 4.46Å; R121-E124 WeakPolarHBondContact CD-OE1 3.37Å; R121-E124 WeakPolarHBondContact CD-OE2 3.32Å; R121-E124 IonicContact NH1-OE1 3.19Å; R121-E124 PolarHBondContact NH1-OE1 3.1Å; R121-E124 IonicContact NH1-OE2 3.47Å; R121-E124 PolarHBondContact NH1-OE2 2.99Å; R121-E124 PolarHBondContact O-N 3.46Å; E124-T127 PolarHBondContact O-N 3.45Å; E124-E128 WeakPolarHBondContact O-CB 3.4Å; E124-E128 VanDerWaalsContact O-CG 3.25Å; E124-E128 WeakPolarHBondContact O-CG 3.32Å; E124-E128 PolarHBondContact O-N 3.3Å
125	F	85.1	Confident	78.1	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-59.7	-49	174.6	177	-85.6	0	0	0	112.1	L113 L116 L117 R121 V122 S123 T127 E128 L129 V147 E150	L113-F125 HydrophobicContact CB-CD2 4.12Å; L113-F125 HydrophobicContact CB-CE2 3.75Å; L113-F125 HydrophobicContact CD2-CD2 3.69Å; L113-F125 HydrophobicContact CD2-CE2 3.75Å; L113-F125 HydrophobicContact CD2-CG 4.39Å; L113-F125 HydrophobicContact CD2-CZ 4.44Å; L113-F125 HydrophobicContact CG-CD2 4.48Å; L113-F125 HydrophobicContact CG-CE2 4.2Å; L116-F125 HydrophobicContact CB-CB 4.31Å; L117-F125 HydrophobicContact CD1-CD2 4.3Å; L117-F125 HydrophobicContact CD1-CE2 3.82Å; L117-F125 HydrophobicContact CD1-CZ 4.46Å; L117-F125 HydrophobicContact CD2-CD2 3.88Å; L117-F125 HydrophobicContact CD2-CE2 4.06Å; L117-F125 HydrophobicContact CD2-CG 4.19Å; L117-F125 HydrophobicContact CG-CD2 3.8Å; L117-F125 HydrophobicContact CG-CE2 3.84Å; R121-F125 PolarHBondContact O-N 3.28Å; V122-F125 VanDerWaalsContact O-CB 3.32Å; V122-F125 WeakPolarHBondContact O-CB 3.48Å; V122-F125 PolarHBondContact O-N 3.1Å; S123-F125 VanDerWaalsContact C-N 3.28Å; S123-F125 PolarHBondContact O-N 3.41Å; F125-T127 VanDerWaalsContact C-N 3.35Å; F125-T127 PolarHBondContact O-N 2.83Å; F125-E128 PolarHBondContact O-N 3.43Å; F125-L129 HydrophobicContact CE1-CD1 3.77Å; F125-L129 HydrophobicContact CZ-CD1 4.27Å; F125-L129 WeakPolarHBondContact O-CB 3.29Å; F125-L129 PolarHBondContact O-N 2.95Å; F125-V147 HydrophobicContact CZ-CG2 4.48Å; F125-E150 HydrophobicContact CD1-CG 4.05Å; F125-E150 HydrophobicContact CE1-CB 4.01Å; F125-E150 HydrophobicContact CE1-CG 3.61Å; F125-E150 HydrophobicContact CZ-CB 3.82Å; F125-E150 HydrophobicContact CZ-CG 3.89Å
126	H	83.3	Confident	77.3	Confident	79 Å²	79	65.2 Å²	65.2	37%	0.366	34%	0.338	S	S	.	.	H	α-helix	trans	-66.5	-36.5	178.8	-68.2	-51.2	0	0	0	112.9	V122 S123 E128 L129 E130 E150	V122-H126 WeakPolarHBondContact CG1-NE2 3.37Å; V122-H126 PolarHBondContact O-CD2 2.65Å; V122-H126 VanDerWaalsContact O-CD2 3.31Å; V122-H126 PolarHBondContact O-N 3.46Å; S123-H126 PolarHBondContact O-N 3.23Å; H126-E128 VanDerWaalsContact C-N 3.32Å; H126-E128 PolarHBondContact O-N 3.12Å; H126-L129 PolarHBondContact O-N 3.41Å; H126-E130 PolarHBondContact O-N 2.87Å; H126-E150 IonicContact CE1-OE1 3.92Å; H126-E150 IonicContact CE1-OE2 2.75Å; H126-E150 IonicContact NE2-OE1 3.92Å
127	T	84.8	Confident	76.5	Confident	92 Å²	92	66.4 Å²	66.4	56%	0.564	34%	0.344	S	S	*	.	H	α-helix	trans	-63.7	-40.7	175.9	-52.7	0	0	0	0	111.1	S123 E124 F125 R131	S123-T127 PolarHBondContact O-N 2.93Å; S123-T127 VanDerWaalsContact O-N 3.15Å; S123-T127 PolarHBondContact O-OG1 3.4Å; E124-T127 PolarHBondContact O-N 3.45Å; F125-T127 VanDerWaalsContact C-N 3.35Å; F125-T127 PolarHBondContact O-N 2.83Å; T127-R131 PolarHBondContact O-N 3.39Å
128	E	77.2	Confident	75.6	Confident	25 Å²	25	73.4 Å²	73.4	12%	0.117	38%	0.377	C	S	.	.	H	α-helix	trans	-69.3	-34.7	175.2	-73.4	-71.6	166.6	0	0	112.5	K89 L113 L116 E124 F125 H126 R131 L132	K89-E128 VanDerWaalsContact CE-OE1 3.31Å; K89-E128 WeakPolarHBondContact CE-OE1 3.39Å; K89-E128 IonicContact NZ-OE1 3.71Å; K89-E128 PolarHBondContact NZ-OE1 3.5Å; K89-E128 IonicContact NZ-OE2 2.72Å; L113-E128 HydrophobicContact CD2-CB 4.25Å; L116-E128 HydrophobicContact CD1-CB 4.42Å; L116-E128 HydrophobicContact CD1-CG 3.97Å; E124-E128 WeakPolarHBondContact O-CB 3.4Å; E124-E128 VanDerWaalsContact O-CG 3.25Å; E124-E128 WeakPolarHBondContact O-CG 3.32Å; E124-E128 PolarHBondContact O-N 3.3Å; F125-E128 PolarHBondContact O-N 3.43Å; H126-E128 VanDerWaalsContact C-N 3.32Å; H126-E128 PolarHBondContact O-N 3.12Å; E128-R131 WeakPolarHBondContact O-CB 2.97Å; E128-R131 PolarHBondContact O-N 3.3Å; E128-R131 IonicContact OE1-CZ 3.51Å; E128-R131 IonicContact OE1-NH2 3.64Å; E128-R131 PolarHBondContact OE1-NH2 2.9Å; E128-R131 IonicContact OE2-CZ 3.92Å; E128-R131 IonicContact OE2-NE 3.84Å; E128-R131 IonicContact OE2-NH2 2.74Å; E128-R131 PolarHBondContact OE2-NH2 3.39Å; E128-L132 WeakPolarHBondContact O-CD1 3.28Å
129	L	80.1	Confident	75	Confident	45 Å²	45	78.1 Å²	78.1	24%	0.236	41%	0.405	C	S	.	.	H	α-helix	trans	-66.5	-41.2	176.4	-162.5	157.3	0	0	0	111.5	F125 H126 R131 L132 I137 V147	F125-L129 HydrophobicContact CE1-CD1 3.77Å; F125-L129 HydrophobicContact CZ-CD1 4.27Å; F125-L129 WeakPolarHBondContact O-CB 3.29Å; F125-L129 PolarHBondContact O-N 2.95Å; H126-L129 PolarHBondContact O-N 3.41Å; L129-R131 PolarHBondContact O-N 2.87Å; L129-L132 PolarHBondContact O-N 3.35Å; L129-L132 VanDerWaalsContact O-N 3.11Å; L129-I137 HydrophobicContact CD2-CD1 3.89Å; L129-I137 HydrophobicContact CG-CD1 4.34Å; L129-V147 HydrophobicContact CD1-CG1 4.49Å; L129-V147 HydrophobicContact CD1-CG2 3.9Å
130	E	80.9	Confident	74.4	Confident	166 Å²	166	76.9 Å²	76.9	78%	0.776	40%	0.4	S	S	*	.	H	α-helix	trans	-60	-31.4	175.6	-174.5	175.4	-173.7	0	0	112.4	H126 L132	H126-E130 PolarHBondContact O-N 2.87Å; E130-L132 VanDerWaalsContact C-N 3.28Å; E130-L132 PolarHBondContact O-N 3.26Å
131	R	74.3	Confident	74.2	Confident	97 Å²	97	76.5 Å²	76.5	37%	0.366	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-18.2	-179.9	-163.3	165.4	59	170.1	4.9	113.4	F93 T127 E128 L129	F93-R131 HydrophobicContact CD1-CG 4.11Å; F93-R131 HydrophobicContact CE1-CG 3.38Å; F93-R131 VanDerWaalsContact CE2-NE 3.27Å; F93-R131 VanDerWaalsContact CZ-CD 3.43Å; F93-R131 HydrophobicContact CZ-CG 3.78Å; T127-R131 PolarHBondContact O-N 3.39Å; E128-R131 WeakPolarHBondContact O-CB 2.97Å; E128-R131 PolarHBondContact O-N 3.3Å; E128-R131 IonicContact OE1-CZ 3.51Å; E128-R131 IonicContact OE1-NH2 3.64Å; E128-R131 PolarHBondContact OE1-NH2 2.9Å; E128-R131 IonicContact OE2-CZ 3.92Å; E128-R131 IonicContact OE2-NE 3.84Å; E128-R131 IonicContact OE2-NH2 2.74Å; E128-R131 PolarHBondContact OE2-NH2 3.39Å; L129-R131 PolarHBondContact O-N 2.87Å
132	L	70.8	Confident	73.7	Confident	27 Å²	27	75.7 Å²	75.7	14%	0.141	40%	0.399	C	S	.	.	S	Bend	trans	-87	141.8	177.1	-75.6	144.6	0	0	0	111	L109 L113 E128 L129 E130 I137 I143	L109-L132 HydrophobicContact CD1-CD2 4.1Å; L113-L132 HydrophobicContact CD1-CD1 4.46Å; E128-L132 WeakPolarHBondContact O-CD1 3.28Å; L129-L132 PolarHBondContact O-N 3.35Å; L129-L132 VanDerWaalsContact O-N 3.11Å; E130-L132 VanDerWaalsContact C-N 3.28Å; E130-L132 PolarHBondContact O-N 3.26Å; L132-I137 HydrophobicContact CB-CD1 4.26Å; L132-I137 HydrophobicContact CB-CG1 4.3Å; L132-I143 HydrophobicContact CD2-CD1 4.36Å
133	T	63.4	Low	73.4	Confident	68 Å²	68	73.7 Å²	73.7	42%	0.417	39%	0.387	S	S	.	.			trans	-76	131.8	177.6	-57	0	0	0	0	109.9	K135 D136	T133-K135 HydrophobicContact CG2-CB 4.41Å; T133-K135 PolarHBondContact O-N 3.2Å; T133-D136 PolarHBondContact O-N 3.17Å
134	A	60.6	Low	73.3	Confident	64 Å²	64	76.6 Å²	76.6	53%	0.529	38%	0.383	S	S	.	.	H	α-helix	trans	-55.7	-22.7	-175.2	0	0	0	0	0	114.8	Q138	A134-Q138 PolarHBondContact O-N 3.32Å
135	K	62.6	Low	73.1	Confident	160 Å²	160	73.7 Å²	73.7	70%	0.696	37%	0.369	S	S	*	.	H	α-helix	trans	-68.8	-36.3	175.6	-65.7	-177.4	179.6	178.1	0	112.4	T133 Q138 T139	T133-K135 HydrophobicContact CG2-CB 4.41Å; T133-K135 PolarHBondContact O-N 3.2Å; K135-Q138 PolarHBondContact O-N 3.35Å; K135-T139 WeakPolarHBondContact O-CB 3.5Å; K135-T139 PolarHBondContact O-N 3.29Å; K135-T139 VanDerWaalsContact O-N 3.16Å; K135-T139 PolarHBondContact O-OG1 3.02Å
136	D	65.2	Low	73	Confident	37 Å²	37	73.7 Å²	73.7	20%	0.198	37%	0.37	C	S	.	.	H	α-helix	trans	-77.2	-31.2	-177.9	-53	-34.6	0	0	0	111	T133 Q138 N140	T133-D136 PolarHBondContact O-N 3.17Å; D136-Q138 VanDerWaalsContact C-N 3.34Å; D136-Q138 PolarHBondContact O-N 3.23Å; D136-N140 WeakPolarHBondContact O-CB 3.45Å; D136-N140 PolarHBondContact O-N 3.08Å; D136-N140 VanDerWaalsContact O-N 3.09Å
137	I	65.3	Low	73	Confident	30 Å²	30	71.6 Å²	71.6	15%	0.154	36%	0.362	C	S	.	.	H	α-helix	trans	-63.7	-40	175.3	-56.4	177.6	0	0	0	111.1	L129 L132 I143 V147	L129-I137 HydrophobicContact CD2-CD1 3.89Å; L129-I137 HydrophobicContact CG-CD1 4.34Å; L132-I137 HydrophobicContact CB-CD1 4.26Å; L132-I137 HydrophobicContact CB-CG1 4.3Å; I137-I143 HydrophobicContact CG1-CG2 4.39Å; I137-I143 HydrophobicContact CG2-CG2 4.39Å; I137-V147 HydrophobicContact CG2-CG2 4.45Å
138	Q	62.9	Low	72.8	Confident	157 Å²	157	68.5 Å²	68.5	73%	0.734	34%	0.344	S	S	*	.	H	α-helix	trans	-80.2	-34.1	-178.7	-68.4	-178.3	8.5	0	0	112.9	A134 K135 D136	A134-Q138 PolarHBondContact O-N 3.32Å; K135-Q138 PolarHBondContact O-N 3.35Å; D136-Q138 VanDerWaalsContact C-N 3.34Å; D136-Q138 PolarHBondContact O-N 3.23Å
139	T	68.5	Low	73.1	Confident	118 Å²	118	67.6 Å²	67.6	72%	0.724	34%	0.34	S	S	*	.	H	α-helix	trans	-78.4	-33.4	-175.3	-50.7	0	0	0	0	111.6	K135	K135-T139 WeakPolarHBondContact O-CB 3.5Å; K135-T139 PolarHBondContact O-N 3.29Å; K135-T139 VanDerWaalsContact O-N 3.16Å; K135-T139 PolarHBondContact O-OG1 3.02Å
140	N	70.1	Confident	73.2	Confident	31 Å²	31	65.9 Å²	65.9	17%	0.166	33%	0.331	C	S	.	.			trans	-100	116.7	-171.5	-152.6	-33.3	0	0	0	113.6	H106 D136 Y142 I143 R144	H106-N140 WeakPolarHBondContact CB-ND2 3.2Å; D136-N140 WeakPolarHBondContact O-CB 3.45Å; D136-N140 PolarHBondContact O-N 3.08Å; D136-N140 VanDerWaalsContact O-N 3.09Å; N140-Y142 PolarHBondContact O-N 3.35Å; N140-Y142 WeakPolarHBondContact OD1-CD2 3.34Å; N140-Y142 PolarHBondContact OD1-N 3.5Å; N140-Y142 VanDerWaalsContact OD1-N 3.13Å; N140-I143 HydrophobicContact CB-CD1 4.49Å; N140-I143 PolarHBondContact O-N 3.42Å; N140-R144 PolarHBondContact O-N 2.59Å; N140-R144 VanDerWaalsContact O-N 3.11Å
141	V	73.6	Confident	73.4	Confident	95 Å²	95	62.4 Å²	62.4	58%	0.576	32%	0.315	S	S	*	.	H	α-helix	trans	-59.1	-32	177.2	-177.3	0	0	0	0	111.7	I143 H145	V141-I143 PolarHBondContact O-N 3.05Å; V141-H145 PolarHBondContact O-N 3.37Å
142	Y	71.8	Confident	73.9	Confident	79 Å²	79	60.7 Å²	60.7	31%	0.31	31%	0.309	S	S	.	.	H	α-helix	trans	-69.8	-28.7	-178.5	-65.4	-66	0	0	0	114.2	N140 P146 P169 A170 Y173	N140-Y142 PolarHBondContact O-N 3.35Å; N140-Y142 WeakPolarHBondContact OD1-CD2 3.34Å; N140-Y142 PolarHBondContact OD1-N 3.5Å; N140-Y142 VanDerWaalsContact OD1-N 3.13Å; Y142-P146 WeakPolarHBondContact O-CD 3.43Å; Y142-P146 WeakPolarHBondContact O-CG 3.41Å; Y142-P169 HydrophobicContact CD1-CB 4.07Å; Y142-P169 HydrophobicContact CD1-CG 3.59Å; Y142-P169 HydrophobicContact CE1-CB 3.55Å; Y142-P169 HydrophobicContact CE1-CG 3.61Å; Y142-A170 HydrophobicContact CE1-CB 4.29Å; Y142-Y173 AromaticContact CD1-CE2 3.87Å; Y142-Y173 HydrophobicContact CD1-CE2 3.87Å; Y142-Y173 HydrophobicContact CE1-CE2 4.47Å
143	I	75.4	Confident	74.5	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-91.8	-35.4	178.2	-62.2	176.7	0	0	0	110.2	H106 L113 L132 I137 N140 V141 H145 P146 V147	H106-I143 HydrophobicContact CB-CD1 4.19Å; L113-I143 HydrophobicContact CD1-CG2 4.13Å; L132-I143 HydrophobicContact CD2-CD1 4.36Å; I137-I143 HydrophobicContact CG1-CG2 4.39Å; I137-I143 HydrophobicContact CG2-CG2 4.39Å; N140-I143 HydrophobicContact CB-CD1 4.49Å; N140-I143 PolarHBondContact O-N 3.42Å; V141-I143 PolarHBondContact O-N 3.05Å; I143-H145 PolarHBondContact O-N 3.28Å; I143-P146 VanDerWaalsContact O-CD 3.27Å; I143-P146 WeakPolarHBondContact O-CD 3.39Å; I143-V147 HydrophobicContact CG2-CG2 4.43Å; I143-V147 WeakPolarHBondContact O-CG2 3.42Å; I143-V147 PolarHBondContact O-N 3.06Å
144	R	79.8	Confident	75.4	Confident	156 Å²	156	64.5 Å²	64.5	59%	0.589	32%	0.324	S	S	*	.	H	α-helix	trans	-59.9	-35.1	176.7	-177.4	174.6	173.5	168.2	-0.8	112.6	N140 V147 S148	N140-R144 PolarHBondContact O-N 2.59Å; N140-R144 VanDerWaalsContact O-N 3.11Å; R144-V147 PolarHBondContact O-N 3.45Å; R144-S148 WeakPolarHBondContact O-CB 3.38Å; R144-S148 PolarHBondContact O-N 2.86Å; R144-S148 PolarHBondContact O-OG 3.42Å
145	H	79.8	Confident	76.4	Confident	20 Å²	20	66.1 Å²	66.1	9%	0.093	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-54.6	179.9	179.5	-77.1	0	0	0	112.5	V141 I143 V147 S148 L149 A164 N167	V141-H145 PolarHBondContact O-N 3.37Å; I143-H145 PolarHBondContact O-N 3.28Å; H145-V147 VanDerWaalsContact C-N 3.31Å; H145-V147 PolarHBondContact O-N 3.26Å; H145-S148 PolarHBondContact O-N 2.96Å; H145-L149 WeakPolarHBondContact O-CB 3.05Å; H145-L149 PolarHBondContact O-N 3.48Å; H145-A164 PolarHBondContact NE2-O 3.03Å; H145-N167 PolarHBondContact CD2-O 3.4Å
146	P	82.1	Confident	77.2	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-54.3	-41.2	172.3	-25.2	28.5	0	0	0	114.3	L113 L114 Y142 I143 L149 E150	L113-P146 HydrophobicContact CB-CB 4.02Å; L113-P146 HydrophobicContact CB-CG 4.49Å; L114-P146 HydrophobicContact CD1-CG 4.12Å; L114-P146 HydrophobicContact CD2-CB 4.37Å; L114-P146 HydrophobicContact CD2-CG 4.45Å; L114-P146 HydrophobicContact CG-CB 4.13Å; L114-P146 HydrophobicContact CG-CG 3.9Å; Y142-P146 WeakPolarHBondContact O-CD 3.43Å; Y142-P146 WeakPolarHBondContact O-CG 3.41Å; I143-P146 VanDerWaalsContact O-CD 3.27Å; I143-P146 WeakPolarHBondContact O-CD 3.39Å; P146-L149 WeakPolarHBondContact O-CB 3.17Å; P146-L149 PolarHBondContact O-N 3.25Å; P146-E150 WeakPolarHBondContact O-CB 3.44Å; P146-E150 PolarHBondContact O-N 2.87Å
147	V	82.9	Confident	77.8	Confident	34 Å²	34	59.9 Å²	59.9	21%	0.206	31%	0.305	C	S	.	.	H	α-helix	trans	-67.5	-43.7	179.5	176.8	0	0	0	0	111.6	F125 L129 I137 I143 R144 H145 L149 E150 Q151	F125-V147 HydrophobicContact CZ-CG2 4.48Å; L129-V147 HydrophobicContact CD1-CG1 4.49Å; L129-V147 HydrophobicContact CD1-CG2 3.9Å; I137-V147 HydrophobicContact CG2-CG2 4.45Å; I143-V147 HydrophobicContact CG2-CG2 4.43Å; I143-V147 WeakPolarHBondContact O-CG2 3.42Å; I143-V147 PolarHBondContact O-N 3.06Å; R144-V147 PolarHBondContact O-N 3.45Å; H145-V147 VanDerWaalsContact C-N 3.31Å; H145-V147 PolarHBondContact O-N 3.26Å; V147-L149 VanDerWaalsContact C-N 3.29Å; V147-L149 PolarHBondContact O-N 3.25Å; V147-E150 PolarHBondContact O-N 3.31Å; V147-Q151 PolarHBondContact O-N 3.46Å
148	S	82.1	Confident	78.4	Confident	27 Å²	27	61.1 Å²	61.1	19%	0.189	31%	0.309	C	S	.	.	H	α-helix	trans	-66.3	-36.7	177.2	-52.2	0	0	0	0	111.1	R144 H145 Q151 Y152	R144-S148 WeakPolarHBondContact O-CB 3.38Å; R144-S148 PolarHBondContact O-N 2.86Å; R144-S148 PolarHBondContact O-OG 3.42Å; H145-S148 PolarHBondContact O-N 2.96Å; S148-Q151 PolarHBondContact O-N 3.24Å; S148-Y152 WeakPolarHBondContact O-CD2 3.46Å; S148-Y152 PolarHBondContact O-N 2.91Å
149	L	82.3	Confident	79.1	Confident	6 Å²	6	58.7 Å²	58.7	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-63.9	-44.1	176.6	-170.4	71.8	0	0	0	111.6	L114 H145 P146 V147 Y152 L153 V161 A164 I177 L180	L114-L149 HydrophobicContact CD2-CD2 3.64Å; H145-L149 WeakPolarHBondContact O-CB 3.05Å; H145-L149 PolarHBondContact O-N 3.48Å; P146-L149 WeakPolarHBondContact O-CB 3.17Å; P146-L149 PolarHBondContact O-N 3.25Å; V147-L149 VanDerWaalsContact C-N 3.29Å; V147-L149 PolarHBondContact O-N 3.25Å; L149-Y152 PolarHBondContact O-N 2.98Å; L149-L153 PolarHBondContact O-N 2.61Å; L149-V161 HydrophobicContact CD1-CB 4.34Å; L149-V161 HydrophobicContact CD1-CG1 3.85Å; L149-V161 HydrophobicContact CD1-CG2 4.34Å; L149-A164 HydrophobicContact CD1-CB 4.21Å; L149-I177 HydrophobicContact CD2-CD1 3.41Å; L149-I177 VanDerWaalsContact CD2-CD1 3.41Å; L149-L180 HydrophobicContact CD2-CD2 4.01Å
150	E	83.5	Confident	79.4	Confident	9 Å²	9	57.2 Å²	57.2	4%	0.042	28%	0.284	C	S	.	.	H	α-helix	trans	-63	-44	175.7	-168.2	-80.5	148	0	0	111.3	L117 F125 H126 P146 V147 Y152 L153 M154	L117-E150 HydrophobicContact CD1-CB 4.03Å; L117-E150 HydrophobicContact CD1-CG 4.47Å; L117-E150 HydrophobicContact CD2-CB 3.99Å; L117-E150 HydrophobicContact CD2-CG 3.52Å; F125-E150 HydrophobicContact CD1-CG 4.05Å; F125-E150 HydrophobicContact CE1-CB 4.01Å; F125-E150 HydrophobicContact CE1-CG 3.61Å; F125-E150 HydrophobicContact CZ-CB 3.82Å; F125-E150 HydrophobicContact CZ-CG 3.89Å; H126-E150 IonicContact CE1-OE1 3.92Å; H126-E150 IonicContact CE1-OE2 2.75Å; H126-E150 IonicContact NE2-OE1 3.92Å; P146-E150 WeakPolarHBondContact O-CB 3.44Å; P146-E150 PolarHBondContact O-N 2.87Å; V147-E150 PolarHBondContact O-N 3.31Å; E150-Y152 VanDerWaalsContact C-N 3.33Å; E150-Y152 PolarHBondContact O-N 2.9Å; E150-L153 WeakPolarHBondContact O-CA 3.46Å; E150-L153 WeakPolarHBondContact O-CB 2.95Å; E150-L153 PolarHBondContact O-N 2.96Å; E150-L153 VanDerWaalsContact O-N 3.08Å; E150-M154 PolarHBondContact O-N 3.12Å; E150-M154 WeakPolarHBondContact OE1-CE 3.48Å; E150-M154 VanDerWaalsContact OE1-CG 3.28Å; E150-M154 WeakPolarHBondContact OE1-CG 3.41Å; E150-M154 WeakPolarHBondContact OE2-CE 3.37Å
151	Q	85.3	Confident	79.8	Confident	94 Å²	94	55.9 Å²	55.9	44%	0.439	28%	0.277	S	S	.	.	H	α-helix	trans	-59	-43.2	173.1	-175.7	-178	-15.5	0	0	112.2	V147 S148 L153 M154 E155	V147-Q151 PolarHBondContact O-N 3.46Å; S148-Q151 PolarHBondContact O-N 3.24Å; Q151-L153 VanDerWaalsContact C-N 3.26Å; Q151-L153 PolarHBondContact O-N 2.93Å; Q151-M154 PolarHBondContact O-N 3.15Å; Q151-E155 HydrophobicContact CG-CG 4.49Å; Q151-E155 PolarHBondContact NE2-OE1 3.35Å; Q151-E155 WeakPolarHBondContact O-CB 3.47Å; Q151-E155 WeakPolarHBondContact O-CG 3.27Å; Q151-E155 PolarHBondContact O-N 3.08Å
152	Y	84.3	Confident	79.7	Confident	61 Å²	61	53.2 Å²	53.2	24%	0.239	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-31.7	176.7	-59.5	-31.1	0	0	0	112.7	S148 L149 E150 G156 S157 K160 A164	S148-Y152 WeakPolarHBondContact O-CD2 3.46Å; S148-Y152 PolarHBondContact O-N 2.91Å; L149-Y152 PolarHBondContact O-N 2.98Å; E150-Y152 VanDerWaalsContact C-N 3.33Å; E150-Y152 PolarHBondContact O-N 2.9Å; Y152-G156 PolarHBondContact O-N 3.3Å; Y152-G156 VanDerWaalsContact O-N 3.15Å; Y152-S157 PolarHBondContact O-N 3.4Å; Y152-K160 HydrophobicContact CD1-CB 4.04Å; Y152-K160 HydrophobicContact CD1-CD 3.67Å; Y152-K160 HydrophobicContact CD2-CB 3.81Å; Y152-K160 HydrophobicContact CE1-CB 4.24Å; Y152-K160 HydrophobicContact CE1-CD 3.56Å; Y152-K160 HydrophobicContact CE2-CB 4.02Å; Y152-K160 HydrophobicContact CG-CB 3.83Å; Y152-K160 HydrophobicContact CG-CD 4.32Å; Y152-A164 HydrophobicContact CE2-CB 4.47Å
153	L	82.2	Confident	79.8	Confident	52 Å²	52	55.8 Å²	55.8	27%	0.272	28%	0.276	S	S	.	.	H	α-helix	trans	-68.1	-43.7	173.6	-174.5	64.4	0	0	0	111	L149 E150 Q151 G156 Y158 I184	L149-L153 PolarHBondContact O-N 2.61Å; E150-L153 WeakPolarHBondContact O-CA 3.46Å; E150-L153 WeakPolarHBondContact O-CB 2.95Å; E150-L153 PolarHBondContact O-N 2.96Å; E150-L153 VanDerWaalsContact O-N 3.08Å; Q151-L153 VanDerWaalsContact C-N 3.26Å; Q151-L153 PolarHBondContact O-N 2.93Å; L153-G156 PolarHBondContact O-N 3.35Å; L153-G156 VanDerWaalsContact O-N 3.1Å; L153-Y158 HydrophobicContact CD1-CE1 4.26Å; L153-I184 HydrophobicContact CD1-CD1 3.88Å; L153-I184 HydrophobicContact CD1-CG1 3.82Å
154	M	83.1	Confident	79.5	Confident	123 Å²	123	56.5 Å²	56.5	61%	0.606	28%	0.282	S	S	*	.	H	α-helix	trans	-63.4	-39.9	173.9	-76.3	-156.3	-93.4	0	0	113	E150 Q151 G156	E150-M154 PolarHBondContact O-N 3.12Å; E150-M154 WeakPolarHBondContact OE1-CE 3.48Å; E150-M154 VanDerWaalsContact OE1-CG 3.28Å; E150-M154 WeakPolarHBondContact OE1-CG 3.41Å; E150-M154 WeakPolarHBondContact OE2-CE 3.37Å; Q151-M154 PolarHBondContact O-N 3.15Å; M154-G156 PolarHBondContact O-N 2.75Å
155	E	81.6	Confident	78.9	Confident	98 Å²	98	52.5 Å²	52.5	46%	0.458	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-14.3	174.8	-73	176.3	-168.2	0	0	112.5	Q151 S157 K160	Q151-E155 HydrophobicContact CG-CG 4.49Å; Q151-E155 PolarHBondContact NE2-OE1 3.35Å; Q151-E155 WeakPolarHBondContact O-CB 3.47Å; Q151-E155 WeakPolarHBondContact O-CG 3.27Å; Q151-E155 PolarHBondContact O-N 3.08Å; E155-S157 PolarHBondContact O-N 2.72Å; E155-K160 IonicContact OE2-NZ 2.73Å; E155-K160 PolarHBondContact OE2-NZ 3.25Å
156	G	78.4	Confident	78.1	Confident	34 Å²	34	55.1 Å²	55.1	35%	0.351	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	18.7	-171	0	0	0	0	0	113.3	Y152 L153 M154 Y158	Y152-G156 PolarHBondContact O-N 3.3Å; Y152-G156 VanDerWaalsContact O-N 3.15Å; L153-G156 PolarHBondContact O-N 3.35Å; L153-G156 VanDerWaalsContact O-N 3.1Å; M154-G156 PolarHBondContact O-N 2.75Å; G156-Y158 VanDerWaalsContact O-CD2 3.27Å; G156-Y158 WeakPolarHBondContact O-CD2 3.34Å; G156-Y158 WeakPolarHBondContact O-CE2 3.49Å; G156-Y158 PolarHBondContact O-N 3.14Å; G156-Y158 VanDerWaalsContact O-N 3.12Å
157	S	79.8	Confident	77.4	Confident	32 Å²	32	60.8 Å²	60.8	22%	0.224	33%	0.332	C	S	.	.			trans	-88.5	74.2	-175.6	-161.9	0	0	0	0	111.4	Y152 E155 N159 K160 V161	Y152-S157 PolarHBondContact O-N 3.4Å; E155-S157 PolarHBondContact O-N 2.72Å; S157-N159 VanDerWaalsContact C-N 3.27Å; S157-N159 PolarHBondContact O-N 3.33Å; S157-K160 PolarHBondContact O-N 3.46Å; S157-K160 VanDerWaalsContact O-N 3.14Å; S157-V161 PolarHBondContact O-N 3.19Å
158	Y	76.1	Confident	76.5	Confident	56 Å²	56	61 Å²	61	22%	0.22	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-29	-175.7	-56.1	-66.7	0	0	0	114	L153 G156 K160 V161 F162 I184 I188	L153-Y158 HydrophobicContact CD1-CE1 4.26Å; G156-Y158 VanDerWaalsContact O-CD2 3.27Å; G156-Y158 WeakPolarHBondContact O-CD2 3.34Å; G156-Y158 WeakPolarHBondContact O-CE2 3.49Å; G156-Y158 PolarHBondContact O-N 3.14Å; G156-Y158 VanDerWaalsContact O-N 3.12Å; Y158-K160 PolarHBondContact O-N 3.26Å; Y158-V161 WeakPolarHBondContact O-CB 3.32Å; Y158-V161 PolarHBondContact O-N 3.09Å; Y158-V161 VanDerWaalsContact O-N 3.11Å; Y158-F162 WeakPolarHBondContact O-CD2 3.4Å; Y158-F162 PolarHBondContact O-N 2.93Å; Y158-I184 HydrophobicContact CD1-CG2 3.42Å; Y158-I184 VanDerWaalsContact CD1-CG2 3.42Å; Y158-I184 HydrophobicContact CE1-CG2 3.49Å; Y158-I184 VanDerWaalsContact CE1-CG2 3.49Å; Y158-I184 HydrophobicContact CG-CG2 4.44Å; Y158-I188 HydrophobicContact CD1-CD1 3.74Å; Y158-I188 HydrophobicContact CD1-CG1 4.09Å; Y158-I188 HydrophobicContact CD2-CD1 3.75Å; Y158-I188 HydrophobicContact CD2-CG1 3.74Å; Y158-I188 HydrophobicContact CE1-CD1 4.02Å; Y158-I188 HydrophobicContact CE1-CG1 3.87Å; Y158-I188 HydrophobicContact CE2-CD1 4.04Å; Y158-I188 HydrophobicContact CE2-CG1 3.5Å; Y158-I188 VanDerWaalsContact CE2-CG1 3.5Å; Y158-I188 HydrophobicContact CG-CD1 3.57Å; Y158-I188 HydrophobicContact CG-CG1 4.02Å
159	N	78.1	Confident	75.3	Confident	105 Å²	105	62.2 Å²	62.2	56%	0.561	34%	0.339	S	S	*	.	H	α-helix	trans	-55.8	-41.8	175.1	-63.6	-15.6	0	0	0	111.6	S157 L163 F209	S157-N159 VanDerWaalsContact C-N 3.27Å; S157-N159 PolarHBondContact O-N 3.33Å; N159-L163 WeakPolarHBondContact O-CG 3.31Å; N159-L163 PolarHBondContact O-N 2.99Å; N159-L163 VanDerWaalsContact O-N 3.15Å; N159-F209 VanDerWaalsContact OD1-CZ 3.27Å; N159-F209 WeakPolarHBondContact OD1-CZ 3.25Å
160	K	76.1	Confident	74.3	Confident	87 Å²	87	62.7 Å²	62.7	38%	0.378	34%	0.344	S	S	.	.	H	α-helix	trans	-73.9	-33.9	179.1	-64.6	-178.2	-171.6	168.3	0	111.9	Y152 E155 S157 Y158 F162 L163 A164	Y152-K160 HydrophobicContact CD1-CB 4.04Å; Y152-K160 HydrophobicContact CD1-CD 3.67Å; Y152-K160 HydrophobicContact CD2-CB 3.81Å; Y152-K160 HydrophobicContact CE1-CB 4.24Å; Y152-K160 HydrophobicContact CE1-CD 3.56Å; Y152-K160 HydrophobicContact CE2-CB 4.02Å; Y152-K160 HydrophobicContact CG-CB 3.83Å; Y152-K160 HydrophobicContact CG-CD 4.32Å; E155-K160 IonicContact OE2-NZ 2.73Å; E155-K160 PolarHBondContact OE2-NZ 3.25Å; S157-K160 PolarHBondContact O-N 3.46Å; S157-K160 VanDerWaalsContact O-N 3.14Å; Y158-K160 PolarHBondContact O-N 3.26Å; K160-F162 VanDerWaalsContact C-N 3.35Å; K160-L163 PolarHBondContact O-N 3.44Å; K160-A164 VanDerWaalsContact O-CB 3.31Å; K160-A164 WeakPolarHBondContact O-CB 3.33Å; K160-A164 PolarHBondContact O-N 3.37Å
161	V	77.1	Confident	73.4	Confident	4 Å²	4	70.9 Å²	70.9	2%	0.024	38%	0.382	C	S	.	.	H	α-helix	trans	-59.5	-45.7	173.4	174	0	0	0	0	110.6	L149 S157 Y158 A164 K165 L181 I184	L149-V161 HydrophobicContact CD1-CB 4.34Å; L149-V161 HydrophobicContact CD1-CG1 3.85Å; L149-V161 HydrophobicContact CD1-CG2 4.34Å; S157-V161 PolarHBondContact O-N 3.19Å; Y158-V161 WeakPolarHBondContact O-CB 3.32Å; Y158-V161 PolarHBondContact O-N 3.09Å; Y158-V161 VanDerWaalsContact O-N 3.11Å; V161-A164 WeakPolarHBondContact O-CB 3.25Å; V161-A164 PolarHBondContact O-N 3.42Å; V161-K165 PolarHBondContact O-N 2.93Å; V161-K165 VanDerWaalsContact O-N 3.15Å; V161-L181 HydrophobicContact CG1-CD2 4.13Å; V161-I184 HydrophobicContact CG1-CD1 4Å
162	F	72.9	Confident	72.6	Confident	39 Å²	39	68 Å²	68	17%	0.171	37%	0.372	C	S	.	.	H	α-helix	trans	-67.7	-35.7	177	-82.3	-79.2	0	0	0	113	Y158 K160 K165 L181 F209	Y158-F162 WeakPolarHBondContact O-CD2 3.4Å; Y158-F162 PolarHBondContact O-N 2.93Å; K160-F162 VanDerWaalsContact C-N 3.35Å; F162-K165 VanDerWaalsContact O-CB 3.23Å; F162-K165 WeakPolarHBondContact O-CB 3.43Å; F162-K165 PolarHBondContact O-N 3.09Å; F162-L181 HydrophobicContact CD1-CD2 4.27Å; F162-L181 HydrophobicContact CE1-CD1 4.47Å; F162-L181 HydrophobicContact CE1-CD2 3.83Å; F162-L181 HydrophobicContact CE2-CD2 4.33Å; F162-L181 HydrophobicContact CZ-CD2 3.87Å; F162-F209 HydrophobicContact CD1-CB 4.39Å; F162-F209 HydrophobicContact CD1-CG 4.44Å; F162-F209 HydrophobicContact CD2-CB 4.48Å; F162-F209 HydrophobicContact CD2-CD1 4.49Å; F162-F209 AromaticContact CD2-CD2 3.44Å; F162-F209 HydrophobicContact CD2-CD2 3.44Å; F162-F209 VanDerWaalsContact CD2-CD2 3.44Å; F162-F209 AromaticContact CD2-CE2 3.66Å; F162-F209 HydrophobicContact CD2-CE2 3.66Å; F162-F209 AromaticContact CD2-CG 3.89Å; F162-F209 HydrophobicContact CD2-CG 3.89Å; F162-F209 HydrophobicContact CD2-CZ 4.29Å; F162-F209 HydrophobicContact CE1-CB 3.94Å; F162-F209 HydrophobicContact CE1-CG 4.33Å; F162-F209 HydrophobicContact CE2-CB 4.07Å; F162-F209 AromaticContact CE2-CD2 3.23Å; F162-F209 HydrophobicContact CE2-CD2 3.23Å; F162-F209 AromaticContact CE2-CE2 3.84Å; F162-F209 HydrophobicContact CE2-CE2 3.84Å; F162-F209 AromaticContact CE2-CG 3.8Å; F162-F209 HydrophobicContact CE2-CG 3.8Å; F162-F209 HydrophobicContact CG-CD2 4.22Å; F162-F209 HydrophobicContact CG-CG 4.23Å; F162-F209 HydrophobicContact CZ-CB 3.77Å; F162-F209 AromaticContact CZ-CD2 3.85Å; F162-F209 HydrophobicContact CZ-CD2 3.85Å; F162-F209 HydrophobicContact CZ-CG 4.03Å
163	L	73.5	Confident	71.9	Confident	133 Å²	133	65.2 Å²	65.2	70%	0.696	36%	0.361	S	S	*	.	H	α-helix	trans	-68	-36.1	172.5	-70	170.6	0	0	0	112	N159 K160 K165 G166	N159-L163 WeakPolarHBondContact O-CG 3.31Å; N159-L163 PolarHBondContact O-N 2.99Å; N159-L163 VanDerWaalsContact O-N 3.15Å; K160-L163 PolarHBondContact O-N 3.44Å; L163-K165 PolarHBondContact O-N 3.02Å; L163-G166 PolarHBondContact O-N 3.19Å
164	A	69.1	Low	71.6	Confident	15 Å²	15	65 Å²	65	12%	0.124	36%	0.362	C	S	.	.	H	α-helix	trans	-66.1	-22.5	175.5	0	0	0	0	0	112.6	H145 L149 Y152 K160 V161 G166 N167	H145-A164 PolarHBondContact NE2-O 3.03Å; L149-A164 HydrophobicContact CD1-CB 4.21Å; Y152-A164 HydrophobicContact CE2-CB 4.47Å; K160-A164 VanDerWaalsContact O-CB 3.31Å; K160-A164 WeakPolarHBondContact O-CB 3.33Å; K160-A164 PolarHBondContact O-N 3.37Å; V161-A164 WeakPolarHBondContact O-CB 3.25Å; V161-A164 PolarHBondContact O-N 3.42Å; A164-G166 VanDerWaalsContact C-N 3.27Å; A164-G166 PolarHBondContact O-N 3.29Å; A164-N167 PolarHBondContact O-N 2.89Å
165	K	66.1	Low	71.3	Confident	72 Å²	72	61.4 Å²	61.4	31%	0.313	34%	0.343	S	S	.	.	H	α-helix	trans	-62.8	-31.2	166.7	-168.3	-172.9	-174.1	153.6	0	112.3	V161 F162 L163 N167 I168 I177 D178 L181	V161-K165 PolarHBondContact O-N 2.93Å; V161-K165 VanDerWaalsContact O-N 3.15Å; F162-K165 VanDerWaalsContact O-CB 3.23Å; F162-K165 WeakPolarHBondContact O-CB 3.43Å; F162-K165 PolarHBondContact O-N 3.09Å; L163-K165 PolarHBondContact O-N 3.02Å; K165-N167 VanDerWaalsContact C-N 3.26Å; K165-N167 PolarHBondContact O-N 3.46Å; K165-I168 HydrophobicContact CG-CD1 3.99Å; K165-I168 WeakPolarHBondContact O-CD1 3.35Å; K165-I168 WeakPolarHBondContact O-CG1 3.31Å; K165-I177 HydrophobicContact CG-CG2 4.15Å; K165-D178 IonicContact NZ-OD1 3.99Å; K165-D178 PolarHBondContact NZ-OD1 3.46Å; K165-L181 HydrophobicContact CD-CD1 3.77Å
166	G	63.4	Low	71	Confident	76 Å²	76	57 Å²	57	78%	0.784	32%	0.322	S	S	*	.	H	α-helix	trans	-72.7	-20.4	176.7	0	0	0	0	0	113.6	L163 A164	L163-G166 PolarHBondContact O-N 3.19Å; A164-G166 VanDerWaalsContact C-N 3.27Å; A164-G166 PolarHBondContact O-N 3.29Å
167	N	66.9	Low	71	Confident	120 Å²	120	55.5 Å²	55.5	64%	0.642	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.3	43.5	-173.2	-163.7	19.9	0	0	0	112	H145 A164 K165 P169	H145-N167 PolarHBondContact CD2-O 3.4Å; A164-N167 PolarHBondContact O-N 2.89Å; K165-N167 VanDerWaalsContact C-N 3.26Å; K165-N167 PolarHBondContact O-N 3.46Å; N167-P169 VanDerWaalsContact O-CD 3.31Å; N167-P169 WeakPolarHBondContact O-CD 3.39Å
168	I	64	Low	71.1	Confident	39 Å²	39	57 Å²	57	20%	0.2	31%	0.312	C	S	.	.			trans	-87.4	117.2	-178.9	-61.8	159.2	0	0	0	109	K165 A170 Y173	K165-I168 HydrophobicContact CG-CD1 3.99Å; K165-I168 WeakPolarHBondContact O-CD1 3.35Å; K165-I168 WeakPolarHBondContact O-CG1 3.31Å; I168-A170 WeakPolarHBondContact CG2-O 3.43Å; I168-Y173 HydrophobicContact CG2-CD2 4.2Å
169	P	58.3	Low	71.4	Confident	52 Å²	52	56.8 Å²	56.8	34%	0.338	31%	0.314	S	S	.	.	S	Bend	trans	-83.8	-9.8	-177.5	31.4	-32.3	0	0	0	113.8	Y142 N167	Y142-P169 HydrophobicContact CD1-CB 4.07Å; Y142-P169 HydrophobicContact CD1-CG 3.59Å; Y142-P169 HydrophobicContact CE1-CB 3.55Å; Y142-P169 HydrophobicContact CE1-CG 3.61Å; N167-P169 VanDerWaalsContact O-CD 3.31Å; N167-P169 WeakPolarHBondContact O-CD 3.39Å
170	A	60.7	Low	71.5	Confident	16 Å²	16	52.2 Å²	52.2	13%	0.132	29%	0.289	C	S	.	.			trans	-143.8	137.3	175.3	0	0	0	0	0	114	Y142 I168 S172 Y173	Y142-A170 HydrophobicContact CE1-CB 4.29Å; I168-A170 WeakPolarHBondContact CG2-O 3.43Å; A170-S172 PolarHBondContact O-N 3.35Å; A170-Y173 HydrophobicContact CB-CD2 3.63Å; A170-Y173 HydrophobicContact CB-CE2 3.6Å; A170-Y173 WeakPolarHBondContact O-CB 3.36Å; A170-Y173 WeakPolarHBondContact O-CD2 3.39Å; A170-Y173 PolarHBondContact O-N 3.38Å
171	E	65	Low	71.6	Confident	180 Å²	180	48.1 Å²	48.1	84%	0.841	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-28.4	-176.3	-166.4	171.9	-177.9	0	0	113.6	Y173 T174	E171-Y173 PolarHBondContact O-N 3.32Å; E171-T174 WeakPolarHBondContact O-CB 3.41Å; E171-T174 PolarHBondContact O-N 3.15Å; E171-T174 PolarHBondContact O-OG1 3.47Å
172	S	68	Low	71.9	Confident	33 Å²	33	51.1 Å²	51.1	23%	0.231	29%	0.287	C	S	.	.	H	α-helix	trans	-65.3	-20.3	176.7	-50.2	0	0	0	0	113.7	A170	A170-S172 PolarHBondContact O-N 3.35Å
173	Y	70.7	Confident	72.4	Confident	3 Å²	3	51.8 Å²	51.8	1%	0.012	30%	0.295	C	S	.	.	H	α-helix	trans	-80	-26.3	178	-63.1	-52.5	0	0	0	113.1	Q107 L111 L114 Y142 I168 A170 E171 F175 F176 I177	Q107-Y173 WeakPolarHBondContact CA-OH 3.34Å; Q107-Y173 WeakPolarHBondContact CG-OH 3.06Å; Q107-Y173 PolarHBondContact O-OH 3.14Å; L111-Y173 HydrophobicContact CB-CE1 4.17Å; L111-Y173 HydrophobicContact CD1-CE1 4.48Å; L111-Y173 HydrophobicContact CD2-CD1 3.71Å; L111-Y173 HydrophobicContact CD2-CE1 3.87Å; L111-Y173 HydrophobicContact CG-CD1 3.88Å; L111-Y173 HydrophobicContact CG-CE1 3.46Å; L111-Y173 VanDerWaalsContact CG-CE1 3.46Å; L114-Y173 HydrophobicContact CD1-CD1 3.15Å; L114-Y173 HydrophobicContact CD1-CE1 3.64Å; L114-Y173 HydrophobicContact CD1-CG 3.82Å; Y142-Y173 AromaticContact CD1-CE2 3.87Å; Y142-Y173 HydrophobicContact CD1-CE2 3.87Å; Y142-Y173 HydrophobicContact CE1-CE2 4.47Å; I168-Y173 HydrophobicContact CG2-CD2 4.2Å; A170-Y173 HydrophobicContact CB-CD2 3.63Å; A170-Y173 HydrophobicContact CB-CE2 3.6Å; A170-Y173 WeakPolarHBondContact O-CB 3.36Å; A170-Y173 WeakPolarHBondContact O-CD2 3.39Å; A170-Y173 PolarHBondContact O-N 3.38Å; E171-Y173 PolarHBondContact O-N 3.32Å; Y173-F175 PolarHBondContact O-N 2.84Å; Y173-F176 PolarHBondContact O-N 3.48Å; Y173-I177 WeakPolarHBondContact O-CG1 3.22Å; Y173-I177 PolarHBondContact O-N 2.67Å
174	T	75.6	Confident	72.7	Confident	49 Å²	49	45.8 Å²	45.8	30%	0.301	26%	0.264	S	S	.	.	H	α-helix	trans	-55.9	-40.6	-177	-53.1	0	0	0	0	111.5	E171 I177 D178	E171-T174 WeakPolarHBondContact O-CB 3.41Å; E171-T174 PolarHBondContact O-N 3.15Å; E171-T174 PolarHBondContact O-OG1 3.47Å; T174-I177 PolarHBondContact O-N 2.74Å; T174-D178 VanDerWaalsContact O-CG 3.3Å; T174-D178 PolarHBondContact O-N 3.45Å
175	F	76.6	Confident	73.3	Confident	46 Å²	46	47.3 Å²	47.3	20%	0.202	27%	0.266	C	S	.	.	H	α-helix	trans	-61.2	-48.1	179.8	178.3	-110	0	0	0	113.2	K76 Y173 D178 I179	K76-F175 HydrophobicContact CB-CE1 4.16Å; K76-F175 HydrophobicContact CB-CE2 4.18Å; K76-F175 HydrophobicContact CB-CZ 3.61Å; K76-F175 HydrophobicContact CD-CD2 4.11Å; K76-F175 HydrophobicContact CD-CE2 3.35Å; K76-F175 HydrophobicContact CD-CZ 3.71Å; K76-F175 HydrophobicContact CG-CD2 4.18Å; K76-F175 HydrophobicContact CG-CE1 4.07Å; K76-F175 HydrophobicContact CG-CE2 3.55Å; K76-F175 HydrophobicContact CG-CZ 3.47Å; K76-F175 VanDerWaalsContact CG-CZ 3.47Å; Y173-F175 PolarHBondContact O-N 2.84Å; F175-D178 PolarHBondContact O-N 3.43Å; F175-I179 HydrophobicContact CD1-CD1 4.25Å; F175-I179 HydrophobicContact CE1-CD1 3.64Å; F175-I179 HydrophobicContact CE2-CD1 4.11Å; F175-I179 HydrophobicContact CZ-CD1 3.57Å; F175-I179 PolarHBondContact O-N 3.18Å
176	F	75.3	Confident	74.1	Confident	5 Å²	5	46.9 Å²	46.9	2%	0.022	27%	0.267	C	S	.	.	H	α-helix	trans	-71.9	-34.3	179.6	-70.6	-68	0	0	0	112.3	I73 F81 L111 L114 F115 Y173 D178 I179 L180	I73-F176 HydrophobicContact CB-CE2 4.46Å; I73-F176 HydrophobicContact CD1-CE2 4.16Å; I73-F176 HydrophobicContact CG1-CE2 3.85Å; I73-F176 HydrophobicContact CG1-CZ 4.09Å; I73-F176 HydrophobicContact CG2-CE2 3.81Å; I73-F176 HydrophobicContact CG2-CZ 4.4Å; F81-F176 HydrophobicContact CD1-CZ 4.48Å; F81-F176 HydrophobicContact CE1-CZ 4.48Å; L111-F176 HydrophobicContact CD2-CD2 3.78Å; L111-F176 HydrophobicContact CD2-CE2 3.74Å; L114-F176 HydrophobicContact CB-CB 4.37Å; F115-F176 HydrophobicContact CB-CE1 4.39Å; F115-F176 HydrophobicContact CD2-CD1 4.34Å; F115-F176 AromaticContact CD2-CE1 3.67Å; F115-F176 HydrophobicContact CD2-CE1 3.67Å; F115-F176 HydrophobicContact CD2-CZ 4.28Å; F115-F176 HydrophobicContact CE2-CE1 4.47Å; Y173-F176 PolarHBondContact O-N 3.48Å; F176-D178 VanDerWaalsContact C-N 3.34Å; F176-I179 PolarHBondContact O-N 2.88Å; F176-L180 WeakPolarHBondContact O-CB 3.45Å; F176-L180 PolarHBondContact O-N 2.76Å
177	I	78.5	Confident	75	Confident	4 Å²	4	48.3 Å²	48.3	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-64.4	-40.2	174.8	-69.1	-67.8	0	0	0	110.9	L114 L149 K165 Y173 T174 I179 L180 L181	L114-I177 HydrophobicContact CD2-CD1 3.72Å; L149-I177 HydrophobicContact CD2-CD1 3.41Å; L149-I177 VanDerWaalsContact CD2-CD1 3.41Å; K165-I177 HydrophobicContact CG-CG2 4.15Å; Y173-I177 WeakPolarHBondContact O-CG1 3.22Å; Y173-I177 PolarHBondContact O-N 2.67Å; T174-I177 PolarHBondContact O-N 2.74Å; I177-I179 PolarHBondContact O-N 3.15Å; I177-L180 PolarHBondContact O-N 3.14Å; I177-L181 HydrophobicContact CG2-CD1 3.84Å; I177-L181 HydrophobicContact CG2-CG 4.18Å; I177-L181 WeakPolarHBondContact O-CB 3.47Å; I177-L181 WeakPolarHBondContact O-CG 3.45Å; I177-L181 PolarHBondContact O-N 3.09Å
178	D	80.4	Confident	75.7	Confident	62 Å²	62	43 Å²	43	33%	0.332	23%	0.225	S	C	.	.	H	α-helix	trans	-64.6	-40.8	178	-72.4	-29.7	0	0	0	111.9	K165 T174 F175 F176 L181 D182	K165-D178 IonicContact NZ-OD1 3.99Å; K165-D178 PolarHBondContact NZ-OD1 3.46Å; T174-D178 VanDerWaalsContact O-CG 3.3Å; T174-D178 PolarHBondContact O-N 3.45Å; F175-D178 PolarHBondContact O-N 3.43Å; F176-D178 VanDerWaalsContact C-N 3.34Å; D178-L181 PolarHBondContact O-N 3.38Å; D178-D182 PolarHBondContact O-N 3.42Å; D178-D182 VanDerWaalsContact O-N 3.14Å
179	I	82.4	Confident	76.4	Confident	53 Å²	53	41.3 Å²	41.3	27%	0.272	22%	0.217	S	C	.	.	H	α-helix	trans	-61.3	-47.8	173.1	-64.1	169.1	0	0	0	110.7	F175 F176 I177 L181 D182 T183	F175-I179 HydrophobicContact CD1-CD1 4.25Å; F175-I179 HydrophobicContact CE1-CD1 3.64Å; F175-I179 HydrophobicContact CE2-CD1 4.11Å; F175-I179 HydrophobicContact CZ-CD1 3.57Å; F175-I179 PolarHBondContact O-N 3.18Å; F176-I179 PolarHBondContact O-N 2.88Å; I177-I179 PolarHBondContact O-N 3.15Å; I179-L181 VanDerWaalsContact C-N 3.29Å; I179-L181 PolarHBondContact O-N 2.92Å; I179-D182 PolarHBondContact O-N 3.09Å; I179-D182 VanDerWaalsContact O-N 3.15Å; I179-T183 PolarHBondContact O-N 3.28Å; I179-T183 VanDerWaalsContact O-N 3.11Å; I179-T183 PolarHBondContact O-OG1 2.71Å
180	L	80.3	Confident	77.5	Confident	8 Å²	8	39.7 Å²	39.7	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-61.6	-38	179.4	-178.1	120.6	0	0	0	111.7	L117 L149 F176 I177 D182 T183 I184	L117-L180 HydrophobicContact CB-CD1 3.58Å; L149-L180 HydrophobicContact CD2-CD2 4.01Å; F176-L180 WeakPolarHBondContact O-CB 3.45Å; F176-L180 PolarHBondContact O-N 2.76Å; I177-L180 PolarHBondContact O-N 3.14Å; L180-D182 VanDerWaalsContact C-N 3.32Å; L180-D182 PolarHBondContact O-N 3.33Å; L180-T183 PolarHBondContact O-N 3.21Å; L180-I184 HydrophobicContact CD2-CD1 3.45Å; L180-I184 VanDerWaalsContact CD2-CD1 3.45Å; L180-I184 HydrophobicContact CD2-CG1 4.48Å; L180-I184 HydrophobicContact CG-CD1 3.92Å; L180-I184 HydrophobicContact CG-CG1 4.47Å; L180-I184 WeakPolarHBondContact O-CB 3.29Å; L180-I184 VanDerWaalsContact O-CG1 3.25Å; L180-I184 WeakPolarHBondContact O-CG1 3.49Å; L180-I184 PolarHBondContact O-N 3.25Å
181	L	79.5	Confident	78.5	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-65.3	-35.8	176.1	-74.4	170.6	0	0	0	112.2	V161 F162 K165 I177 D178 I179 I184 R185	V161-L181 HydrophobicContact CG1-CD2 4.13Å; F162-L181 HydrophobicContact CD1-CD2 4.27Å; F162-L181 HydrophobicContact CE1-CD1 4.47Å; F162-L181 HydrophobicContact CE1-CD2 3.83Å; F162-L181 HydrophobicContact CE2-CD2 4.33Å; F162-L181 HydrophobicContact CZ-CD2 3.87Å; K165-L181 HydrophobicContact CD-CD1 3.77Å; I177-L181 HydrophobicContact CG2-CD1 3.84Å; I177-L181 HydrophobicContact CG2-CG 4.18Å; I177-L181 WeakPolarHBondContact O-CB 3.47Å; I177-L181 WeakPolarHBondContact O-CG 3.45Å; I177-L181 PolarHBondContact O-N 3.09Å; D178-L181 PolarHBondContact O-N 3.38Å; I179-L181 VanDerWaalsContact C-N 3.29Å; I179-L181 PolarHBondContact O-N 2.92Å; L181-I184 PolarHBondContact O-N 3.3Å; L181-R185 WeakPolarHBondContact O-CB 3.07Å; L181-R185 VanDerWaalsContact O-CG 3.22Å; L181-R185 WeakPolarHBondContact O-CG 3.28Å; L181-R185 PolarHBondContact O-N 3.5Å
182	D	82.7	Confident	79.2	Confident	67 Å²	67	34.1 Å²	34.1	36%	0.358	19%	0.188	S	C	.	.	H	α-helix	trans	-66.3	-43.5	174.4	-74.1	-17.3	0	0	0	111.2	D178 I179 L180 I184 R185 D186	D178-D182 PolarHBondContact O-N 3.42Å; D178-D182 VanDerWaalsContact O-N 3.14Å; I179-D182 PolarHBondContact O-N 3.09Å; I179-D182 VanDerWaalsContact O-N 3.15Å; L180-D182 VanDerWaalsContact C-N 3.32Å; L180-D182 PolarHBondContact O-N 3.33Å; D182-I184 PolarHBondContact O-N 3.32Å; D182-R185 WeakPolarHBondContact O-CB 3.48Å; D182-R185 PolarHBondContact O-N 3.32Å; D182-R185 IonicContact OD1-CZ 2.72Å; D182-R185 IonicContact OD1-NH1 3.4Å; D182-R185 PolarHBondContact OD1-NH1 3.41Å; D182-D186 PolarHBondContact O-N 3.15Å; D182-D186 VanDerWaalsContact O-N 3.08Å
183	T	82.7	Confident	79.6	Confident	53 Å²	53	35.3 Å²	35.3	33%	0.325	19%	0.19	S	C	.	.	H	α-helix	trans	-62.5	-42.1	173.7	-48.7	0	0	0	0	112.2	I179 L180 R185 D186 E187	I179-T183 PolarHBondContact O-N 3.28Å; I179-T183 VanDerWaalsContact O-N 3.11Å; I179-T183 PolarHBondContact O-OG1 2.71Å; L180-T183 PolarHBondContact O-N 3.21Å; T183-R185 VanDerWaalsContact C-N 3.34Å; T183-R185 PolarHBondContact O-N 3.31Å; T183-D186 WeakPolarHBondContact O-CB 3.39Å; T183-D186 PolarHBondContact O-N 3.47Å; T183-E187 PolarHBondContact O-N 3.49Å
184	I	81.3	Confident	80.1	Confident	8 Å²	8	43 Å²	43	4%	0.041	22%	0.224	C	C	.	.	H	α-helix	trans	-63.4	-40.7	176.7	-74.8	171.4	0	0	0	111.1	L153 Y158 V161 L180 L181 D182 D186 E187 I188	L153-I184 HydrophobicContact CD1-CD1 3.88Å; L153-I184 HydrophobicContact CD1-CG1 3.82Å; Y158-I184 HydrophobicContact CD1-CG2 3.42Å; Y158-I184 VanDerWaalsContact CD1-CG2 3.42Å; Y158-I184 HydrophobicContact CE1-CG2 3.49Å; Y158-I184 VanDerWaalsContact CE1-CG2 3.49Å; Y158-I184 HydrophobicContact CG-CG2 4.44Å; V161-I184 HydrophobicContact CG1-CD1 4Å; L180-I184 HydrophobicContact CD2-CD1 3.45Å; L180-I184 VanDerWaalsContact CD2-CD1 3.45Å; L180-I184 HydrophobicContact CD2-CG1 4.48Å; L180-I184 HydrophobicContact CG-CD1 3.92Å; L180-I184 HydrophobicContact CG-CG1 4.47Å; L180-I184 WeakPolarHBondContact O-CB 3.29Å; L180-I184 VanDerWaalsContact O-CG1 3.25Å; L180-I184 WeakPolarHBondContact O-CG1 3.49Å; L180-I184 PolarHBondContact O-N 3.25Å; L181-I184 PolarHBondContact O-N 3.3Å; D182-I184 PolarHBondContact O-N 3.32Å; I184-D186 VanDerWaalsContact C-N 3.25Å; I184-D186 PolarHBondContact O-N 3.1Å; I184-E187 PolarHBondContact O-N 3.23Å; I184-I188 HydrophobicContact CG2-CD1 3.59Å; I184-I188 HydrophobicContact CG2-CG1 4.16Å; I184-I188 WeakPolarHBondContact O-CB 2.98Å; I184-I188 WeakPolarHBondContact O-CG1 3.42Å; I184-I188 PolarHBondContact O-N 2.89Å
185	R	81.7	Confident	80.3	Confident	46 Å²	46	44.2 Å²	44.2	17%	0.174	24%	0.238	C	C	.	.	H	α-helix	trans	-60.2	-39.3	174.8	-77.1	168.6	-179.3	141.7	0.7	111.4	L181 D182 T183 A189	L181-R185 WeakPolarHBondContact O-CB 3.07Å; L181-R185 VanDerWaalsContact O-CG 3.22Å; L181-R185 WeakPolarHBondContact O-CG 3.28Å; L181-R185 PolarHBondContact O-N 3.5Å; D182-R185 WeakPolarHBondContact O-CB 3.48Å; D182-R185 PolarHBondContact O-N 3.32Å; D182-R185 IonicContact OD1-CZ 2.72Å; D182-R185 IonicContact OD1-NH1 3.4Å; D182-R185 PolarHBondContact OD1-NH1 3.41Å; T183-R185 VanDerWaalsContact C-N 3.34Å; T183-R185 PolarHBondContact O-N 3.31Å; R185-A189 VanDerWaalsContact O-CB 3.31Å; R185-A189 WeakPolarHBondContact O-CB 3.31Å; R185-A189 PolarHBondContact O-N 3.31Å
186	D	82.3	Confident	80.3	Confident	64 Å²	64	48 Å²	48	34%	0.342	25%	0.253	S	S	.	.	H	α-helix	trans	-66.4	-40.1	177.3	-77.8	-30.3	0	0	0	112.7	D182 T183 I184 G190 R223	D182-D186 PolarHBondContact O-N 3.15Å; D182-D186 VanDerWaalsContact O-N 3.08Å; T183-D186 WeakPolarHBondContact O-CB 3.39Å; T183-D186 PolarHBondContact O-N 3.47Å; I184-D186 VanDerWaalsContact C-N 3.25Å; I184-D186 PolarHBondContact O-N 3.1Å; D186-G190 PolarHBondContact O-N 3.36Å; D186-R223 VanDerWaalsContact CA-NH2 3.32Å; D186-R223 PolarHBondContact O-NH2 3.43Å; D186-R223 IonicContact OD1-CZ 3.75Å; D186-R223 IonicContact OD1-NE 3.93Å; D186-R223 IonicContact OD1-NH2 2.75Å; D186-R223 PolarHBondContact OD1-NH2 3.06Å
187	E	81.7	Confident	80.1	Confident	106 Å²	106	53.3 Å²	53.3	50%	0.495	28%	0.275	S	S	.	.	H	α-helix	trans	-67.4	-45.1	173.7	-70.9	-62.1	147.5	0	0	111.9	T183 I184 A189 G190 C191	T183-E187 PolarHBondContact O-N 3.49Å; I184-E187 PolarHBondContact O-N 3.23Å; E187-A189 VanDerWaalsContact C-N 3.29Å; E187-A189 PolarHBondContact O-N 3.2Å; E187-G190 CarbonylContact O-C 3.6Å; E187-G190 PolarHBondContact O-N 3.35Å; E187-G190 VanDerWaalsContact O-N 3.11Å; E187-C191 PolarHBondContact O-N 3.27Å; E187-C191 PolarHBondContact O-SG 3.31Å
188	I	81.7	Confident	79.9	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.036	30%	0.303	C	S	.	.	H	α-helix	trans	-57.6	-45	175	-69.1	166.6	0	0	0	110	Y158 I184 G190 C191 I192 V207 L208	Y158-I188 HydrophobicContact CD1-CD1 3.74Å; Y158-I188 HydrophobicContact CD1-CG1 4.09Å; Y158-I188 HydrophobicContact CD2-CD1 3.75Å; Y158-I188 HydrophobicContact CD2-CG1 3.74Å; Y158-I188 HydrophobicContact CE1-CD1 4.02Å; Y158-I188 HydrophobicContact CE1-CG1 3.87Å; Y158-I188 HydrophobicContact CE2-CD1 4.04Å; Y158-I188 HydrophobicContact CE2-CG1 3.5Å; Y158-I188 VanDerWaalsContact CE2-CG1 3.5Å; Y158-I188 HydrophobicContact CG-CD1 3.57Å; Y158-I188 HydrophobicContact CG-CG1 4.02Å; I184-I188 HydrophobicContact CG2-CD1 3.59Å; I184-I188 HydrophobicContact CG2-CG1 4.16Å; I184-I188 WeakPolarHBondContact O-CB 2.98Å; I184-I188 WeakPolarHBondContact O-CG1 3.42Å; I184-I188 PolarHBondContact O-N 2.89Å; I188-G190 VanDerWaalsContact C-N 3.34Å; I188-G190 PolarHBondContact O-N 3.03Å; I188-C191 WeakPolarHBondContact O-CB 3.27Å; I188-C191 PolarHBondContact O-N 3.36Å; I188-I192 HydrophobicContact CG2-CD1 3.75Å; I188-I192 HydrophobicContact CG2-CG1 4.27Å; I188-I192 VanDerWaalsContact O-CG1 3.27Å; I188-I192 WeakPolarHBondContact O-CG1 3.29Å; I188-I192 PolarHBondContact O-N 3.47Å; I188-V207 HydrophobicContact CG2-CG1 3.85Å; I188-L208 HydrophobicContact CB-CD2 4.22Å; I188-L208 HydrophobicContact CG2-CD2 3.77Å
189	A	79.8	Confident	79.7	Confident	5 Å²	5	56.7 Å²	56.7	4%	0.041	29%	0.289	C	S	.	.	H	α-helix	trans	-59.4	-45.1	176.4	0	0	0	0	0	111.4	R185 E187 C191 I192 E193 W225	R185-A189 VanDerWaalsContact O-CB 3.31Å; R185-A189 WeakPolarHBondContact O-CB 3.31Å; R185-A189 PolarHBondContact O-N 3.31Å; E187-A189 VanDerWaalsContact C-N 3.29Å; E187-A189 PolarHBondContact O-N 3.2Å; A189-C191 VanDerWaalsContact C-N 3.31Å; A189-C191 PolarHBondContact O-N 3.05Å; A189-I192 PolarHBondContact O-N 3.19Å; A189-E193 WeakPolarHBondContact O-CG 3.46Å; A189-E193 PolarHBondContact O-N 2.84Å; A189-W225 HydrophobicContact CB-CH2 4.46Å; A189-W225 HydrophobicContact CB-CZ2 4.09Å
190	G	80.6	Confident	79.6	Confident	18 Å²	18	57.8 Å²	57.8	19%	0.186	29%	0.293	C	S	.	.	H	α-helix	trans	-62.4	-34.5	175.1	0	0	0	0	0	113.7	D186 E187 I188 K194	D186-G190 PolarHBondContact O-N 3.36Å; E187-G190 CarbonylContact O-C 3.6Å; E187-G190 PolarHBondContact O-N 3.35Å; E187-G190 VanDerWaalsContact O-N 3.11Å; I188-G190 VanDerWaalsContact C-N 3.34Å; I188-G190 PolarHBondContact O-N 3.03Å; G190-K194 WeakPolarHBondContact O-CG 3.2Å; G190-K194 PolarHBondContact O-N 2.9Å
191	C	81.6	Confident	79.2	Confident	70 Å²	70	60.2 Å²	60.2	47%	0.473	30%	0.304	S	S	.	.	H	α-helix	trans	-69.6	-41.2	172.8	-71.1	0	0	0	0	112.2	E187 I188 A189 K194 A195	E187-C191 PolarHBondContact O-N 3.27Å; E187-C191 PolarHBondContact O-SG 3.31Å; I188-C191 WeakPolarHBondContact O-CB 3.27Å; I188-C191 PolarHBondContact O-N 3.36Å; A189-C191 VanDerWaalsContact C-N 3.31Å; A189-C191 PolarHBondContact O-N 3.05Å; C191-K194 PolarHBondContact O-N 3.24Å; C191-A195 VanDerWaalsContact O-CB 3.27Å; C191-A195 WeakPolarHBondContact O-CB 3.44Å; C191-A195 PolarHBondContact O-N 3.39Å
192	I	79.5	Confident	79.1	Confident	8 Å²	8	64.4 Å²	64.4	4%	0.041	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-44.4	178.3	-70.1	167.2	0	0	0	110.6	I188 A189 K194 A195 Y196 I199 V207 L208 F235	I188-I192 HydrophobicContact CG2-CD1 3.75Å; I188-I192 HydrophobicContact CG2-CG1 4.27Å; I188-I192 VanDerWaalsContact O-CG1 3.27Å; I188-I192 WeakPolarHBondContact O-CG1 3.29Å; I188-I192 PolarHBondContact O-N 3.47Å; A189-I192 PolarHBondContact O-N 3.19Å; I192-K194 PolarHBondContact O-N 2.89Å; I192-A195 PolarHBondContact O-N 2.95Å; I192-Y196 HydrophobicContact CB-CD2 4.48Å; I192-Y196 HydrophobicContact CG2-CD2 4.08Å; I192-Y196 PolarHBondContact O-N 3.18Å; I192-I199 HydrophobicContact CG2-CD1 4.29Å; I192-V207 HydrophobicContact CD1-CB 4.41Å; I192-V207 HydrophobicContact CD1-CG1 3.73Å; I192-V207 HydrophobicContact CG1-CG1 4.39Å; I192-L208 HydrophobicContact CD1-CD2 4.42Å; I192-L208 HydrophobicContact CD1-CG 4.36Å; I192-F235 HydrophobicContact CG2-CD2 4.42Å; I192-F235 HydrophobicContact CG2-CE1 4.06Å; I192-F235 HydrophobicContact CG2-CE2 3.52Å; I192-F235 HydrophobicContact CG2-CZ 3.32Å
193	E	77.4	Confident	78.8	Confident	59 Å²	59	66 Å²	66	28%	0.276	33%	0.331	S	S	.	.	H	α-helix	trans	-58.3	-31.2	177.6	-74.5	173.4	-174	0	0	112.9	A189 W225 F235	A189-E193 WeakPolarHBondContact O-CG 3.46Å; A189-E193 PolarHBondContact O-N 2.84Å; E193-W225 HydrophobicContact CG-CZ2 4.25Å; E193-W225 PolarHBondContact OE1-NE1 2.98Å; E193-F235 HydrophobicContact CB-CD1 4.34Å; E193-F235 HydrophobicContact CG-CD1 3.72Å; E193-F235 HydrophobicContact CG-CE1 4.15Å; E193-F235 HydrophobicContact CG-CG 4.5Å
194	K	79.9	Confident	78.3	Confident	164 Å²	164	63.5 Å²	63.5	71%	0.713	32%	0.316	S	S	*	.	H	α-helix	trans	-86.7	-37.7	178.4	-68.5	173.9	-176.1	172.6	0	112.9	G190 C191 I192	G190-K194 WeakPolarHBondContact O-CG 3.2Å; G190-K194 PolarHBondContact O-N 2.9Å; C191-K194 PolarHBondContact O-N 3.24Å; I192-K194 PolarHBondContact O-N 2.89Å
195	A	80.3	Confident	78	Confident	74 Å²	74	64.3 Å²	64.3	61%	0.612	32%	0.321	S	S	*	.	H	α-helix	trans	-82	-36.3	-172.3	0	0	0	0	0	112.9	C191 I192	C191-A195 VanDerWaalsContact O-CB 3.27Å; C191-A195 WeakPolarHBondContact O-CB 3.44Å; C191-A195 PolarHBondContact O-N 3.39Å; I192-A195 PolarHBondContact O-N 2.95Å
196	Y	76.2	Confident	77.8	Confident	127 Å²	127	70.5 Å²	70.5	50%	0.498	35%	0.345	S	S	.	.			trans	-114.2	142.3	-173.3	-60.3	-78.2	0	0	0	111.3	I192 F235	I192-Y196 HydrophobicContact CB-CD2 4.48Å; I192-Y196 HydrophobicContact CG2-CD2 4.08Å; I192-Y196 PolarHBondContact O-N 3.18Å; Y196-F235 VanDerWaalsContact O-CD2 3.27Å; Y196-F235 WeakPolarHBondContact O-CD2 3.27Å
197	K	72.1	Confident	77.5	Confident	115 Å²	115	70.4 Å²	70.4	50%	0.5	35%	0.347	S	S	.	.	S	Bend	trans	-84.8	-33.6	169.4	-65.2	-173.8	-177.1	-173.5	0	111.7	F235	K197-F235 PolarHBondContact O-N 3.43Å
198	Q	73.2	Confident	77.1	Confident	131 Å²	131	65.6 Å²	65.6	61%	0.612	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.3	139.1	-179.8	-6.3	-178.8	0.3	0	0	108.2	Y233	Q198-Y233 CarbonylContact C-O 3.55Å; Q198-Y233 VanDerWaalsContact CA-O 3.22Å; Q198-Y233 WeakPolarHBondContact CA-O 3.49Å
199	I	77.4	Confident	76.6	Confident	7 Å²	7	68.9 Å²	68.9	4%	0.036	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	144.9	173.2	-164.6	168.1	0	0	0	110.3	I192 E203 A204 Y232 Y233 F235	I192-I199 HydrophobicContact CG2-CD1 4.29Å; I199-E203 HydrophobicContact CD1-CB 4.23Å; I199-E203 HydrophobicContact CG1-CB 3.91Å; I199-A204 HydrophobicContact CD1-CB 4.18Å; I199-A204 HydrophobicContact CG1-CB 4.42Å; I199-A204 HydrophobicContact CG2-CB 4.06Å; I199-Y232 CarbonylContact O-C 3.56Å; I199-Y232 VanDerWaalsContact O-CA 3.31Å; I199-Y232 WeakPolarHBondContact O-CA 3.34Å; I199-Y233 HydrophobicContact CG2-CD2 4.41Å; I199-Y233 PolarHBondContact N-O 3.01Å; I199-Y233 PolarHBondContact O-N 3.28Å; I199-F235 HydrophobicContact CB-CE2 3.84Å; I199-F235 HydrophobicContact CB-CZ 4.36Å; I199-F235 HydrophobicContact CG2-CE2 3.36Å; I199-F235 HydrophobicContact CG2-CZ 3.41Å; I199-F235 VanDerWaalsContact CG2-CZ 3.41Å
200	Q	79.2	Confident	76.2	Confident	75 Å²	75	69.6 Å²	69.6	35%	0.35	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	149	172.8	-70.7	-177.2	-6.8	0	0	111.7	N202 E203 A204 Y232	Q200-N202 VanDerWaalsContact C-N 3.27Å; Q200-N202 PolarHBondContact O-N 3.4Å; Q200-E203 HydrophobicContact CB-CB 4.37Å; Q200-E203 HydrophobicContact CB-CG 4.21Å; Q200-E203 PolarHBondContact O-N 3.18Å; Q200-A204 PolarHBondContact O-N 3.47Å; Q200-Y232 HydrophobicContact CB-CE1 4.39Å; Q200-Y232 HydrophobicContact CG-CD1 3.69Å; Q200-Y232 HydrophobicContact CG-CE1 3.16Å; Q200-Y232 PolarHBondContact NE2-OH 3.01Å
201	F	72.7	Confident	75.5	Confident	60 Å²	60	75.1 Å²	75.1	26%	0.263	38%	0.376	S	S	.	.	H	α-helix	trans	-53.1	-41.8	174.9	-177.7	-87.3	0	0	0	113.2	T205 P213 M216 T217 G231 Y233	F201-T205 WeakPolarHBondContact O-CB 3.42Å; F201-T205 PolarHBondContact O-N 3.28Å; F201-T205 PolarHBondContact O-OG1 2.99Å; F201-P213 HydrophobicContact CE1-CB 4.12Å; F201-P213 HydrophobicContact CZ-CB 3.71Å; F201-M216 HydrophobicContact CB-CE 4.13Å; F201-M216 HydrophobicContact CD1-CE 3.84Å; F201-M216 HydrophobicContact CD2-CE 3.09Å; F201-M216 HydrophobicContact CD2-SD 3.68Å; F201-M216 HydrophobicContact CE1-CE 3.93Å; F201-M216 HydrophobicContact CE2-CE 3.19Å; F201-M216 HydrophobicContact CE2-SD 3.46Å; F201-M216 WeakPolarHBondContact CE2-SD 3.27Å; F201-M216 HydrophobicContact CG-CE 3.42Å; F201-M216 VanDerWaalsContact CG-CE 3.42Å; F201-M216 HydrophobicContact CZ-CE 3.61Å; F201-M216 HydrophobicContact CZ-SD 4.21Å; F201-M216 WeakPolarHBondContact O-CE 3.27Å; F201-T217 HydrophobicContact CE2-CG2 4.43Å; F201-G231 WeakPolarHBondContact CB-O 3.4Å; F201-G231 PolarHBondContact N-O 3.3Å; F201-Y233 AromaticContact CD2-CE2 3.88Å; F201-Y233 HydrophobicContact CD2-CE2 3.88Å
202	N	76.6	Confident	74.8	Confident	89 Å²	89	73.7 Å²	73.7	48%	0.476	37%	0.367	S	S	.	.	H	α-helix	trans	-68.8	-40.2	-179.2	-167.7	1.3	0	0	0	112.1	Q200 T205 R206	Q200-N202 VanDerWaalsContact C-N 3.27Å; Q200-N202 PolarHBondContact O-N 3.4Å; N202-T205 PolarHBondContact O-N 3.47Å; N202-R206 WeakPolarHBondContact O-CG 3.48Å; N202-R206 PolarHBondContact O-N 3.29Å; N202-R206 VanDerWaalsContact O-N 3.09Å; N202-R206 PolarHBondContact OD1-NE 2.85Å
203	E	76.3	Confident	74.3	Confident	100 Å²	100	76.6 Å²	76.6	47%	0.467	39%	0.386	S	S	.	.	H	α-helix	trans	-68.8	-43.2	177.6	-66.7	-179.6	142.2	0	0	111.2	I199 Q200 T205 R206 V207	I199-E203 HydrophobicContact CD1-CB 4.23Å; I199-E203 HydrophobicContact CG1-CB 3.91Å; Q200-E203 HydrophobicContact CB-CB 4.37Å; Q200-E203 HydrophobicContact CB-CG 4.21Å; Q200-E203 PolarHBondContact O-N 3.18Å; E203-T205 VanDerWaalsContact C-N 3.3Å; E203-T205 PolarHBondContact O-N 3.26Å; E203-R206 PolarHBondContact O-N 2.75Å; E203-V207 VanDerWaalsContact O-CG2 3.29Å; E203-V207 WeakPolarHBondContact O-CG2 3.5Å; E203-V207 PolarHBondContact O-N 3.08Å
204	A	72.9	Confident	73.9	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-60.5	-39.2	174.8	0	0	0	0	0	112.3	I199 Q200 V207 L208 M216	I199-A204 HydrophobicContact CD1-CB 4.18Å; I199-A204 HydrophobicContact CG1-CB 4.42Å; I199-A204 HydrophobicContact CG2-CB 4.06Å; Q200-A204 PolarHBondContact O-N 3.47Å; A204-V207 PolarHBondContact O-N 3.38Å; A204-L208 WeakPolarHBondContact O-CB 3.38Å; A204-L208 PolarHBondContact O-N 3.01Å; A204-M216 HydrophobicContact CB-CE 4.01Å
205	T	75.1	Confident	73.5	Confident	26 Å²	26	74.8 Å²	74.8	16%	0.16	39%	0.387	C	S	.	.	H	α-helix	trans	-64.9	-40.3	176.9	-57.6	0	0	0	0	111.6	F201 N202 E203 F209 F210 M216	F201-T205 WeakPolarHBondContact O-CB 3.42Å; F201-T205 PolarHBondContact O-N 3.28Å; F201-T205 PolarHBondContact O-OG1 2.99Å; N202-T205 PolarHBondContact O-N 3.47Å; E203-T205 VanDerWaalsContact C-N 3.3Å; E203-T205 PolarHBondContact O-N 3.26Å; T205-F209 PolarHBondContact O-N 2.94Å; T205-F209 VanDerWaalsContact O-N 3.09Å; T205-F210 HydrophobicContact CG2-CB 4.25Å; T205-F210 WeakPolarHBondContact CG2-O 2.97Å; T205-F210 PolarHBondContact O-N 3.11Å; T205-M216 WeakPolarHBondContact OG1-CE 3.31Å
206	R	76.8	Confident	72.9	Confident	175 Å²	175	71.3 Å²	71.3	66%	0.66	36%	0.358	S	S	*	.	H	α-helix	trans	-67.8	-44.2	177	-72.9	175.5	-178.3	-161.9	-3.9	112.1	N202 E203 F209	N202-R206 WeakPolarHBondContact O-CG 3.48Å; N202-R206 PolarHBondContact O-N 3.29Å; N202-R206 VanDerWaalsContact O-N 3.09Å; N202-R206 PolarHBondContact OD1-NE 2.85Å; E203-R206 PolarHBondContact O-N 2.75Å; R206-F209 PolarHBondContact O-N 3.49Å
207	V	76.9	Confident	72.7	Confident	63 Å²	63	67.7 Å²	67.7	38%	0.382	35%	0.349	S	S	.	.	H	α-helix	trans	-68.8	-37.7	-177.7	176.7	0	0	0	0	111.8	I188 I192 E203 A204 F209	I188-V207 HydrophobicContact CG2-CG1 3.85Å; I192-V207 HydrophobicContact CD1-CB 4.41Å; I192-V207 HydrophobicContact CD1-CG1 3.73Å; I192-V207 HydrophobicContact CG1-CG1 4.39Å; E203-V207 VanDerWaalsContact O-CG2 3.29Å; E203-V207 WeakPolarHBondContact O-CG2 3.5Å; E203-V207 PolarHBondContact O-N 3.08Å; A204-V207 PolarHBondContact O-N 3.38Å; V207-F209 VanDerWaalsContact C-N 3.33Å; V207-F209 WeakPolarHBondContact O-CD2 3.42Å
208	L	73.9	Confident	72.9	Confident	5 Å²	5	67.9 Å²	67.9	3%	0.026	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88	-0.8	178.5	-67.1	165.5	0	0	0	113.5	I188 I192 A204 F210 W225	I188-L208 HydrophobicContact CB-CD2 4.22Å; I188-L208 HydrophobicContact CG2-CD2 3.77Å; I192-L208 HydrophobicContact CD1-CD2 4.42Å; I192-L208 HydrophobicContact CD1-CG 4.36Å; A204-L208 WeakPolarHBondContact O-CB 3.38Å; A204-L208 PolarHBondContact O-N 3.01Å; L208-F210 VanDerWaalsContact C-N 3.29Å; L208-F210 HydrophobicContact CB-CD2 3.57Å; L208-F210 HydrophobicContact CB-CE2 3.48Å; L208-F210 VanDerWaalsContact CB-CE2 3.48Å; L208-F210 HydrophobicContact CB-CZ 4.41Å; L208-F210 HydrophobicContact CD1-CD2 4.4Å; L208-F210 HydrophobicContact CD1-CE2 3.83Å; L208-F210 HydrophobicContact CG-CE2 4.2Å; L208-F210 PolarHBondContact O-N 3.19Å; L208-W225 HydrophobicContact CD1-CH2 4.15Å; L208-W225 HydrophobicContact CD1-CZ3 4.41Å
209	F	70.5	Confident	72.9	Confident	75 Å²	75	64 Å²	64	33%	0.329	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	42	179.6	-65.9	-84.7	0	0	0	113.7	N159 F162 T205 R206 V207	N159-F209 VanDerWaalsContact OD1-CZ 3.27Å; N159-F209 WeakPolarHBondContact OD1-CZ 3.25Å; F162-F209 HydrophobicContact CD1-CB 4.39Å; F162-F209 HydrophobicContact CD1-CG 4.44Å; F162-F209 HydrophobicContact CD2-CB 4.48Å; F162-F209 HydrophobicContact CD2-CD1 4.49Å; F162-F209 AromaticContact CD2-CD2 3.44Å; F162-F209 HydrophobicContact CD2-CD2 3.44Å; F162-F209 VanDerWaalsContact CD2-CD2 3.44Å; F162-F209 AromaticContact CD2-CE2 3.66Å; F162-F209 HydrophobicContact CD2-CE2 3.66Å; F162-F209 AromaticContact CD2-CG 3.89Å; F162-F209 HydrophobicContact CD2-CG 3.89Å; F162-F209 HydrophobicContact CD2-CZ 4.29Å; F162-F209 HydrophobicContact CE1-CB 3.94Å; F162-F209 HydrophobicContact CE1-CG 4.33Å; F162-F209 HydrophobicContact CE2-CB 4.07Å; F162-F209 AromaticContact CE2-CD2 3.23Å; F162-F209 HydrophobicContact CE2-CD2 3.23Å; F162-F209 AromaticContact CE2-CE2 3.84Å; F162-F209 HydrophobicContact CE2-CE2 3.84Å; F162-F209 AromaticContact CE2-CG 3.8Å; F162-F209 HydrophobicContact CE2-CG 3.8Å; F162-F209 HydrophobicContact CG-CD2 4.22Å; F162-F209 HydrophobicContact CG-CG 4.23Å; F162-F209 HydrophobicContact CZ-CB 3.77Å; F162-F209 AromaticContact CZ-CD2 3.85Å; F162-F209 HydrophobicContact CZ-CD2 3.85Å; F162-F209 HydrophobicContact CZ-CG 4.03Å; T205-F209 PolarHBondContact O-N 2.94Å; T205-F209 VanDerWaalsContact O-N 3.09Å; R206-F209 PolarHBondContact O-N 3.49Å; V207-F209 VanDerWaalsContact C-N 3.33Å; V207-F209 WeakPolarHBondContact O-CD2 3.42Å
210	F	71	Confident	72.7	Confident	20 Å²	20	63.8 Å²	63.8	9%	0.088	33%	0.331	C	S	.	.			trans	-79.8	130.3	173.2	-73	-64.2	0	0	0	110.8	T205 L208 N215 M216 Y219	T205-F210 HydrophobicContact CG2-CB 4.25Å; T205-F210 WeakPolarHBondContact CG2-O 2.97Å; T205-F210 PolarHBondContact O-N 3.11Å; L208-F210 VanDerWaalsContact C-N 3.29Å; L208-F210 HydrophobicContact CB-CD2 3.57Å; L208-F210 HydrophobicContact CB-CE2 3.48Å; L208-F210 VanDerWaalsContact CB-CE2 3.48Å; L208-F210 HydrophobicContact CB-CZ 4.41Å; L208-F210 HydrophobicContact CD1-CD2 4.4Å; L208-F210 HydrophobicContact CD1-CE2 3.83Å; L208-F210 HydrophobicContact CG-CE2 4.2Å; L208-F210 PolarHBondContact O-N 3.19Å; F210-N215 HydrophobicContact CD1-CB 3.78Å; F210-N215 HydrophobicContact CE1-CB 4.03Å; F210-N215 HydrophobicContact CG-CB 4.48Å; F210-M216 HydrophobicContact CD2-CB 3.97Å; F210-M216 HydrophobicContact CD2-CG 4.06Å; F210-M216 HydrophobicContact CE2-CB 4.45Å; F210-M216 HydrophobicContact CE2-CG 4.38Å; F210-M216 HydrophobicContact CG-CB 4.48Å; F210-Y219 AromaticContact CE1-CD2 3.68Å; F210-Y219 HydrophobicContact CE1-CD2 3.68Å; F210-Y219 AromaticContact CE1-CE2 3.65Å; F210-Y219 HydrophobicContact CE1-CE2 3.65Å; F210-Y219 HydrophobicContact CE1-CG 4.46Å; F210-Y219 HydrophobicContact CE2-CD2 4.27Å; F210-Y219 HydrophobicContact CE2-CG 4.32Å; F210-Y219 HydrophobicContact CZ-CD1 4.22Å; F210-Y219 AromaticContact CZ-CD2 3.3Å; F210-Y219 HydrophobicContact CZ-CD2 3.3Å; F210-Y219 HydrophobicContact CZ-CE1 4.44Å; F210-Y219 AromaticContact CZ-CE2 3.57Å; F210-Y219 HydrophobicContact CZ-CE2 3.57Å; F210-Y219 AromaticContact CZ-CG 3.64Å; F210-Y219 HydrophobicContact CZ-CG 3.64Å
211	S	65.2	Low	72.5	Confident	135 Å²	135	66.3 Å²	66.3	94%	0.944	35%	0.347	S	S	*	.	S	Bend	trans	-82.1	-15.9	171.7	-51.5	0	0	0	0	113.2
212	S	68.1	Low	72.8	Confident	40 Å²	40	70.9 Å²	70.9	28%	0.28	37%	0.366	S	S	.	.			trans	-129.2	132.3	-177.3	-177.8	0	0	0	0	111.6	N214 N215	S212-N214 PolarHBondContact O-N 3.27Å; S212-N215 PolarHBondContact O-N 3.44Å
213	P	67.8	Low	72.5	Confident	68 Å²	68	70.9 Å²	70.9	44%	0.442	36%	0.36	S	S	.	.	H	α-helix	trans	-64.8	-26	178.4	26	-33.5	0	0	0	113.1	F201 M216 T217	F201-P213 HydrophobicContact CE1-CB 4.12Å; F201-P213 HydrophobicContact CZ-CB 3.71Å; P213-M216 PolarHBondContact O-N 3.38Å; P213-T217 PolarHBondContact O-N 2.97Å
214	N	70.1	Confident	72.1	Confident	112 Å²	112	69 Å²	69	60%	0.599	37%	0.367	S	S	*	.	H	α-helix	trans	-67.4	-38.2	-179.7	-67.6	-5.2	0	0	0	112.4	S212 M216 T217 E218	S212-N214 PolarHBondContact O-N 3.27Å; N214-M216 PolarHBondContact O-N 3.4Å; N214-T217 WeakPolarHBondContact CA-OG1 3.46Å; N214-T217 PolarHBondContact O-N 3.22Å; N214-T217 PolarHBondContact O-OG1 3.21Å; N214-E218 PolarHBondContact O-N 2.87Å; N214-E218 VanDerWaalsContact O-N 3.09Å
215	N	71.3	Confident	72.3	Confident	74 Å²	74	70.1 Å²	70.1	40%	0.396	37%	0.371	S	S	.	.	H	α-helix	trans	-64.4	-36.6	177.3	-65.3	5.2	0	0	0	109.9	F210 S212 T217 E218 Y219	F210-N215 HydrophobicContact CD1-CB 3.78Å; F210-N215 HydrophobicContact CE1-CB 4.03Å; F210-N215 HydrophobicContact CG-CB 4.48Å; S212-N215 PolarHBondContact O-N 3.44Å; N215-T217 PolarHBondContact O-N 2.89Å; N215-E218 PolarHBondContact O-N 3.22Å; N215-Y219 WeakPolarHBondContact O-CB 3.45Å; N215-Y219 VanDerWaalsContact O-CD2 3.29Å; N215-Y219 WeakPolarHBondContact O-CD2 3.31Å; N215-Y219 PolarHBondContact O-N 2.87Å
216	M	68.6	Low	71.9	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	39%	0.386	C	S	.	.	H	α-helix	trans	-68.4	-36.6	179.4	-164.6	-102.9	-98.2	0	0	112.1	F201 A204 T205 F210 P213 N214 Y219 A220 Y233	F201-M216 HydrophobicContact CB-CE 4.13Å; F201-M216 HydrophobicContact CD1-CE 3.84Å; F201-M216 HydrophobicContact CD2-CE 3.09Å; F201-M216 HydrophobicContact CD2-SD 3.68Å; F201-M216 HydrophobicContact CE1-CE 3.93Å; F201-M216 HydrophobicContact CE2-CE 3.19Å; F201-M216 HydrophobicContact CE2-SD 3.46Å; F201-M216 WeakPolarHBondContact CE2-SD 3.27Å; F201-M216 HydrophobicContact CG-CE 3.42Å; F201-M216 VanDerWaalsContact CG-CE 3.42Å; F201-M216 HydrophobicContact CZ-CE 3.61Å; F201-M216 HydrophobicContact CZ-SD 4.21Å; F201-M216 WeakPolarHBondContact O-CE 3.27Å; A204-M216 HydrophobicContact CB-CE 4.01Å; T205-M216 WeakPolarHBondContact OG1-CE 3.31Å; F210-M216 HydrophobicContact CD2-CB 3.97Å; F210-M216 HydrophobicContact CD2-CG 4.06Å; F210-M216 HydrophobicContact CE2-CB 4.45Å; F210-M216 HydrophobicContact CE2-CG 4.38Å; F210-M216 HydrophobicContact CG-CB 4.48Å; P213-M216 PolarHBondContact O-N 3.38Å; N214-M216 PolarHBondContact O-N 3.4Å; M216-Y219 PolarHBondContact O-N 3.02Å; M216-A220 VanDerWaalsContact O-CB 3.31Å; M216-A220 WeakPolarHBondContact O-CB 3.4Å; M216-A220 PolarHBondContact O-N 3.46Å; M216-Y233 HydrophobicContact CE-CE2 3.83Å; M216-Y233 HydrophobicContact SD-CD2 4.49Å; M216-Y233 HydrophobicContact SD-CE2 3.38Å; M216-Y233 WeakPolarHBondContact SD-CE2 3.43Å; M216-Y233 PolarHBondContact SD-OH 3.18Å
217	T	71.1	Confident	71.5	Confident	50 Å²	50	69.7 Å²	69.7	31%	0.307	38%	0.38	S	S	.	.	H	α-helix	trans	-66	-38.7	172.2	52.1	0	0	0	0	113	F201 P213 N214 N215 A220 N221	F201-T217 HydrophobicContact CE2-CG2 4.43Å; P213-T217 PolarHBondContact O-N 2.97Å; N214-T217 WeakPolarHBondContact CA-OG1 3.46Å; N214-T217 PolarHBondContact O-N 3.22Å; N214-T217 PolarHBondContact O-OG1 3.21Å; N215-T217 PolarHBondContact O-N 2.89Å; T217-A220 PolarHBondContact O-N 3.04Å; T217-N221 WeakPolarHBondContact O-CB 3.48Å; T217-N221 PolarHBondContact O-N 3.11Å; T217-N221 PolarHBondContact O-ND2 3.37Å
218	E	77.4	Confident	70.8	Confident	119 Å²	119	68.8 Å²	68.8	56%	0.556	38%	0.377	S	S	*	.	H	α-helix	trans	-65.2	-41.2	173.4	-78.7	-172	167	0	0	112.2	N214 N215 N221 K222	N214-E218 PolarHBondContact O-N 2.87Å; N214-E218 VanDerWaalsContact O-N 3.09Å; N215-E218 PolarHBondContact O-N 3.22Å; E218-N221 PolarHBondContact O-N 2.87Å; E218-K222 WeakPolarHBondContact O-CG 3.31Å; E218-K222 PolarHBondContact O-N 2.96Å
219	Y	73	Confident	70.3	Confident	50 Å²	50	75 Å²	75	20%	0.196	42%	0.418	C	S	.	.	H	α-helix	trans	-66.7	-41	176.8	-93.8	-88.4	0	0	0	112.2	F210 N215 M216 N221 K222 R223	F210-Y219 AromaticContact CE1-CD2 3.68Å; F210-Y219 HydrophobicContact CE1-CD2 3.68Å; F210-Y219 AromaticContact CE1-CE2 3.65Å; F210-Y219 HydrophobicContact CE1-CE2 3.65Å; F210-Y219 HydrophobicContact CE1-CG 4.46Å; F210-Y219 HydrophobicContact CE2-CD2 4.27Å; F210-Y219 HydrophobicContact CE2-CG 4.32Å; F210-Y219 HydrophobicContact CZ-CD1 4.22Å; F210-Y219 AromaticContact CZ-CD2 3.3Å; F210-Y219 HydrophobicContact CZ-CD2 3.3Å; F210-Y219 HydrophobicContact CZ-CE1 4.44Å; F210-Y219 AromaticContact CZ-CE2 3.57Å; F210-Y219 HydrophobicContact CZ-CE2 3.57Å; F210-Y219 AromaticContact CZ-CG 3.64Å; F210-Y219 HydrophobicContact CZ-CG 3.64Å; N215-Y219 WeakPolarHBondContact O-CB 3.45Å; N215-Y219 VanDerWaalsContact O-CD2 3.29Å; N215-Y219 WeakPolarHBondContact O-CD2 3.31Å; N215-Y219 PolarHBondContact O-N 2.87Å; M216-Y219 PolarHBondContact O-N 3.02Å; Y219-N221 VanDerWaalsContact C-N 3.32Å; Y219-N221 PolarHBondContact O-N 2.88Å; Y219-K222 PolarHBondContact O-N 3Å; Y219-R223 WeakPolarHBondContact O-CG 3.22Å; Y219-R223 PolarHBondContact O-N 3.36Å; Y219-R223 VanDerWaalsContact O-N 3.07Å
220	A	73.2	Confident	69.9	Low	3 Å²	3	78 Å²	78	3%	0.025	44%	0.437	C	S	.	.	H	α-helix	trans	-61.4	-41	174.2	0	0	0	0	0	111.5	M216 T217 R223 G224 W225 Y233	M216-A220 VanDerWaalsContact O-CB 3.31Å; M216-A220 WeakPolarHBondContact O-CB 3.4Å; M216-A220 PolarHBondContact O-N 3.46Å; T217-A220 PolarHBondContact O-N 3.04Å; A220-R223 PolarHBondContact O-N 3.39Å; A220-G224 PolarHBondContact O-N 3.47Å; A220-W225 HydrophobicContact CB-CB 4.28Å; A220-W225 HydrophobicContact CB-CE3 4.19Å; A220-W225 PolarHBondContact O-N 2.95Å; A220-Y233 HydrophobicContact CB-CD1 4.4Å; A220-Y233 HydrophobicContact CB-CE1 3.65Å
221	N	74.6	Confident	69.7	Low	128 Å²	128	78.2 Å²	78.2	68%	0.684	45%	0.445	S	S	*	.	H	α-helix	trans	-66.1	-41.5	175.3	-71.9	-25.1	0	0	0	112.3	T217 E218 Y219 R223 G224	T217-N221 WeakPolarHBondContact O-CB 3.48Å; T217-N221 PolarHBondContact O-N 3.11Å; T217-N221 PolarHBondContact O-ND2 3.37Å; E218-N221 PolarHBondContact O-N 2.87Å; Y219-N221 VanDerWaalsContact C-N 3.32Å; Y219-N221 PolarHBondContact O-N 2.88Å; N221-R223 VanDerWaalsContact C-N 3.26Å; N221-R223 PolarHBondContact O-N 3.46Å; N221-G224 PolarHBondContact O-N 2.78Å
222	K	78.4	Confident	69.9	Low	155 Å²	155	75.8 Å²	75.8	67%	0.674	42%	0.415	S	S	*	.	H	α-helix	trans	-61.4	-34.3	176.1	-78.1	179.2	-178.6	176.6	0	112.7	E218 Y219	E218-K222 WeakPolarHBondContact O-CG 3.31Å; E218-K222 PolarHBondContact O-N 2.96Å; Y219-K222 PolarHBondContact O-N 3Å
223	R	71.1	Confident	69.9	Low	90 Å²	90	74 Å²	74	34%	0.34	40%	0.402	S	S	.	.	H	α-helix	trans	-93.1	-7.7	-179.4	-65.7	-73.1	-178.5	157.9	-2.1	113.7	D186 Y219 A220 N221 W225	D186-R223 VanDerWaalsContact CA-NH2 3.32Å; D186-R223 PolarHBondContact O-NH2 3.43Å; D186-R223 IonicContact OD1-CZ 3.75Å; D186-R223 IonicContact OD1-NE 3.93Å; D186-R223 IonicContact OD1-NH2 2.75Å; D186-R223 PolarHBondContact OD1-NH2 3.06Å; Y219-R223 WeakPolarHBondContact O-CG 3.22Å; Y219-R223 PolarHBondContact O-N 3.36Å; Y219-R223 VanDerWaalsContact O-N 3.07Å; A220-R223 PolarHBondContact O-N 3.39Å; N221-R223 VanDerWaalsContact C-N 3.26Å; N221-R223 PolarHBondContact O-N 3.46Å; R223-W225 HydrophobicContact CB-CD2 4.36Å; R223-W225 HydrophobicContact CB-CG 4.26Å; R223-W225 VanDerWaalsContact CB-NE1 3.32Å
224	G	68.5	Low	69.8	Low	59 Å²	59	72.6 Å²	72.6	61%	0.608	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	29.3	178.9	0	0	0	0	0	114.2	A220 N221	A220-G224 PolarHBondContact O-N 3.47Å; N221-G224 PolarHBondContact O-N 2.78Å
225	W	76.4	Confident	69.7	Low	24 Å²	24	67.9 Å²	67.9	9%	0.091	37%	0.369	C	S	.	.			trans	-72.8	128.1	179	-60.9	-8.2	0	0	0	110.7	A189 E193 L208 A220 R223 Q227 Y233 F235	A189-W225 HydrophobicContact CB-CH2 4.46Å; A189-W225 HydrophobicContact CB-CZ2 4.09Å; E193-W225 HydrophobicContact CG-CZ2 4.25Å; E193-W225 PolarHBondContact OE1-NE1 2.98Å; L208-W225 HydrophobicContact CD1-CH2 4.15Å; L208-W225 HydrophobicContact CD1-CZ3 4.41Å; A220-W225 HydrophobicContact CB-CB 4.28Å; A220-W225 HydrophobicContact CB-CE3 4.19Å; A220-W225 PolarHBondContact O-N 2.95Å; R223-W225 HydrophobicContact CB-CD2 4.36Å; R223-W225 HydrophobicContact CB-CG 4.26Å; R223-W225 VanDerWaalsContact CB-NE1 3.32Å; W225-Q227 PolarHBondContact O-N 3.37Å; W225-Y233 HydrophobicContact CB-CD1 3.73Å; W225-Y233 HydrophobicContact CB-CE1 4.4Å; W225-Y233 HydrophobicContact CB-CG 4.34Å; W225-Y233 HydrophobicContact CE3-CD1 4.29Å; W225-Y233 HydrophobicContact CE3-CD2 4.31Å; W225-Y233 HydrophobicContact CE3-CG 4.05Å; W225-F235 AromaticContact CD1-CE1 3.99Å; W225-F235 HydrophobicContact CD2-CD1 4.26Å; W225-F235 AromaticContact CD2-CE1 3.46Å; W225-F235 HydrophobicContact CD2-CE1 3.46Å; W225-F235 VanDerWaalsContact CD2-CE1 3.46Å; W225-F235 HydrophobicContact CD2-CZ 4.31Å; W225-F235 AromaticContact CE2-CE1 3.37Å; W225-F235 AromaticContact CE3-CE1 3.79Å; W225-F235 HydrophobicContact CE3-CE1 3.79Å; W225-F235 HydrophobicContact CE3-CZ 4.2Å; W225-F235 HydrophobicContact CG-CD1 4.27Å; W225-F235 AromaticContact CG-CE1 3.89Å; W225-F235 HydrophobicContact CG-CE1 3.89Å; W225-F235 AromaticContact CH2-CE1 3.92Å; W225-F235 HydrophobicContact CH2-CE1 3.92Å; W225-F235 HydrophobicContact CH2-CZ 4.18Å; W225-F235 AromaticContact CZ2-CE1 3.61Å; W225-F235 HydrophobicContact CZ2-CE1 3.61Å; W225-F235 HydrophobicContact CZ2-CZ 4.3Å; W225-F235 HydrophobicContact CZ3-CE1 4.01Å; W225-F235 HydrophobicContact CZ3-CZ 4.14Å; W225-F235 AromaticContact NE1-CD1 3.91Å; W225-F235 AromaticContact NE1-CE1 3.7Å
226	T	66.9	Low	69.1	Low	76 Å²	76	69.9 Å²	69.9	47%	0.466	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	114	178.2	43	0	0	0	0	110.4	S228 S234	T226-S228 PolarHBondContact O-N 2.91Å; T226-S234 PolarHBondContact O-N 2.79Å; T226-S234 PolarHBondContact O-OG 3.35Å; T226-S234 PolarHBondContact OG1-O 3.45Å; T226-S234 PolarHBondContact OG1-OG 3.19Å
227	Q	67.1	Low	68.3	Low	116 Å²	116	71.7 Å²	71.7	54%	0.542	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	114.3	173	-168.5	174.4	6.5	0	0	109.3	W225 Y233	W225-Q227 PolarHBondContact O-N 3.37Å; Q227-Y233 HydrophobicContact CB-CD1 4.26Å; Q227-Y233 HydrophobicContact CB-CE1 3.88Å; Q227-Y233 HydrophobicContact CG-CE1 4.13Å
228	S	63.5	Low	67.3	Low	45 Å²	45	75.5 Å²	75.5	32%	0.315	42%	0.415	S	S	.	.			trans	-76.4	149.5	169	-63.4	0	0	0	0	109.8	T226 D230 G231 Y232	T226-S228 PolarHBondContact O-N 2.91Å; S228-D230 PolarHBondContact O-N 3.36Å; S228-G231 PolarHBondContact O-N 3.07Å; S228-Y232 PolarHBondContact N-O 3.49Å
229	P	61.7	Low	65.9	Low	136 Å²	136	75.8 Å²	75.8	88%	0.883	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-17.1	-178.7	19.3	-29.9	0	0	0	114.3	G231	P229-G231 VanDerWaalsContact C-N 3.3Å; P229-G231 PolarHBondContact O-N 3.28Å
230	D	62.4	Low	64.6	Low	138 Å²	138	81.8 Å²	81.8	74%	0.738	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	7.4	174.5	-67.6	-36.4	0	0	0	114.5	S228 Y232	S228-D230 PolarHBondContact O-N 3.36Å; D230-Y232 HydrophobicContact CB-CD2 3.83Å; D230-Y232 HydrophobicContact CB-CE2 4.14Å; D230-Y232 WeakPolarHBondContact O-CD2 3.36Å
231	G	66.5	Low	63.5	Low	24 Å²	24	90.6 Å²	90.6	25%	0.247	48%	0.479	C	S	.	.	S	Bend	trans	79.2	18.7	177.1	0	0	0	0	0	114.8	F201 S228 P229	F201-G231 WeakPolarHBondContact CB-O 3.4Å; F201-G231 PolarHBondContact N-O 3.3Å; S228-G231 PolarHBondContact O-N 3.07Å; P229-G231 VanDerWaalsContact C-N 3.3Å; P229-G231 PolarHBondContact O-N 3.28Å
232	Y	70.2	Confident	62.3	Low	84 Å²	84	90.4 Å²	90.4	33%	0.329	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	135.3	172.8	-66.3	-94.7	0	0	0	110.7	I199 Q200 S228 D230	I199-Y232 CarbonylContact O-C 3.56Å; I199-Y232 VanDerWaalsContact O-CA 3.31Å; I199-Y232 WeakPolarHBondContact O-CA 3.34Å; Q200-Y232 HydrophobicContact CB-CE1 4.39Å; Q200-Y232 HydrophobicContact CG-CD1 3.69Å; Q200-Y232 HydrophobicContact CG-CE1 3.16Å; Q200-Y232 PolarHBondContact NE2-OH 3.01Å; S228-Y232 PolarHBondContact N-O 3.49Å; D230-Y232 HydrophobicContact CB-CD2 3.83Å; D230-Y232 HydrophobicContact CB-CE2 4.14Å; D230-Y232 WeakPolarHBondContact O-CD2 3.36Å
233	Y	68.9	Low	60.9	Low	2 Å²	2	91.8 Å²	91.8	1%	0.008	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	120.4	162.8	-67	-70.5	0	0	0	108.2	Q198 I199 F201 M216 A220 W225 Q227	Q198-Y233 CarbonylContact C-O 3.55Å; Q198-Y233 VanDerWaalsContact CA-O 3.22Å; Q198-Y233 WeakPolarHBondContact CA-O 3.49Å; I199-Y233 HydrophobicContact CG2-CD2 4.41Å; I199-Y233 PolarHBondContact N-O 3.01Å; I199-Y233 PolarHBondContact O-N 3.28Å; F201-Y233 AromaticContact CD2-CE2 3.88Å; F201-Y233 HydrophobicContact CD2-CE2 3.88Å; M216-Y233 HydrophobicContact CE-CE2 3.83Å; M216-Y233 HydrophobicContact SD-CD2 4.49Å; M216-Y233 HydrophobicContact SD-CE2 3.38Å; M216-Y233 WeakPolarHBondContact SD-CE2 3.43Å; M216-Y233 PolarHBondContact SD-OH 3.18Å; A220-Y233 HydrophobicContact CB-CD1 4.4Å; A220-Y233 HydrophobicContact CB-CE1 3.65Å; W225-Y233 HydrophobicContact CB-CD1 3.73Å; W225-Y233 HydrophobicContact CB-CE1 4.4Å; W225-Y233 HydrophobicContact CB-CG 4.34Å; W225-Y233 HydrophobicContact CE3-CD1 4.29Å; W225-Y233 HydrophobicContact CE3-CD2 4.31Å; W225-Y233 HydrophobicContact CE3-CG 4.05Å; Q227-Y233 HydrophobicContact CB-CD1 4.26Å; Q227-Y233 HydrophobicContact CB-CE1 3.88Å; Q227-Y233 HydrophobicContact CG-CE1 4.13Å
234	S	64.9	Low	59.8	Low	39 Å²	39	95.9 Å²	95.9	27%	0.273	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	126	166.7	46.2	0	0	0	0	108.7	T226	T226-S234 PolarHBondContact O-N 2.79Å; T226-S234 PolarHBondContact O-OG 3.35Å; T226-S234 PolarHBondContact OG1-O 3.45Å; T226-S234 PolarHBondContact OG1-OG 3.19Å
235	F	68.1	Low	59.1	Low	13 Å²	13	98 Å²	98	6%	0.057	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-89.7	127.9	168.4	-55	-70.8	0	0	0	106.1	I192 E193 Y196 K197 I199 W225 S237	I192-F235 HydrophobicContact CG2-CD2 4.42Å; I192-F235 HydrophobicContact CG2-CE1 4.06Å; I192-F235 HydrophobicContact CG2-CE2 3.52Å; I192-F235 HydrophobicContact CG2-CZ 3.32Å; E193-F235 HydrophobicContact CB-CD1 4.34Å; E193-F235 HydrophobicContact CG-CD1 3.72Å; E193-F235 HydrophobicContact CG-CE1 4.15Å; E193-F235 HydrophobicContact CG-CG 4.5Å; Y196-F235 VanDerWaalsContact O-CD2 3.27Å; Y196-F235 WeakPolarHBondContact O-CD2 3.27Å; K197-F235 PolarHBondContact O-N 3.43Å; I199-F235 HydrophobicContact CB-CE2 3.84Å; I199-F235 HydrophobicContact CB-CZ 4.36Å; I199-F235 HydrophobicContact CG2-CE2 3.36Å; I199-F235 HydrophobicContact CG2-CZ 3.41Å; I199-F235 VanDerWaalsContact CG2-CZ 3.41Å; W225-F235 AromaticContact CD1-CE1 3.99Å; W225-F235 HydrophobicContact CD2-CD1 4.26Å; W225-F235 AromaticContact CD2-CE1 3.46Å; W225-F235 HydrophobicContact CD2-CE1 3.46Å; W225-F235 VanDerWaalsContact CD2-CE1 3.46Å; W225-F235 HydrophobicContact CD2-CZ 4.31Å; W225-F235 AromaticContact CE2-CE1 3.37Å; W225-F235 AromaticContact CE3-CE1 3.79Å; W225-F235 HydrophobicContact CE3-CE1 3.79Å; W225-F235 HydrophobicContact CE3-CZ 4.2Å; W225-F235 HydrophobicContact CG-CD1 4.27Å; W225-F235 AromaticContact CG-CE1 3.89Å; W225-F235 HydrophobicContact CG-CE1 3.89Å; W225-F235 AromaticContact CH2-CE1 3.92Å; W225-F235 HydrophobicContact CH2-CE1 3.92Å; W225-F235 HydrophobicContact CH2-CZ 4.18Å; W225-F235 AromaticContact CZ2-CE1 3.61Å; W225-F235 HydrophobicContact CZ2-CE1 3.61Å; W225-F235 HydrophobicContact CZ2-CZ 4.3Å; W225-F235 HydrophobicContact CZ3-CE1 4.01Å; W225-F235 HydrophobicContact CZ3-CZ 4.14Å; W225-F235 AromaticContact NE1-CD1 3.91Å; W225-F235 AromaticContact NE1-CE1 3.7Å; F235-S237 PolarHBondContact O-N 2.68Å
236	S	58.6	Low	58.3	Low	116 Å²	116	103.4 Å²	103.4	81%	0.811	55%	0.546	S	S	*	.			trans	-66.9	70	166	-53.4	0	0	0	0	107.8	Q238	S236-Q238 PolarHBondContact O-N 2.64Å
237	S	51.5	Low	58.3	Low	38 Å²	38	105.8 Å²	105.8	27%	0.266	56%	0.555	S	S	.	*			trans	-51	134.1	171.2	-171.9	0	0	0	0	105.7	F235 Q239	F235-S237 PolarHBondContact O-N 2.68Å; S237-Q239 PolarHBondContact O-N 3.28Å
238	Q	50.8	Low	58.6	Low	131 Å²	131	103 Å²	103	61%	0.612	55%	0.546	S	S	*	.			trans	-62.3	50.8	176.4	-66.6	172.7	-32.7	0	0	111.6	S236 Q240 R241	S236-Q238 PolarHBondContact O-N 2.64Å; Q238-Q240 PolarHBondContact O-N 3.17Å; Q238-R241 PolarHBondContact O-N 3.05Å
239	Q	47.7	Very low	59.2	Low	125 Å²	125	103.9 Å²	103.9	58%	0.584	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	-9.9	170.3	-75	-172	-76.8	0	0	111.6	S237	S237-Q239 PolarHBondContact O-N 3.28Å
240	Q	46.3	Very low	60.2	Low	175 Å²	175	102.2 Å²	102.2	82%	0.818	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-8.9	173.9	-79.9	-178.2	-22.5	0	0	115.4	Q238	Q238-Q240 PolarHBondContact O-N 3.17Å
241	R	49.4	Very low	61.2	Low	188 Å²	188	101.2 Å²	101.2	71%	0.709	53%	0.531	S	S	*	.	S	Bend	trans	-101	1.7	-172.8	-101	-176	-178.3	178.9	0.6	117.6	Q238	Q238-R241 PolarHBondContact O-N 3.05Å
242	T	49.3	Very low	62.2	Low	125 Å²	125	104.6 Å²	104.6	77%	0.767	54%	0.543	S	S	*	.	S	Bend	trans	-110.4	-10.9	-179.8	-9.8	0	0	0	0	114.7
243	E	48.3	Very low	63	Low	184 Å²	184	102.8 Å²	102.8	86%	0.86	55%	0.546	S	S	*	.	S	Bend	trans	-99.3	-17.7	178.1	-69.1	-176.6	171.8	0	0	113.5
244	E	49	Very low	63.9	Low	175 Å²	175	106.7 Å²	106.7	82%	0.818	57%	0.57	S	S	*	*	S	Bend	trans	-104.1	1.2	-177.4	-76.7	-163.9	158.3	0	0	115.7	N246	E244-N246 VanDerWaalsContact C-N 3.33Å; E244-N246 PolarHBondContact O-N 2.95Å
245	V	54.6	Low	65.1	Low	105 Å²	105	109 Å²	109	64%	0.636	58%	0.576	S	S	*	*			trans	-91.4	83.9	165.9	-170	0	0	0	0	107.1	I247	V245-I247 PolarHBondContact O-N 3.23Å
246	N	59.1	Low	66.2	Low	136 Å²	136	112.9 Å²	112.9	73%	0.727	60%	0.601	S	S	*	*			trans	-41.3	113	158.1	-168.8	14.4	0	0	0	106.5	E244	E244-N246 VanDerWaalsContact C-N 3.33Å; E244-N246 PolarHBondContact O-N 2.95Å
247	I	65.4	Low	67.7	Low	126 Å²	126	112.9 Å²	112.9	65%	0.646	59%	0.591	S	S	*	*			trans	-39.1	131.4	-179.7	-62.1	161	0	0	0	107	V245 S249	V245-I247 PolarHBondContact O-N 3.23Å; I247-S249 WeakPolarHBondContact O-CB 3.13Å; I247-S249 PolarHBondContact O-N 3.5Å; I247-S249 PolarHBondContact O-OG 3.36Å; I247-S249 VanDerWaalsContact O-OG 3.13Å
248	P	73.7	Confident	69.7	Low	57 Å²	57	115.6 Å²	115.6	37%	0.37	60%	0.599	S	S	.	*			trans	-67.7	69.8	-174.7	26.8	-33.5	0	0	0	110.7	T250 E251 L252	P248-T250 VanDerWaalsContact C-N 3.25Å; P248-T250 PolarHBondContact O-N 2.94Å; P248-E251 HydrophobicContact CB-CB 4.1Å; P248-E251 HydrophobicContact CB-CG 4.04Å; P248-E251 PolarHBondContact O-N 3Å; P248-L252 PolarHBondContact O-N 3.36Å
249	S	76.3	Confident	71.6	Confident	64 Å²	64	116 Å²	116	45%	0.448	60%	0.596	S	S	.	*	H	α-helix	trans	-68.7	-31.3	-178	43	0	0	0	0	109.9	I247 A253	I247-S249 WeakPolarHBondContact O-CB 3.13Å; I247-S249 PolarHBondContact O-N 3.5Å; I247-S249 PolarHBondContact O-OG 3.36Å; I247-S249 VanDerWaalsContact O-OG 3.13Å; S249-A253 WeakPolarHBondContact O-CB 3.31Å; S249-A253 PolarHBondContact O-N 3.44Å
250	T	82.2	Confident	73.7	Confident	101 Å²	101	112.2 Å²	112.2	62%	0.62	59%	0.586	S	S	*	*	H	α-helix	trans	-66.2	-44.3	171	51.1	0	0	0	0	112	P248 A253 T254	P248-T250 VanDerWaalsContact C-N 3.25Å; P248-T250 PolarHBondContact O-N 2.94Å; T250-A253 PolarHBondContact O-N 3.35Å; T250-T254 WeakPolarHBondContact O-CG2 3.36Å; T250-T254 PolarHBondContact O-N 3.29Å; T250-T254 PolarHBondContact O-OG1 2.59Å
251	E	84.8	Confident	75.6	Confident	118 Å²	118	111.5 Å²	111.5	55%	0.551	58%	0.575	S	S	*	*	H	α-helix	trans	-66.6	-44.3	178.3	-64.1	-177	166	0	0	111.3	P248 A253 T254 Q255	P248-E251 HydrophobicContact CB-CB 4.1Å; P248-E251 HydrophobicContact CB-CG 4.04Å; P248-E251 PolarHBondContact O-N 3Å; E251-A253 VanDerWaalsContact C-N 3.33Å; E251-A253 PolarHBondContact O-N 3.48Å; E251-T254 WeakPolarHBondContact CA-OG1 3.48Å; E251-T254 PolarHBondContact O-N 2.94Å; E251-T254 PolarHBondContact O-OG1 3.06Å; E251-Q255 WeakPolarHBondContact O-CG 3.22Å; E251-Q255 PolarHBondContact O-N 3.25Å
252	L	86.9	Confident	77.4	Confident	94 Å²	94	108.2 Å²	108.2	49%	0.492	57%	0.568	S	S	.	*	H	α-helix	trans	-61	-41.6	174.3	-70.5	173.5	0	0	0	111.8	P248 Q255 V256	P248-L252 PolarHBondContact O-N 3.36Å; L252-Q255 PolarHBondContact O-N 2.71Å; L252-V256 VanDerWaalsContact O-CG2 3.31Å; L252-V256 WeakPolarHBondContact O-CG2 3.45Å; L252-V256 PolarHBondContact O-N 3.24Å
253	A	86.3	Confident	79.2	Confident	47 Å²	47	109.5 Å²	109.5	39%	0.388	57%	0.569	S	S	.	*	H	α-helix	trans	-63.5	-42	175.9	0	0	0	0	0	111.9	S249 T250 E251 V256 I257	S249-A253 WeakPolarHBondContact O-CB 3.31Å; S249-A253 PolarHBondContact O-N 3.44Å; T250-A253 PolarHBondContact O-N 3.35Å; E251-A253 VanDerWaalsContact C-N 3.33Å; E251-A253 PolarHBondContact O-N 3.48Å; A253-V256 PolarHBondContact O-N 2.93Å; A253-I257 VanDerWaalsContact O-CG1 3.26Å; A253-I257 WeakPolarHBondContact O-CG1 3.4Å; A253-I257 PolarHBondContact O-N 3.47Å
254	T	88.9	Confident	80.7	Confident	83 Å²	83	108.4 Å²	108.4	51%	0.509	56%	0.564	S	S	.	*	H	α-helix	trans	-64.3	-40.2	175.8	49.3	0	0	0	0	112.5	T250 E251 V256 I257 E258	T250-T254 WeakPolarHBondContact O-CG2 3.36Å; T250-T254 PolarHBondContact O-N 3.29Å; T250-T254 PolarHBondContact O-OG1 2.59Å; E251-T254 WeakPolarHBondContact CA-OG1 3.48Å; E251-T254 PolarHBondContact O-N 2.94Å; E251-T254 PolarHBondContact O-OG1 3.06Å; T254-V256 PolarHBondContact O-N 3.13Å; T254-I257 PolarHBondContact O-N 3.39Å; T254-E258 VanDerWaalsContact O-CB 3.32Å; T254-E258 WeakPolarHBondContact O-CB 3.48Å; T254-E258 PolarHBondContact O-N 2.87Å
255	Q	89.4	Confident	82.2	Confident	88 Å²	88	106.2 Å²	106.2	41%	0.411	56%	0.556	S	S	.	*	H	α-helix	trans	-62.6	-43.1	175.8	-72.8	174.8	0	0	0	111.4	E251 L252 E258 Y259	E251-Q255 WeakPolarHBondContact O-CG 3.22Å; E251-Q255 PolarHBondContact O-N 3.25Å; L252-Q255 PolarHBondContact O-N 2.71Å; Q255-E258 PolarHBondContact O-N 3.18Å; Q255-Y259 HydrophobicContact CB-CE2 4.24Å; Q255-Y259 WeakPolarHBondContact O-CD2 3.29Å; Q255-Y259 PolarHBondContact O-N 3.45Å
256	V	91.6	Very high	82.9	Confident	95 Å²	95	109 Å²	109	58%	0.576	57%	0.565	S	S	*	*	H	α-helix	trans	-64.8	-42.3	177.1	172.7	0	0	0	0	111.8	L252 A253 T254 E258 Y259 A260	L252-V256 VanDerWaalsContact O-CG2 3.31Å; L252-V256 WeakPolarHBondContact O-CG2 3.45Å; L252-V256 PolarHBondContact O-N 3.24Å; A253-V256 PolarHBondContact O-N 2.93Å; T254-V256 PolarHBondContact O-N 3.13Å; V256-E258 VanDerWaalsContact C-N 3.31Å; V256-E258 PolarHBondContact O-N 3.48Å; V256-Y259 PolarHBondContact O-N 2.92Å; V256-A260 WeakPolarHBondContact O-CB 3.32Å; V256-A260 PolarHBondContact O-N 3.45Å
257	I	91.1	Very high	82.9	Confident	116 Å²	116	111.7 Å²	111.7	60%	0.595	59%	0.586	S	S	*	*	H	α-helix	trans	-63.5	-39.5	175.6	-68.6	166	0	0	0	110.7	A253 T254 A260 R261	A253-I257 VanDerWaalsContact O-CG1 3.26Å; A253-I257 WeakPolarHBondContact O-CG1 3.4Å; A253-I257 PolarHBondContact O-N 3.47Å; T254-I257 PolarHBondContact O-N 3.39Å; I257-A260 PolarHBondContact O-N 3.31Å; I257-R261 WeakPolarHBondContact O-CB 3.36Å; I257-R261 PolarHBondContact O-N 3.01Å
258	E	92.5	Very high	83.8	Confident	94 Å²	94	111 Å²	111	44%	0.439	58%	0.583	S	S	.	*	H	α-helix	trans	-70.3	-39.2	179.8	-166.8	157	-144.8	0	0	112.3	T254 Q255 V256 R261 Q262	T254-E258 VanDerWaalsContact O-CB 3.32Å; T254-E258 WeakPolarHBondContact O-CB 3.48Å; T254-E258 PolarHBondContact O-N 2.87Å; Q255-E258 PolarHBondContact O-N 3.18Å; V256-E258 VanDerWaalsContact C-N 3.31Å; V256-E258 PolarHBondContact O-N 3.48Å; E258-R261 PolarHBondContact O-N 2.97Å; E258-R261 IonicContact OE1-NH2 3.79Å; E258-Q262 VanDerWaalsContact O-CG 3.31Å; E258-Q262 WeakPolarHBondContact O-CG 3.31Å; E258-Q262 PolarHBondContact O-N 3.25Å
259	Y	91.2	Very high	84.4	Confident	141 Å²	141	113.8 Å²	113.8	55%	0.553	59%	0.594	S	S	*	*	H	α-helix	trans	-62.4	-44.8	170.3	-66.2	-36.8	0	0	0	112.1	Q255 V256 R261 Q262 L263	Q255-Y259 HydrophobicContact CB-CE2 4.24Å; Q255-Y259 WeakPolarHBondContact O-CD2 3.29Å; Q255-Y259 PolarHBondContact O-N 3.45Å; V256-Y259 PolarHBondContact O-N 2.92Å; Y259-R261 VanDerWaalsContact C-N 3.34Å; Y259-R261 PolarHBondContact O-N 3.36Å; Y259-Q262 PolarHBondContact O-N 3.41Å; Y259-L263 WeakPolarHBondContact O-CG 3.35Å; Y259-L263 PolarHBondContact O-N 3.04Å
260	A	90.8	Very high	84.8	Confident	44 Å²	44	116.6 Å²	116.6	36%	0.364	60%	0.603	S	S	.	*	H	α-helix	trans	-61.1	-43.9	176	0	0	0	0	0	111.3	V256 I257 Q262 L263 E264	V256-A260 WeakPolarHBondContact O-CB 3.32Å; V256-A260 PolarHBondContact O-N 3.45Å; I257-A260 PolarHBondContact O-N 3.31Å; A260-Q262 PolarHBondContact O-N 2.89Å; A260-L263 PolarHBondContact O-N 2.95Å; A260-E264 WeakPolarHBondContact O-CB 3.26Å; A260-E264 PolarHBondContact O-N 3.19Å
261	R	87.8	Confident	85	Confident	160 Å²	160	117.5 Å²	117.5	60%	0.604	60%	0.602	S	S	*	*	H	α-helix	trans	-60.7	-42.9	176.2	-171.6	-178.2	73.4	144.3	-3.1	112.3	I257 E258 Y259 L263 M265	I257-R261 WeakPolarHBondContact O-CB 3.36Å; I257-R261 PolarHBondContact O-N 3.01Å; E258-R261 PolarHBondContact O-N 2.97Å; E258-R261 IonicContact OE1-NH2 3.79Å; Y259-R261 VanDerWaalsContact C-N 3.34Å; Y259-R261 PolarHBondContact O-N 3.36Å; R261-L263 VanDerWaalsContact C-N 3.33Å; R261-M265 VanDerWaalsContact O-CB 3.29Å; R261-M265 WeakPolarHBondContact O-CB 3.32Å; R261-M265 PolarHBondContact O-N 2.89Å
262	Q	86.8	Confident	85	Confident	119 Å²	119	117.4 Å²	117.4	56%	0.556	61%	0.605	S	S	*	*	H	α-helix	trans	-67.9	-32.4	178.7	-73.6	174.6	7.1	0	0	112.7	E258 Y259 A260	E258-Q262 VanDerWaalsContact O-CG 3.31Å; E258-Q262 WeakPolarHBondContact O-CG 3.31Å; E258-Q262 PolarHBondContact O-N 3.25Å; Y259-Q262 PolarHBondContact O-N 3.41Å; A260-Q262 PolarHBondContact O-N 2.89Å
263	L	85.5	Confident	84.8	Confident	152 Å²	152	119 Å²	119	80%	0.796	61%	0.612	S	S	*	*	H	α-helix	trans	-77.6	-36.1	177.1	-72.7	168.7	0	0	0	113.1	Y259 A260 R261	Y259-L263 WeakPolarHBondContact O-CG 3.35Å; Y259-L263 PolarHBondContact O-N 3.04Å; A260-L263 PolarHBondContact O-N 2.95Å; R261-L263 VanDerWaalsContact C-N 3.33Å
264	E	80.6	Confident	84.7	Confident	161 Å²	161	124.1 Å²	124.1	75%	0.752	63%	0.628	S	S	*	*	H	α-helix	trans	-83.8	-17	178.9	-73.1	-174	162.3	0	0	113.5	A260 I266	A260-E264 WeakPolarHBondContact O-CB 3.26Å; A260-E264 PolarHBondContact O-N 3.19Å; E264-I266 PolarHBondContact O-N 3.04Å
265	M	80.9	Confident	84.4	Confident	130 Å²	130	127.3 Å²	127.3	64%	0.64	64%	0.637	S	S	*	*	S	Bend	trans	-69.8	103.8	173.1	-165.1	177.5	88.2	0	0	109.1	R261 V267	R261-M265 VanDerWaalsContact O-CB 3.29Å; R261-M265 WeakPolarHBondContact O-CB 3.32Å; R261-M265 PolarHBondContact O-N 2.89Å; M265-V267 PolarHBondContact O-N 2.93Å
266	I	69.4	Low	84	Confident	162 Å²	162	130.6 Å²	130.6	83%	0.831	66%	0.656	S	S	*	*			trans	-62	118.2	171.4	-55.7	171.9	0	0	0	107.5	E264	E264-I266 PolarHBondContact O-N 3.04Å
267	V	59.7	Low	83.3	Confident	193 Å²	193	133.8 Å²	133.8	100%	1.17	66%	0.664	S	S	*	*			trans	-74.6	0	168.7	179	0	0	0	0	109.8	M265	M265-V267 PolarHBondContact O-N 2.93Å

Retrieved 267 of 267 residues in 342.9 ms (Link to these results)

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