A0A087XND2_POEFO Loading...

Spermatogenesis associated 2

AlphaFold DB , UniProt , Accession A0A087XND2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 566 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	64.1	Low	85.9	Confident	35 Å²	35	62.4 Å²	62.4	17%	0.172	31%	0.311	C	S	.	.				0	161.9	0	-170.5	175.3	-80.7	0	0	107.5	A3 R6 L53 Y56 P58 H62	M1-A3 PolarHBondContact O-N 3.13Å; M1-R6 HydrophobicContact CB-CB 4.16Å; M1-R6 HydrophobicContact CG-CB 3.99Å; M1-R6 HydrophobicContact SD-CB 3.56Å; M1-R6 VanDerWaalsContact SD-CB 3.56Å; M1-R6 HydrophobicContact SD-CG 3.83Å; M1-L53 HydrophobicContact CE-CD2 3.47Å; M1-L53 VanDerWaalsContact CE-CD2 3.47Å; M1-L53 HydrophobicContact CE-CG 4.07Å; M1-Y56 VanDerWaalsContact C-CE1 3.47Å; M1-Y56 HydrophobicContact CB-CD1 4.45Å; M1-Y56 HydrophobicContact CG-CD1 4.03Å; M1-P58 HydrophobicContact CB-CB 4.37Å; M1-H62 PolarHBondContact N-O 2.86Å
2	D	75.3	Confident	86.5	Confident	52 Å²	52	70.3 Å²	70.3	28%	0.278	34%	0.335	S	S	.	.			trans	-57.3	129.2	166.8	165	43.9	0	0	0	107.8	K4 L5 R6 Y56	D2-K4 PolarHBondContact O-N 2.97Å; D2-K4 PolarHBondContact OD1-N 3.39Å; D2-K4 WeakPolarHBondContact OD2-CB 3.48Å; D2-K4 PolarHBondContact OD2-N 2.99Å; D2-L5 HydrophobicContact CB-CB 4.22Å; D2-L5 HydrophobicContact CB-CD1 4.34Å; D2-L5 HydrophobicContact CB-CG 4.48Å; D2-L5 WeakPolarHBondContact OD2-CB 3.47Å; D2-L5 WeakPolarHBondContact OD2-CG 3.41Å; D2-L5 PolarHBondContact OD2-N 3.39Å; D2-R6 WeakPolarHBondContact O-CB 3.31Å; D2-R6 PolarHBondContact O-N 3.28Å; D2-Y56 HydrophobicContact CB-CD2 3.91Å; D2-Y56 HydrophobicContact CB-CE1 4.31Å; D2-Y56 HydrophobicContact CB-CE2 3.43Å; D2-Y56 VanDerWaalsContact CB-CE2 3.43Å
3	A	78.6	Confident	87.2	Confident	78 Å²	78	65.2 Å²	65.2	65%	0.645	31%	0.31	S	S	*	.	H	α-helix	trans	-61.1	-39	-175.8	0	0	0	0	0	110.3	M1 E7	M1-A3 PolarHBondContact O-N 3.13Å; A3-E7 WeakPolarHBondContact O-CB 3.47Å; A3-E7 PolarHBondContact O-N 3.24Å
4	K	86	Confident	87.6	Confident	146 Å²	146	61.9 Å²	61.9	64%	0.635	30%	0.296	S	S	*	.	H	α-helix	trans	-70.4	-51	-179.1	-173.1	-179.1	177.8	-176	0	112	D2 R6 E7 D8	D2-K4 PolarHBondContact O-N 2.97Å; D2-K4 PolarHBondContact OD1-N 3.39Å; D2-K4 WeakPolarHBondContact OD2-CB 3.48Å; D2-K4 PolarHBondContact OD2-N 2.99Å; K4-R6 VanDerWaalsContact C-N 3.33Å; K4-R6 PolarHBondContact O-N 2.82Å; K4-E7 PolarHBondContact O-N 3.36Å; K4-D8 WeakPolarHBondContact O-CB 3.44Å; K4-D8 PolarHBondContact O-N 2.89Å
5	L	86.6	Confident	87.9	Confident	69 Å²	69	61.5 Å²	61.5	36%	0.361	30%	0.299	S	S	.	.	H	α-helix	trans	-61.9	-37.4	177	-74	173.4	0	0	0	112.8	D2 L9 L52 Y56	D2-L5 HydrophobicContact CB-CB 4.22Å; D2-L5 HydrophobicContact CB-CD1 4.34Å; D2-L5 HydrophobicContact CB-CG 4.48Å; D2-L5 WeakPolarHBondContact OD2-CB 3.47Å; D2-L5 WeakPolarHBondContact OD2-CG 3.41Å; D2-L5 PolarHBondContact OD2-N 3.39Å; L5-L9 WeakPolarHBondContact O-CB 3.4Å; L5-L9 PolarHBondContact O-N 2.99Å; L5-L52 HydrophobicContact CD1-CD2 4.36Å; L5-L52 HydrophobicContact CD2-CD2 4.4Å; L5-Y56 HydrophobicContact CD1-CD2 4.31Å
6	R	88.1	Confident	88	Confident	29 Å²	29	60.5 Å²	60.5	11%	0.109	30%	0.304	C	S	.	.	H	α-helix	trans	-64.2	-43.4	173.9	-172.1	170.9	167.1	130.3	-10.7	111.4	M1 D2 K4 L9 F10 R63 F168 E169	M1-R6 HydrophobicContact CB-CB 4.16Å; M1-R6 HydrophobicContact CG-CB 3.99Å; M1-R6 HydrophobicContact SD-CB 3.56Å; M1-R6 VanDerWaalsContact SD-CB 3.56Å; M1-R6 HydrophobicContact SD-CG 3.83Å; D2-R6 WeakPolarHBondContact O-CB 3.31Å; D2-R6 PolarHBondContact O-N 3.28Å; K4-R6 VanDerWaalsContact C-N 3.33Å; K4-R6 PolarHBondContact O-N 2.82Å; R6-L9 PolarHBondContact O-N 2.83Å; R6-F10 VanDerWaalsContact O-CB 3.31Å; R6-F10 WeakPolarHBondContact O-CB 3.37Å; R6-F10 PolarHBondContact O-N 3.05Å; R6-R63 PolarHBondContact NH1-O 2.94Å; R6-F168 HydrophobicContact CG-CE1 3.94Å; R6-F168 HydrophobicContact CG-CZ 4.49Å; R6-E169 IonicContact CZ-OE1 2.65Å; R6-E169 IonicContact NH1-OE1 3.62Å; R6-E169 IonicContact NH2-OE1 2.89Å; R6-E169 PolarHBondContact NH2-OE1 2.95Å
7	E	90.9	Very high	88	Confident	81 Å²	81	57.8 Å²	57.8	38%	0.379	29%	0.291	S	S	.	.	H	α-helix	trans	-71.3	-35.7	-178.8	-174.7	41.8	-129.7	0	0	112	A3 K4 F10 R11	A3-E7 WeakPolarHBondContact O-CB 3.47Å; A3-E7 PolarHBondContact O-N 3.24Å; K4-E7 PolarHBondContact O-N 3.36Å; E7-F10 PolarHBondContact O-N 2.83Å; E7-R11 WeakPolarHBondContact O-CB 3.36Å; E7-R11 PolarHBondContact O-N 3.35Å; E7-R11 PolarHBondContact O-NE 2.9Å; E7-R11 WeakPolarHBondContact OE1-CD 3.47Å; E7-R11 WeakPolarHBondContact OE1-CG 3.36Å; E7-R11 IonicContact OE1-CZ 2.75Å; E7-R11 IonicContact OE1-NE 3.62Å; E7-R11 PolarHBondContact OE1-NE 3.26Å
8	D	92.6	Very high	87.8	Confident	50 Å²	50	61 Å²	61	27%	0.267	30%	0.304	S	S	.	.	H	α-helix	trans	-66.2	-39.7	170.7	-77.8	-35.4	0	0	0	111.7	K4 R11 R12	K4-D8 WeakPolarHBondContact O-CB 3.44Å; K4-D8 PolarHBondContact O-N 2.89Å; D8-R11 IonicContact OD1-CZ 2.67Å; D8-R11 IonicContact OD1-NH1 3.75Å; D8-R11 PolarHBondContact OD1-NH1 3.36Å; D8-R11 IonicContact OD1-NH2 3.88Å; D8-R11 PolarHBondContact OD1-NH2 3.38Å; D8-R12 VanDerWaalsContact O-CG 3.26Å; D8-R12 WeakPolarHBondContact O-CG 3.31Å; D8-R12 PolarHBondContact O-N 2.84Å; D8-R12 VanDerWaalsContact O-N 3.11Å
9	L	93.4	Very high	87.5	Confident	3 Å²	3	67.5 Å²	67.5	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-68.8	-40.3	174.1	-176	66.2	0	0	0	111.8	L5 R6 R12 Y13 L45 T48 A49 L52 F168 L172	L5-L9 WeakPolarHBondContact O-CB 3.4Å; L5-L9 PolarHBondContact O-N 2.99Å; R6-L9 PolarHBondContact O-N 2.83Å; L9-R12 PolarHBondContact O-N 2.89Å; L9-Y13 WeakPolarHBondContact O-CB 3.4Å; L9-Y13 PolarHBondContact O-N 3.16Å; L9-L45 HydrophobicContact CD1-CD1 4.03Å; L9-T48 HydrophobicContact CD1-CG2 4.35Å; L9-A49 HydrophobicContact CD2-CB 3.93Å; L9-L52 HydrophobicContact CB-CD1 4.21Å; L9-L52 HydrophobicContact CD1-CD1 4.03Å; L9-L52 HydrophobicContact CD2-CD1 3.88Å; L9-L52 HydrophobicContact CG-CD1 4.25Å; L9-F168 HydrophobicContact CB-CZ 4.17Å; L9-F168 HydrophobicContact CD2-CE2 4.15Å; L9-F168 HydrophobicContact CD2-CZ 3.9Å; L9-F168 HydrophobicContact CG-CE2 3.9Å; L9-F168 HydrophobicContact CG-CZ 3.89Å; L9-L172 HydrophobicContact CD2-CD2 4.07Å
10	F	94.3	Very high	86.9	Confident	28 Å²	28	69.4 Å²	69.4	12%	0.123	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-46	176.3	177.9	-122.1	0	0	0	111.7	R6 E7 R12 Y13 V14 R164 F168	R6-F10 VanDerWaalsContact O-CB 3.31Å; R6-F10 WeakPolarHBondContact O-CB 3.37Å; R6-F10 PolarHBondContact O-N 3.05Å; E7-F10 PolarHBondContact O-N 2.83Å; F10-R12 VanDerWaalsContact C-N 3.34Å; F10-R12 PolarHBondContact O-N 2.92Å; F10-Y13 WeakPolarHBondContact O-CB 3.46Å; F10-Y13 PolarHBondContact O-N 3.02Å; F10-Y13 VanDerWaalsContact O-N 3.15Å; F10-V14 HydrophobicContact CD2-CG2 4.06Å; F10-V14 HydrophobicContact CE1-CG2 4.33Å; F10-V14 HydrophobicContact CE2-CG2 3.65Å; F10-V14 HydrophobicContact CZ-CG2 3.81Å; F10-V14 WeakPolarHBondContact O-CG2 3.46Å; F10-V14 PolarHBondContact O-N 3.45Å; F10-R164 HydrophobicContact CE2-CB 4.2Å; F10-R164 HydrophobicContact CZ-CB 4.06Å; F10-F168 HydrophobicContact CB-CD1 4.28Å; F10-F168 HydrophobicContact CB-CE1 3.95Å; F10-F168 HydrophobicContact CB-CE2 4.32Å; F10-F168 HydrophobicContact CB-CZ 3.96Å; F10-F168 HydrophobicContact CD2-CB 3.76Å; F10-F168 AromaticContact CD2-CD1 3.8Å; F10-F168 HydrophobicContact CD2-CD1 3.8Å; F10-F168 HydrophobicContact CD2-CD2 4.05Å; F10-F168 HydrophobicContact CD2-CE1 4.33Å; F10-F168 AromaticContact CD2-CG 3.6Å; F10-F168 HydrophobicContact CD2-CG 3.6Å; F10-F168 HydrophobicContact CE2-CB 3.97Å; F10-F168 HydrophobicContact CE2-CG 4.31Å; F10-F168 HydrophobicContact CG-CD1 4.4Å
11	R	94.5	Very high	85.7	Confident	115 Å²	115	69.9 Å²	69.9	43%	0.434	34%	0.337	S	S	.	.	H	α-helix	trans	-61.4	-39.3	173.9	-83.7	177.8	-79.7	111.7	1.3	112.6	E7 D8 T15	E7-R11 WeakPolarHBondContact O-CB 3.36Å; E7-R11 PolarHBondContact O-N 3.35Å; E7-R11 PolarHBondContact O-NE 2.9Å; E7-R11 WeakPolarHBondContact OE1-CD 3.47Å; E7-R11 WeakPolarHBondContact OE1-CG 3.36Å; E7-R11 IonicContact OE1-CZ 2.75Å; E7-R11 IonicContact OE1-NE 3.62Å; E7-R11 PolarHBondContact OE1-NE 3.26Å; D8-R11 IonicContact OD1-CZ 2.67Å; D8-R11 IonicContact OD1-NH1 3.75Å; D8-R11 PolarHBondContact OD1-NH1 3.36Å; D8-R11 IonicContact OD1-NH2 3.88Å; D8-R11 PolarHBondContact OD1-NH2 3.38Å; R11-T15 VanDerWaalsContact O-CB 3.28Å; R11-T15 WeakPolarHBondContact O-CB 3.32Å; R11-T15 PolarHBondContact O-N 2.94Å; R11-T15 PolarHBondContact O-OG1 3.24Å
12	R	94.1	Very high	85.1	Confident	158 Å²	158	73.9 Å²	73.9	60%	0.596	36%	0.356	S	S	*	.	H	α-helix	trans	-62.5	-42.1	172.4	-72.8	171	-172.9	-144.8	2.8	112.1	D8 L9 F10 T15 A16 L45	D8-R12 VanDerWaalsContact O-CG 3.26Å; D8-R12 WeakPolarHBondContact O-CG 3.31Å; D8-R12 PolarHBondContact O-N 2.84Å; D8-R12 VanDerWaalsContact O-N 3.11Å; L9-R12 PolarHBondContact O-N 2.89Å; F10-R12 VanDerWaalsContact C-N 3.34Å; F10-R12 PolarHBondContact O-N 2.92Å; R12-T15 PolarHBondContact O-N 2.83Å; R12-A16 PolarHBondContact O-N 3.15Å; R12-L45 HydrophobicContact CB-CD1 4Å
13	Y	94.7	Very high	83.6	Confident	4 Å²	4	73.7 Å²	73.7	2%	0.016	37%	0.366	C	S	.	.	H	α-helix	trans	-63	-51.4	177.3	175.1	-100.2	0	0	0	112.3	L9 F10 T15 A16 L17 L45 E96 A167 F168 F171	L9-Y13 WeakPolarHBondContact O-CB 3.4Å; L9-Y13 PolarHBondContact O-N 3.16Å; F10-Y13 WeakPolarHBondContact O-CB 3.46Å; F10-Y13 PolarHBondContact O-N 3.02Å; F10-Y13 VanDerWaalsContact O-N 3.15Å; Y13-T15 VanDerWaalsContact C-N 3.3Å; Y13-T15 PolarHBondContact O-N 3.42Å; Y13-A16 WeakPolarHBondContact O-CA 3.46Å; Y13-A16 WeakPolarHBondContact O-CB 3.07Å; Y13-A16 PolarHBondContact O-N 3.4Å; Y13-L17 HydrophobicContact CD1-CD1 4.21Å; Y13-L17 HydrophobicContact CD1-CG 4.49Å; Y13-L17 HydrophobicContact CE1-CD1 3.56Å; Y13-L17 HydrophobicContact CE1-CG 4.1Å; Y13-L17 HydrophobicContact CE2-CD2 4.31Å; Y13-L17 HydrophobicContact CE2-CG 4.5Å; Y13-L17 PolarHBondContact O-N 2.87Å; Y13-L45 HydrophobicContact CD2-CD2 3.99Å; Y13-E96 WeakPolarHBondContact CE2-OE1 3.37Å; Y13-E96 VanDerWaalsContact CZ-OE1 3.32Å; Y13-E96 VanDerWaalsContact OH-CD 3.28Å; Y13-E96 VanDerWaalsContact OH-CG 3.31Å; Y13-E96 WeakPolarHBondContact OH-CG 3.07Å; Y13-E96 PolarHBondContact OH-OE1 2.86Å; Y13-A167 HydrophobicContact CE1-CB 4.21Å; Y13-A167 WeakPolarHBondContact OH-CB 3.4Å; Y13-F168 HydrophobicContact CD1-CB 3.87Å; Y13-F168 AromaticContact CD1-CD2 3.62Å; Y13-F168 HydrophobicContact CD1-CD2 3.62Å; Y13-F168 HydrophobicContact CD1-CG 4.19Å; Y13-F168 HydrophobicContact CD2-CD2 4.23Å; Y13-F168 HydrophobicContact CE1-CB 3.87Å; Y13-F168 HydrophobicContact CE1-CD2 4.28Å; Y13-F168 AromaticContact CG-CD2 3.6Å; Y13-F168 HydrophobicContact CG-CD2 3.6Å; Y13-F168 HydrophobicContact CG-CE2 4.25Å; Y13-F171 HydrophobicContact CD2-CB 4.29Å; Y13-F171 AromaticContact CD2-CD1 3.86Å; Y13-F171 HydrophobicContact CD2-CD1 3.86Å; Y13-F171 HydrophobicContact CD2-CD2 4.07Å; Y13-F171 HydrophobicContact CD2-CE1 4.19Å; Y13-F171 HydrophobicContact CD2-CE2 4.4Å; Y13-F171 AromaticContact CD2-CG 3.8Å; Y13-F171 HydrophobicContact CD2-CG 3.8Å; Y13-F171 HydrophobicContact CD2-CZ 4.47Å; Y13-F171 HydrophobicContact CE2-CB 3.7Å; Y13-F171 HydrophobicContact CE2-CD1 4.13Å; Y13-F171 AromaticContact CE2-CD2 3.84Å; Y13-F171 HydrophobicContact CE2-CD2 3.84Å; Y13-F171 AromaticContact CE2-CG 3.61Å; Y13-F171 HydrophobicContact CE2-CG 3.61Å
14	V	93.1	Very high	81.9	Confident	19 Å²	19	71.9 Å²	71.9	12%	0.115	36%	0.356	C	S	.	.	H	α-helix	trans	-59.7	-42	175.8	176.1	0	0	0	0	111.1	F10 A16 L17 E18 R164	F10-V14 HydrophobicContact CD2-CG2 4.06Å; F10-V14 HydrophobicContact CE1-CG2 4.33Å; F10-V14 HydrophobicContact CE2-CG2 3.65Å; F10-V14 HydrophobicContact CZ-CG2 3.81Å; F10-V14 WeakPolarHBondContact O-CG2 3.46Å; F10-V14 PolarHBondContact O-N 3.45Å; V14-A16 VanDerWaalsContact C-N 3.26Å; V14-A16 PolarHBondContact O-N 3.27Å; V14-L17 PolarHBondContact O-N 3.35Å; V14-E18 HydrophobicContact CG1-CG 4.44Å; V14-E18 WeakPolarHBondContact CG1-OE1 3.36Å; V14-E18 WeakPolarHBondContact O-CG 3.02Å; V14-E18 PolarHBondContact O-N 3.48Å; V14-R164 HydrophobicContact CG2-CG 4.46Å
15	T	92.1	Very high	79.8	Confident	56 Å²	56	74.9 Å²	74.9	34%	0.344	36%	0.364	S	S	.	.	H	α-helix	trans	-60.2	-34	174.1	-56.8	0	0	0	0	112.5	R11 R12 Y13 R19	R11-T15 VanDerWaalsContact O-CB 3.28Å; R11-T15 WeakPolarHBondContact O-CB 3.32Å; R11-T15 PolarHBondContact O-N 2.94Å; R11-T15 PolarHBondContact O-OG1 3.24Å; R12-T15 PolarHBondContact O-N 2.83Å; Y13-T15 VanDerWaalsContact C-N 3.3Å; Y13-T15 PolarHBondContact O-N 3.42Å; T15-R19 WeakPolarHBondContact O-CD 3.46Å; T15-R19 WeakPolarHBondContact O-CG 3.44Å; T15-R19 PolarHBondContact O-N 3.06Å
16	A	90.1	Very high	77.4	Confident	45 Å²	45	76.8 Å²	76.8	37%	0.372	38%	0.379	S	S	.	.	H	α-helix	trans	-73.9	-39.1	176.2	0	0	0	0	0	112.1	R12 Y13 V14 R19 L45	R12-A16 PolarHBondContact O-N 3.15Å; Y13-A16 WeakPolarHBondContact O-CA 3.46Å; Y13-A16 WeakPolarHBondContact O-CB 3.07Å; Y13-A16 PolarHBondContact O-N 3.4Å; V14-A16 VanDerWaalsContact C-N 3.26Å; V14-A16 PolarHBondContact O-N 3.27Å; A16-R19 PolarHBondContact O-N 2.79Å; A16-L45 HydrophobicContact CB-CD2 4.2Å
17	L	87	Confident	75	Confident	15 Å²	15	80 Å²	80	8%	0.079	42%	0.421	C	S	.	.	H	α-helix	trans	-61.4	-44.9	173.3	-64.1	-173.3	0	0	0	111.9	Y13 V14 R19 R20 T100 L103	Y13-L17 HydrophobicContact CD1-CD1 4.21Å; Y13-L17 HydrophobicContact CD1-CG 4.49Å; Y13-L17 HydrophobicContact CE1-CD1 3.56Å; Y13-L17 HydrophobicContact CE1-CG 4.1Å; Y13-L17 HydrophobicContact CE2-CD2 4.31Å; Y13-L17 HydrophobicContact CE2-CG 4.5Å; Y13-L17 PolarHBondContact O-N 2.87Å; V14-L17 PolarHBondContact O-N 3.35Å; L17-R19 PolarHBondContact O-N 3.32Å; L17-R20 WeakPolarHBondContact O-CB 3.27Å; L17-R20 PolarHBondContact O-N 3.01Å; L17-T100 HydrophobicContact CD1-CG2 3.89Å; L17-T100 HydrophobicContact CD2-CG2 3.41Å; L17-T100 VanDerWaalsContact CD2-CG2 3.41Å; L17-T100 HydrophobicContact CG-CG2 4.29Å; L17-L103 HydrophobicContact CD1-CD1 4.42Å
18	E	84.8	Confident	72.3	Confident	115 Å²	115	80.4 Å²	80.4	54%	0.537	44%	0.438	S	S	.	.	H	α-helix	trans	-67.9	-16.9	179.3	-69.9	170.9	176.6	0	0	112.6	V14	V14-E18 HydrophobicContact CG1-CG 4.44Å; V14-E18 WeakPolarHBondContact CG1-OE1 3.36Å; V14-E18 WeakPolarHBondContact O-CG 3.02Å; V14-E18 PolarHBondContact O-N 3.48Å
19	R	82.7	Confident	69.9	Low	185 Å²	185	81.5 Å²	81.5	70%	0.698	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	7.8	170.4	-69.8	170.5	-174.2	-179.6	3.2	114.2	T15 A16 L17 P21	T15-R19 WeakPolarHBondContact O-CD 3.46Å; T15-R19 WeakPolarHBondContact O-CG 3.44Å; T15-R19 PolarHBondContact O-N 3.06Å; A16-R19 PolarHBondContact O-N 2.79Å; L17-R19 PolarHBondContact O-N 3.32Å; R19-P21 VanDerWaalsContact O-CD 3.25Å; R19-P21 WeakPolarHBondContact O-CD 3.45Å
20	R	75.4	Confident	67.5	Low	104 Å²	104	85.9 Å²	85.9	39%	0.392	49%	0.493	S	S	.	.			trans	-97	23.3	176.5	-153	-176.5	177.2	-177.6	0.1	115.5	L17 T100 L104	L17-R20 WeakPolarHBondContact O-CB 3.27Å; L17-R20 PolarHBondContact O-N 3.01Å; R20-T100 PolarHBondContact NH1-OG1 3.5Å; R20-L104 HydrophobicContact CB-CD1 4.16Å
21	P	60.6	Low	65.1	Low	80 Å²	80	89.4 Å²	89.4	52%	0.519	52%	0.516	S	S	.	.			trans	-66.3	162.6	-179.9	31.4	-33.9	0	0	0	111.5	R19 G23 R38	R19-P21 VanDerWaalsContact O-CD 3.25Å; R19-P21 WeakPolarHBondContact O-CD 3.45Å; P21-G23 PolarHBondContact O-N 3.11Å; P21-R38 PolarHBondContact O-NH2 2.91Å
22	E	51.5	Low	63.2	Low	119 Å²	119	90.5 Å²	90.5	56%	0.556	53%	0.53	S	S	*	.			trans	-45.4	112.1	-148.6	-58.3	-171.6	128.4	0	0	115.1	G24 F105 K108	E22-G24 PolarHBondContact O-N 3.04Å; E22-F105 HydrophobicContact CG-CE1 3.5Å; E22-F105 HydrophobicContact CG-CZ 3.9Å; E22-K108 WeakPolarHBondContact OE1-CE 3.32Å; E22-K108 IonicContact OE1-NZ 3.62Å; E22-K108 PolarHBondContact OE1-NZ 3.23Å
23	G	45.6	Very low	61.1	Low	48 Å²	48	89 Å²	89	50%	0.495	53%	0.53	S	S	.	.			trans	-65.3	109.7	147.6	0	0	0	0	0	106.7	P21 Y25	P21-G23 PolarHBondContact O-N 3.11Å; G23-Y25 PolarHBondContact O-N 3.03Å
24	G	41.3	Very low	59.3	Low	41 Å²	41	90.4 Å²	90.4	42%	0.423	55%	0.545	S	S	.	.			trans	-73.2	128.4	-159.3	0	0	0	0	0	114.4	E22 T26	E22-G24 PolarHBondContact O-N 3.04Å; G24-T26 PolarHBondContact O-N 3.09Å
25	Y	42	Very low	57.5	Low	208 Å²	208	94.2 Å²	94.2	82%	0.816	57%	0.565	S	S	*	*	S	Bend	trans	-70.1	28.8	154.2	-80	-89.8	0	0	0	112.3	G23	G23-Y25 PolarHBondContact O-N 3.03Å
26	T	36.1	Very low	56.1	Low	109 Å²	109	97.2 Å²	97.2	67%	0.669	57%	0.574	S	S	*	*	S	Bend	trans	-107.9	117.5	173.6	50.4	0	0	0	0	107.2	G24 A28	G24-T26 PolarHBondContact O-N 3.09Å; T26-A28 PolarHBondContact O-N 2.83Å
27	G	37.8	Very low	55	Low	97 Å²	97	97.9 Å²	97.9	100%	1	58%	0.575	S	S	*	*	S	Bend	trans	-69.7	59.9	-165.2	0	0	0	0	0	116.7
28	A	35.4	Very low	54	Low	89 Å²	89	101.9 Å²	101.9	74%	0.736	59%	0.589	S	S	*	*	S	Bend	trans	-146.8	88.3	177.6	0	0	0	0	0	111.2	T26	T26-A28 PolarHBondContact O-N 2.83Å
29	G	41.4	Very low	53.4	Low	73 Å²	73	101.8 Å²	101.8	75%	0.753	59%	0.588	S	S	*	*			trans	56.9	67.4	155.1	0	0	0	0	0	118.1	T31	G29-T31 PolarHBondContact O-N 3.11Å
30	S	42.8	Very low	53.2	Low	96 Å²	96	100 Å²	100	67%	0.671	59%	0.586	S	S	*	*			trans	-60.9	122.7	154.3	-174.8	0	0	0	0	108.9
31	T	45	Very low	53.4	Low	102 Å²	102	99.9 Å²	99.9	63%	0.626	59%	0.593	S	S	*	*			trans	-79.3	123.2	178.2	46.5	0	0	0	0	110.1	G29 E33 G34	G29-T31 PolarHBondContact O-N 3.11Å; T31-E33 PolarHBondContact O-N 3.27Å; T31-G34 PolarHBondContact O-N 3.4Å
32	L	54.3	Low	54.6	Low	137 Å²	137	98.9 Å²	98.9	72%	0.717	59%	0.588	S	S	*	*	H	α-helix	trans	-52.7	-28	-178.3	-71.9	164.8	0	0	0	113.7	K36	L32-K36 WeakPolarHBondContact O-CD 3.45Å; L32-K36 WeakPolarHBondContact O-CG 3.38Å; L32-K36 PolarHBondContact O-N 2.73Å
33	E	49	Very low	56.5	Low	128 Å²	128	97.5 Å²	97.5	60%	0.598	58%	0.581	S	S	*	*	H	α-helix	trans	-71.2	-35.3	175.9	-60.3	-50.8	112.4	0	0	113.6	T31 K36 S37	T31-E33 PolarHBondContact O-N 3.27Å; E33-K36 IonicContact OE1-NZ 3.57Å; E33-K36 PolarHBondContact OE1-NZ 2.8Å; E33-S37 WeakPolarHBondContact O-CB 3.45Å; E33-S37 PolarHBondContact O-N 3.35Å
34	G	56.2	Low	58.7	Low	33 Å²	33	97.6 Å²	97.6	34%	0.34	58%	0.578	S	S	.	*	H	α-helix	trans	-66.8	-38.6	178.9	0	0	0	0	0	112.2	T31 S37 R38	T31-G34 PolarHBondContact O-N 3.4Å; G34-S37 PolarHBondContact O-N 2.71Å; G34-R38 WeakPolarHBondContact O-CG 3.21Å; G34-R38 PolarHBondContact O-N 3.4Å
35	D	56.1	Low	61.2	Low	99 Å²	99	96.8 Å²	96.8	53%	0.529	56%	0.564	S	S	.	*	H	α-helix	trans	-76.2	-40.6	-179.9	-157.6	54.4	0	0	0	112.3	S37 R38 H39	D35-S37 VanDerWaalsContact C-N 3.26Å; D35-S37 PolarHBondContact O-N 3.03Å; D35-R38 PolarHBondContact O-N 3.33Å; D35-R38 VanDerWaalsContact O-N 3.16Å; D35-H39 PolarHBondContact O-N 3.35Å
36	K	62.2	Low	63.7	Low	119 Å²	119	87.3 Å²	87.3	52%	0.517	53%	0.527	S	S	.	.	H	α-helix	trans	-54	-42.6	167.2	-72.7	168.6	-168.4	173.9	0	112	L32 E33 K40	L32-K36 WeakPolarHBondContact O-CD 3.45Å; L32-K36 WeakPolarHBondContact O-CG 3.38Å; L32-K36 PolarHBondContact O-N 2.73Å; E33-K36 IonicContact OE1-NZ 3.57Å; E33-K36 PolarHBondContact OE1-NZ 2.8Å; K36-K40 VanDerWaalsContact O-CB 3.3Å; K36-K40 WeakPolarHBondContact O-CB 3.28Å; K36-K40 PolarHBondContact O-N 2.92Å
37	S	67.1	Low	66.5	Low	58 Å²	58	85 Å²	85	41%	0.406	52%	0.515	S	S	.	.	H	α-helix	trans	-64.4	-45.6	177.4	-163.1	0	0	0	0	111.5	E33 G34 D35 H39 K40 D41	E33-S37 WeakPolarHBondContact O-CB 3.45Å; E33-S37 PolarHBondContact O-N 3.35Å; G34-S37 PolarHBondContact O-N 2.71Å; D35-S37 VanDerWaalsContact C-N 3.26Å; D35-S37 PolarHBondContact O-N 3.03Å; S37-H39 PolarHBondContact O-N 3.43Å; S37-K40 PolarHBondContact O-N 3.29Å; S37-D41 VanDerWaalsContact O-CG 3.32Å; S37-D41 PolarHBondContact O-N 3.37Å
38	R	67.6	Low	69.2	Low	100 Å²	100	83 Å²	83	38%	0.377	48%	0.483	S	S	.	.	H	α-helix	trans	-59.8	-43.1	176.6	-75.6	171.3	162.6	-163.5	-8.9	112.4	P21 G34 D35 S42	P21-R38 PolarHBondContact O-NH2 2.91Å; G34-R38 WeakPolarHBondContact O-CG 3.21Å; G34-R38 PolarHBondContact O-N 3.4Å; D35-R38 PolarHBondContact O-N 3.33Å; D35-R38 VanDerWaalsContact O-N 3.16Å; R38-S42 PolarHBondContact O-N 3.41Å; R38-S42 VanDerWaalsContact O-N 3.14Å
39	H	71.9	Confident	72	Confident	112 Å²	112	78.7 Å²	78.7	52%	0.519	45%	0.448	S	S	.	.	H	α-helix	trans	-62.3	-47.8	174.6	-172.7	-73.3	0	0	0	111.4	D35 S37 D41 S42 E43	D35-H39 PolarHBondContact O-N 3.35Å; S37-H39 PolarHBondContact O-N 3.43Å; H39-D41 PolarHBondContact O-N 3.17Å; H39-S42 WeakPolarHBondContact O-CB 3.41Å; H39-S42 PolarHBondContact O-N 2.94Å; H39-E43 IonicContact CE1-OE2 2.71Å; H39-E43 IonicContact ND1-OE2 2.69Å; H39-E43 WeakPolarHBondContact O-CB 3.4Å; H39-E43 PolarHBondContact O-N 3.29Å
40	K	77.1	Confident	74.5	Confident	147 Å²	147	75.6 Å²	75.6	64%	0.639	42%	0.415	S	S	*	.	H	α-helix	trans	-61	-40.1	-180	-175.2	-178.1	178.5	-175.2	0	112.8	K36 S37 E43 A44	K36-K40 VanDerWaalsContact O-CB 3.3Å; K36-K40 WeakPolarHBondContact O-CB 3.28Å; K36-K40 PolarHBondContact O-N 2.92Å; S37-K40 PolarHBondContact O-N 3.29Å; K40-E43 PolarHBondContact O-N 3.38Å; K40-A44 VanDerWaalsContact O-CB 3.29Å; K40-A44 WeakPolarHBondContact O-CB 3.11Å; K40-A44 PolarHBondContact O-N 3.33Å
41	D	80.8	Confident	76.8	Confident	102 Å²	102	73.9 Å²	73.9	55%	0.545	41%	0.407	S	S	.	.	H	α-helix	trans	-67.2	-40.1	177	-70.7	-25.3	0	0	0	111.7	S37 H39 L45	S37-D41 VanDerWaalsContact O-CG 3.32Å; S37-D41 PolarHBondContact O-N 3.37Å; H39-D41 PolarHBondContact O-N 3.17Å; D41-L45 WeakPolarHBondContact O-CB 3.5Å; D41-L45 PolarHBondContact O-N 2.79Å
42	S	85.3	Confident	78.9	Confident	60 Å²	60	70.8 Å²	70.8	42%	0.42	39%	0.386	S	S	.	.	H	α-helix	trans	-62.9	-46.6	173.6	-171.5	0	0	0	0	111.8	R38 H39 A44 L45 L46	R38-S42 PolarHBondContact O-N 3.41Å; R38-S42 VanDerWaalsContact O-N 3.14Å; H39-S42 WeakPolarHBondContact O-CB 3.41Å; H39-S42 PolarHBondContact O-N 2.94Å; S42-A44 PolarHBondContact O-N 3.19Å; S42-L45 PolarHBondContact O-N 3.21Å; S42-L46 WeakPolarHBondContact O-CB 3.45Å; S42-L46 PolarHBondContact O-N 2.95Å
43	E	90.5	Very high	80.6	Confident	89 Å²	89	64.3 Å²	64.3	42%	0.416	35%	0.352	S	S	.	.	H	α-helix	trans	-65.4	-37.7	178.4	-176	168.1	-156.6	0	0	112.5	H39 K40 L46 S47	H39-E43 IonicContact CE1-OE2 2.71Å; H39-E43 IonicContact ND1-OE2 2.69Å; H39-E43 WeakPolarHBondContact O-CB 3.4Å; H39-E43 PolarHBondContact O-N 3.29Å; K40-E43 PolarHBondContact O-N 3.38Å; E43-L46 PolarHBondContact O-N 3.37Å; E43-S47 WeakPolarHBondContact O-CB 3.32Å; E43-S47 PolarHBondContact O-N 3.19Å; E43-S47 PolarHBondContact O-OG 2.92Å
44	A	91.9	Very high	82.4	Confident	51 Å²	51	58.7 Å²	58.7	42%	0.421	33%	0.328	S	S	.	.	H	α-helix	trans	-66	-38.5	172.9	0	0	0	0	0	112.3	K40 S42 T48	K40-A44 VanDerWaalsContact O-CB 3.29Å; K40-A44 WeakPolarHBondContact O-CB 3.11Å; K40-A44 PolarHBondContact O-N 3.33Å; S42-A44 PolarHBondContact O-N 3.19Å; A44-T48 WeakPolarHBondContact O-CB 3.26Å; A44-T48 PolarHBondContact O-N 2.93Å; A44-T48 PolarHBondContact O-OG1 3.39Å
45	L	93.9	Very high	83.7	Confident	24 Å²	24	61.2 Å²	61.2	13%	0.126	35%	0.346	C	S	.	.	H	α-helix	trans	-66.6	-43.6	174.1	-171.4	70.4	0	0	0	111.4	L9 R12 Y13 A16 D41 S42 T48 A49 F171	L9-L45 HydrophobicContact CD1-CD1 4.03Å; R12-L45 HydrophobicContact CB-CD1 4Å; Y13-L45 HydrophobicContact CD2-CD2 3.99Å; A16-L45 HydrophobicContact CB-CD2 4.2Å; D41-L45 WeakPolarHBondContact O-CB 3.5Å; D41-L45 PolarHBondContact O-N 2.79Å; S42-L45 PolarHBondContact O-N 3.21Å; L45-T48 WeakPolarHBondContact O-CB 3.31Å; L45-T48 PolarHBondContact O-N 3.27Å; L45-A49 PolarHBondContact O-N 3.09Å; L45-F171 HydrophobicContact CB-CZ 4.38Å; L45-F171 HydrophobicContact CD2-CE2 4.36Å; L45-F171 HydrophobicContact CD2-CZ 4.01Å; L45-F171 HydrophobicContact CG-CE1 4.47Å; L45-F171 HydrophobicContact CG-CE2 4.42Å; L45-F171 HydrophobicContact CG-CZ 3.77Å
46	L	94.9	Very high	84.5	Confident	9 Å²	9	60.7 Å²	60.7	5%	0.047	34%	0.337	C	S	.	.	H	α-helix	trans	-64.8	-38	176.9	-176.5	50.6	0	0	0	112.2	S42 E43 A49 T50 F171 Q174 A175 R178	S42-L46 WeakPolarHBondContact O-CB 3.45Å; S42-L46 PolarHBondContact O-N 2.95Å; E43-L46 PolarHBondContact O-N 3.37Å; L46-A49 PolarHBondContact O-N 3.02Å; L46-T50 PolarHBondContact O-N 3.47Å; L46-T50 PolarHBondContact O-OG1 2.85Å; L46-F171 HydrophobicContact CB-CE2 3.9Å; L46-F171 HydrophobicContact CB-CZ 4.31Å; L46-F171 HydrophobicContact CD1-CD2 4.35Å; L46-F171 HydrophobicContact CD1-CE2 3.93Å; L46-F171 HydrophobicContact CD1-CZ 4.33Å; L46-F171 HydrophobicContact CG-CE2 4.46Å; L46-Q174 HydrophobicContact CD1-CB 3.92Å; L46-Q174 HydrophobicContact CD2-CB 4.36Å; L46-A175 HydrophobicContact CD1-CB 3.81Å; L46-R178 VanDerWaalsContact CD2-CZ 3.42Å
47	S	95	Very high	84.8	Confident	59 Å²	59	56.2 Å²	56.2	41%	0.413	32%	0.318	S	S	.	.	H	α-helix	trans	-64.1	-40.7	171.3	-56.4	0	0	0	0	111.5	E43 A49 T50 A51	E43-S47 WeakPolarHBondContact O-CB 3.32Å; E43-S47 PolarHBondContact O-N 3.19Å; E43-S47 PolarHBondContact O-OG 2.92Å; S47-A49 PolarHBondContact O-N 2.9Å; S47-T50 PolarHBondContact O-N 3.22Å; S47-A51 WeakPolarHBondContact O-CB 3.44Å; S47-A51 PolarHBondContact O-N 2.91Å
48	T	94.3	Very high	84.9	Confident	55 Å²	55	53.6 Å²	53.6	34%	0.337	30%	0.3	S	S	.	.	H	α-helix	trans	-62.6	-40.9	173.9	-56.4	0	0	0	0	111.5	L9 A44 L45 L52	L9-T48 HydrophobicContact CD1-CG2 4.35Å; A44-T48 WeakPolarHBondContact O-CB 3.26Å; A44-T48 PolarHBondContact O-N 2.93Å; A44-T48 PolarHBondContact O-OG1 3.39Å; L45-T48 WeakPolarHBondContact O-CB 3.31Å; L45-T48 PolarHBondContact O-N 3.27Å; T48-L52 HydrophobicContact CG2-CD1 4.01Å; T48-L52 WeakPolarHBondContact O-CB 3.46Å; T48-L52 VanDerWaalsContact O-CG 3.29Å; T48-L52 WeakPolarHBondContact O-CG 3.46Å; T48-L52 PolarHBondContact O-N 2.87Å
49	A	94.1	Very high	85.3	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66	-41.6	176.6	0	0	0	0	0	112.5	L9 L45 L46 S47 L52 L53 F171 L172 A175	L9-A49 HydrophobicContact CD2-CB 3.93Å; L45-A49 PolarHBondContact O-N 3.09Å; L46-A49 PolarHBondContact O-N 3.02Å; S47-A49 PolarHBondContact O-N 2.9Å; A49-L52 PolarHBondContact O-N 2.82Å; A49-L53 WeakPolarHBondContact O-CG 3.46Å; A49-L53 PolarHBondContact O-N 3.4Å; A49-F171 HydrophobicContact CB-CE1 3.57Å; A49-F171 HydrophobicContact CB-CZ 3.77Å; A49-L172 HydrophobicContact CB-CD2 4.3Å; A49-A175 HydrophobicContact CB-CB 3.84Å
50	T	94	Very high	85.3	Confident	7 Å²	7	48 Å²	48	4%	0.043	28%	0.282	C	S	.	.	H	α-helix	trans	-62.2	-48.6	176.2	-51.9	0	0	0	0	110.3	L46 S47 L52 L53 G54 R178 L179	L46-T50 PolarHBondContact O-N 3.47Å; L46-T50 PolarHBondContact O-OG1 2.85Å; S47-T50 PolarHBondContact O-N 3.22Å; T50-L52 VanDerWaalsContact C-N 3.33Å; T50-L52 PolarHBondContact O-N 2.9Å; T50-L53 PolarHBondContact O-N 2.68Å; T50-G54 PolarHBondContact O-N 2.8Å; T50-R178 HydrophobicContact CG2-CB 4.08Å; T50-L179 HydrophobicContact CG2-CB 4.12Å; T50-L179 HydrophobicContact CG2-CD1 4.13Å
51	A	91.9	Very high	85.1	Confident	61 Å²	61	43.9 Å²	43.9	50%	0.504	28%	0.282	S	S	.	.	H	α-helix	trans	-60.8	-38.2	175	0	0	0	0	0	112.8	S47 G54 A55	S47-A51 WeakPolarHBondContact O-CB 3.44Å; S47-A51 PolarHBondContact O-N 2.91Å; A51-G54 PolarHBondContact O-N 2.89Å; A51-A55 WeakPolarHBondContact O-CB 3.5Å; A51-A55 PolarHBondContact O-N 2.89Å
52	L	89.7	Confident	85.1	Confident	37 Å²	37	44.9 Å²	44.9	19%	0.194	28%	0.283	C	S	.	.	H	α-helix	trans	-69	-32.8	175.6	-77.5	167.3	0	0	0	113.1	L5 L9 T48 A49 T50 Y56	L5-L52 HydrophobicContact CD1-CD2 4.36Å; L5-L52 HydrophobicContact CD2-CD2 4.4Å; L9-L52 HydrophobicContact CB-CD1 4.21Å; L9-L52 HydrophobicContact CD1-CD1 4.03Å; L9-L52 HydrophobicContact CD2-CD1 3.88Å; L9-L52 HydrophobicContact CG-CD1 4.25Å; T48-L52 HydrophobicContact CG2-CD1 4.01Å; T48-L52 WeakPolarHBondContact O-CB 3.46Å; T48-L52 VanDerWaalsContact O-CG 3.29Å; T48-L52 WeakPolarHBondContact O-CG 3.46Å; T48-L52 PolarHBondContact O-N 2.87Å; A49-L52 PolarHBondContact O-N 2.82Å; T50-L52 VanDerWaalsContact C-N 3.33Å; T50-L52 PolarHBondContact O-N 2.9Å; L52-Y56 WeakPolarHBondContact O-CA 3.31Å; L52-Y56 VanDerWaalsContact O-CB 3.25Å; L52-Y56 WeakPolarHBondContact O-CB 3.47Å; L52-Y56 PolarHBondContact O-N 2.81Å
53	L	89.4	Confident	85.1	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-75	-26.8	173.9	-75.3	166	0	0	0	113.4	M1 A49 T50 L172 A175 E176 L179 R200	M1-L53 HydrophobicContact CE-CD2 3.47Å; M1-L53 VanDerWaalsContact CE-CD2 3.47Å; M1-L53 HydrophobicContact CE-CG 4.07Å; A49-L53 WeakPolarHBondContact O-CG 3.46Å; A49-L53 PolarHBondContact O-N 3.4Å; T50-L53 PolarHBondContact O-N 2.68Å; L53-L172 HydrophobicContact CD1-CD2 4.27Å; L53-A175 HydrophobicContact CD1-CB 3.6Å; L53-E176 HydrophobicContact CD1-CB 4.13Å; L53-L179 HydrophobicContact CB-CD2 4.09Å; L53-R200 PolarHBondContact O-NH2 2.94Å
54	G	87.2	Confident	85.1	Confident	9 Å²	9	38.8 Å²	38.8	9%	0.093	25%	0.247	C	C	.	.	H	α-helix	trans	-80.7	-45.6	172.9	0	0	0	0	0	113.2	T50 A51 Q57 D206	T50-G54 PolarHBondContact O-N 2.8Å; A51-G54 PolarHBondContact O-N 2.89Å; G54-Q57 PolarHBondContact O-NE2 3.3Å; G54-D206 WeakPolarHBondContact O-CB 3.13Å
55	A	83.8	Confident	84.9	Confident	87 Å²	87	46.7 Å²	46.7	72%	0.719	27%	0.266	S	S	*	.	H	α-helix	trans	-83.1	-43.4	-175.3	0	0	0	0	0	113.3	A51	A51-A55 WeakPolarHBondContact O-CB 3.5Å; A51-A55 PolarHBondContact O-N 2.89Å
56	Y	71.1	Confident	84.7	Confident	87 Å²	87	47.9 Å²	47.9	34%	0.341	27%	0.272	S	S	.	.	S	Bend	trans	-85.1	129.4	168.7	-167.2	-84.8	0	0	0	108.8	M1 D2 L5 L52 P58	M1-Y56 VanDerWaalsContact C-CE1 3.47Å; M1-Y56 HydrophobicContact CB-CD1 4.45Å; M1-Y56 HydrophobicContact CG-CD1 4.03Å; D2-Y56 HydrophobicContact CB-CD2 3.91Å; D2-Y56 HydrophobicContact CB-CE1 4.31Å; D2-Y56 HydrophobicContact CB-CE2 3.43Å; D2-Y56 VanDerWaalsContact CB-CE2 3.43Å; L5-Y56 HydrophobicContact CD1-CD2 4.31Å; L52-Y56 WeakPolarHBondContact O-CA 3.31Å; L52-Y56 VanDerWaalsContact O-CB 3.25Å; L52-Y56 WeakPolarHBondContact O-CB 3.47Å; L52-Y56 PolarHBondContact O-N 2.81Å; Y56-P58 VanDerWaalsContact C-CD 3.47Å; Y56-P58 HydrophobicContact CD1-CB 4.46Å; Y56-P58 HydrophobicContact CE1-CB 4.42Å; Y56-P58 WeakPolarHBondContact O-CD 3.45Å
57	Q	69.4	Low	84.5	Confident	26 Å²	26	47.8 Å²	47.8	12%	0.121	27%	0.271	C	S	.	.			trans	-106.6	81.8	-175.3	-73.7	-66	-16.8	0	0	111.5	G54 R204 D205 D206	G54-Q57 PolarHBondContact O-NE2 3.3Å; Q57-R204 HydrophobicContact CB-CB 4.26Å; Q57-R204 VanDerWaalsContact CD-C 3.41Å; Q57-R204 WeakPolarHBondContact CG-O 3.45Å; Q57-R204 VanDerWaalsContact O-CZ 3.31Å; Q57-R204 PolarHBondContact O-NE 3.18Å; Q57-R204 PolarHBondContact O-NH2 2.89Å; Q57-R204 PolarHBondContact OE1-O 3.1Å; Q57-R204 VanDerWaalsContact OE1-O 3.14Å; Q57-D205 PolarHBondContact NE2-O 3.37Å; Q57-D205 PolarHBondContact OE1-O 3.29Å; Q57-D206 VanDerWaalsContact NE2-CA 3.35Å; Q57-D206 VanDerWaalsContact NE2-N 3.19Å
58	P	68.9	Low	84.4	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.019	28%	0.283	C	S	.	.			trans	-65.3	147.4	171.1	31.8	-34.4	0	0	0	109.6	M1 Y56 R63	M1-P58 HydrophobicContact CB-CB 4.37Å; Y56-P58 VanDerWaalsContact C-CD 3.47Å; Y56-P58 HydrophobicContact CD1-CB 4.46Å; Y56-P58 HydrophobicContact CE1-CB 4.42Å; Y56-P58 WeakPolarHBondContact O-CD 3.45Å; P58-R63 HydrophobicContact CB-CG 4Å; P58-R63 HydrophobicContact CG-CG 3.34Å; P58-R63 PolarHBondContact O-NE 3.44Å; P58-R63 PolarHBondContact O-NH2 3.03Å
59	D	75.6	Confident	84.4	Confident	78 Å²	78	50.7 Å²	50.7	42%	0.417	27%	0.267	S	S	.	.			trans	-49	133	159.2	175.4	70.6	0	0	0	109.8	G61 H62	D59-G61 VanDerWaalsContact C-N 3.27Å; D59-G61 PolarHBondContact O-N 2.65Å; D59-G61 PolarHBondContact OD2-N 3.16Å; D59-H62 HydrophobicContact CB-CB 4.36Å; D59-H62 CarbonylContact O-C 3.57Å; D59-H62 WeakPolarHBondContact O-CA 3.41Å; D59-H62 PolarHBondContact O-N 3.27Å; D59-H62 IonicContact OD2-CE1 2.68Å; D59-H62 IonicContact OD2-CG 2.8Å; D59-H62 IonicContact OD2-ND1 3.79Å; D59-H62 PolarHBondContact OD2-ND1 2.9Å
60	P	72.5	Confident	84.4	Confident	16 Å²	16	51.3 Å²	51.3	10%	0.104	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-57.4	-36.4	-173.4	-26.4	33.8	0	0	0	114.4	H62 R63 R201	P60-H62 PolarHBondContact O-N 3.46Å; P60-H62 VanDerWaalsContact O-N 3.16Å; P60-R63 PolarHBondContact O-N 3.23Å; P60-R201 WeakPolarHBondContact CB-O 3.48Å; P60-R201 VanDerWaalsContact CG-O 3.26Å; P60-R201 WeakPolarHBondContact CG-O 3.35Å
61	G	73.9	Confident	84.4	Confident	61 Å²	61	53.4 Å²	53.4	63%	0.629	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-67.6	-9	175.6	0	0	0	0	0	114.3	D59	D59-G61 VanDerWaalsContact C-N 3.27Å; D59-G61 PolarHBondContact O-N 2.65Å; D59-G61 PolarHBondContact OD2-N 3.16Å
62	H	80.1	Confident	84.5	Confident	123 Å²	123	51 Å²	51	57%	0.569	26%	0.257	S	S	*	.	G	3₁₀ helix	trans	-119.8	22.8	-178.1	-62.8	85.8	0	0	0	113	M1 D59 P60	M1-H62 PolarHBondContact N-O 2.86Å; D59-H62 HydrophobicContact CB-CB 4.36Å; D59-H62 CarbonylContact O-C 3.57Å; D59-H62 WeakPolarHBondContact O-CA 3.41Å; D59-H62 PolarHBondContact O-N 3.27Å; D59-H62 IonicContact OD2-CE1 2.68Å; D59-H62 IonicContact OD2-CG 2.8Å; D59-H62 IonicContact OD2-ND1 3.79Å; D59-H62 PolarHBondContact OD2-ND1 2.9Å; P60-H62 PolarHBondContact O-N 3.46Å; P60-H62 VanDerWaalsContact O-N 3.16Å
63	R	85.3	Confident	84.8	Confident	1 Å²	1	49.2 Å²	49.2	0%	0.004	25%	0.248	C	C	.	.	S	Bend	trans	-83.6	-47	171.2	-74.8	171.3	-169.4	161.2	6.2	111.9	R6 P58 P60 Y70 E176 R200 C203	R6-R63 PolarHBondContact NH1-O 2.94Å; P58-R63 HydrophobicContact CB-CG 4Å; P58-R63 HydrophobicContact CG-CG 3.34Å; P58-R63 PolarHBondContact O-NE 3.44Å; P58-R63 PolarHBondContact O-NH2 3.03Å; P60-R63 PolarHBondContact O-N 3.23Å; R63-Y70 WeakPolarHBondContact CD-OH 3.22Å; R63-Y70 PolarHBondContact NH1-OH 3.2Å; R63-E176 IonicContact NH1-OE1 2.77Å; R63-R200 PolarHBondContact NH1-O 2.53Å; R63-C203 PolarHBondContact NH2-O 2.95Å
64	F	89.9	Confident	85	Confident	19 Å²	19	50.4 Å²	50.4	8%	0.083	25%	0.254	C	S	.	.			trans	-122.9	151.6	178.6	-56.7	-88.1	0	0	0	109.7	V67 F69 Y70 E169 L172 A173 E176	F64-V67 WeakPolarHBondContact CB-O 3.45Å; F64-V67 HydrophobicContact CD1-CB 4.34Å; F64-F69 HydrophobicContact CD1-CB 4.15Å; F64-F69 HydrophobicContact CD2-CB 3.47Å; F64-F69 VanDerWaalsContact CD2-CB 3.47Å; F64-F69 HydrophobicContact CD2-CD1 4.22Å; F64-F69 AromaticContact CD2-CG 3.96Å; F64-F69 HydrophobicContact CD2-CG 3.96Å; F64-F69 HydrophobicContact CE1-CB 4.21Å; F64-F69 HydrophobicContact CE1-CD2 4.3Å; F64-F69 HydrophobicContact CE1-CG 4.28Å; F64-F69 HydrophobicContact CE2-CB 3.55Å; F64-F69 AromaticContact CE2-CD1 3.57Å; F64-F69 HydrophobicContact CE2-CD1 3.57Å; F64-F69 HydrophobicContact CE2-CD2 4.16Å; F64-F69 HydrophobicContact CE2-CE1 4.32Å; F64-F69 AromaticContact CE2-CG 3.47Å; F64-F69 HydrophobicContact CE2-CG 3.47Å; F64-F69 VanDerWaalsContact CE2-CG 3.47Å; F64-F69 HydrophobicContact CG-CB 3.79Å; F64-F69 HydrophobicContact CZ-CB 3.93Å; F64-F69 HydrophobicContact CZ-CD1 4.06Å; F64-F69 AromaticContact CZ-CD2 3.85Å; F64-F69 HydrophobicContact CZ-CD2 3.85Å; F64-F69 HydrophobicContact CZ-CE2 4.38Å; F64-F69 AromaticContact CZ-CG 3.66Å; F64-F69 HydrophobicContact CZ-CG 3.66Å; F64-Y70 HydrophobicContact CD2-CE2 4.37Å; F64-Y70 HydrophobicContact CE2-CE2 4.46Å; F64-E169 HydrophobicContact CD1-CB 4.49Å; F64-L172 HydrophobicContact CE1-CB 3.95Å; F64-A173 HydrophobicContact CE1-CB 4.04Å; F64-A173 HydrophobicContact CZ-CB 4.5Å; F64-E176 HydrophobicContact CE2-CB 4.37Å; F64-E176 HydrophobicContact CE2-CG 4.28Å; F64-E176 HydrophobicContact CZ-CB 3.94Å; F64-E176 HydrophobicContact CZ-CG 4.36Å
65	R	88	Confident	85.3	Confident	217 Å²	217	53.4 Å²	53.4	82%	0.819	27%	0.268	S	S	*	.	S	Bend	trans	-131.6	-24	-178	-54.9	-176.4	75.3	-173.9	3.1	112.8	E169	R65-E169 VanDerWaalsContact N-CD 3.29Å; R65-E169 PolarHBondContact N-OE1 2.99Å; R65-E169 PolarHBondContact N-OE2 3.47Å
66	M	89.6	Confident	85.9	Confident	50 Å²	50	49.4 Å²	49.4	25%	0.246	23%	0.234	C	C	.	.	S	Bend	trans	-112.8	-32.7	-179.4	-52.3	-179.9	77.8	0	0	111.3	H162 Q165 L166 E169	M66-H162 WeakPolarHBondContact CE-CE1 3.1Å; M66-H162 WeakPolarHBondContact CE-ND1 3.36Å; M66-Q165 HydrophobicContact SD-CB 3.95Å; M66-Q165 HydrophobicContact SD-CG 3.57Å; M66-Q165 VanDerWaalsContact SD-CG 3.57Å; M66-L166 HydrophobicContact CB-CD1 4.02Å; M66-L166 HydrophobicContact CE-CB 3.8Å; M66-L166 HydrophobicContact CE-CD1 4.32Å; M66-L166 HydrophobicContact SD-CB 4.11Å; M66-E169 WeakPolarHBondContact CA-OE2 3.45Å; M66-E169 PolarHBondContact N-OE2 3.12Å
67	V	91.8	Very high	87	Confident	6 Å²	6	46.9 Å²	46.9	4%	0.036	23%	0.226	C	C	.	.	S	Bend	trans	-100.9	124.1	178.8	-176.3	0	0	0	0	110.3	F64 F69 F92 L166 E169 L170	F64-V67 WeakPolarHBondContact CB-O 3.45Å; F64-V67 HydrophobicContact CD1-CB 4.34Å; V67-F69 HydrophobicContact CG1-CB 4.34Å; V67-F69 PolarHBondContact O-N 3.18Å; V67-F92 HydrophobicContact CG1-CE1 4.4Å; V67-L166 HydrophobicContact CG2-CD1 4.17Å; V67-E169 HydrophobicContact CG2-CB 3.8Å; V67-E169 PolarHBondContact N-OE2 3.22Å; V67-E169 VanDerWaalsContact N-OE2 3.13Å; V67-L170 HydrophobicContact CG2-CD2 4.1Å; V67-L170 HydrophobicContact CG2-CG 4.32Å
68	R	92.2	Very high	88.1	Confident	174 Å²	174	51.8 Å²	51.8	66%	0.657	24%	0.244	S	C	*	.			trans	-77.6	61.7	171.8	-70.1	-172.3	66.2	-177.5	3	111.2	Y70 E71 M72	R68-Y70 PolarHBondContact O-N 3.39Å; R68-E71 WeakPolarHBondContact CB-OE2 3.11Å; R68-E71 IonicContact NE-OE2 3.94Å; R68-M72 VanDerWaalsContact O-CB 3.26Å; R68-M72 WeakPolarHBondContact O-CB 3.46Å; R68-M72 PolarHBondContact O-N 2.91Å
69	F	94.3	Very high	89	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.009	28%	0.278	C	S	.	.	H	α-helix	trans	-56.9	-55.1	-166.7	175.3	-96.1	0	0	0	112.6	F64 V67 E71 M72 V73 F92 A173 E176 L180 L197	F64-F69 HydrophobicContact CD1-CB 4.15Å; F64-F69 HydrophobicContact CD2-CB 3.47Å; F64-F69 VanDerWaalsContact CD2-CB 3.47Å; F64-F69 HydrophobicContact CD2-CD1 4.22Å; F64-F69 AromaticContact CD2-CG 3.96Å; F64-F69 HydrophobicContact CD2-CG 3.96Å; F64-F69 HydrophobicContact CE1-CB 4.21Å; F64-F69 HydrophobicContact CE1-CD2 4.3Å; F64-F69 HydrophobicContact CE1-CG 4.28Å; F64-F69 HydrophobicContact CE2-CB 3.55Å; F64-F69 AromaticContact CE2-CD1 3.57Å; F64-F69 HydrophobicContact CE2-CD1 3.57Å; F64-F69 HydrophobicContact CE2-CD2 4.16Å; F64-F69 HydrophobicContact CE2-CE1 4.32Å; F64-F69 AromaticContact CE2-CG 3.47Å; F64-F69 HydrophobicContact CE2-CG 3.47Å; F64-F69 VanDerWaalsContact CE2-CG 3.47Å; F64-F69 HydrophobicContact CG-CB 3.79Å; F64-F69 HydrophobicContact CZ-CB 3.93Å; F64-F69 HydrophobicContact CZ-CD1 4.06Å; F64-F69 AromaticContact CZ-CD2 3.85Å; F64-F69 HydrophobicContact CZ-CD2 3.85Å; F64-F69 HydrophobicContact CZ-CE2 4.38Å; F64-F69 AromaticContact CZ-CG 3.66Å; F64-F69 HydrophobicContact CZ-CG 3.66Å; V67-F69 HydrophobicContact CG1-CB 4.34Å; V67-F69 PolarHBondContact O-N 3.18Å; F69-E71 PolarHBondContact O-N 2.79Å; F69-M72 PolarHBondContact O-N 2.92Å; F69-V73 HydrophobicContact CD2-CG2 4.12Å; F69-V73 HydrophobicContact CE1-CG2 4.23Å; F69-V73 HydrophobicContact CE2-CG2 3.79Å; F69-V73 HydrophobicContact CG-CG2 4.5Å; F69-V73 HydrophobicContact CZ-CG2 3.85Å; F69-V73 WeakPolarHBondContact O-CG2 3.25Å; F69-V73 PolarHBondContact O-N 3.08Å; F69-F92 AromaticContact CD2-CE2 3.98Å; F69-F92 HydrophobicContact CD2-CE2 3.98Å; F69-F92 HydrophobicContact CD2-CZ 4.01Å; F69-F92 HydrophobicContact CE2-CD2 4.48Å; F69-F92 AromaticContact CE2-CE2 3.75Å; F69-F92 HydrophobicContact CE2-CE2 3.75Å; F69-F92 HydrophobicContact CE2-CZ 4.25Å; F69-A173 HydrophobicContact CD2-CB 3.67Å; F69-A173 HydrophobicContact CE2-CB 3.9Å; F69-A173 WeakPolarHBondContact CE2-O 3.44Å; F69-E176 HydrophobicContact CD1-CG 4.14Å; F69-E176 HydrophobicContact CE1-CB 4Å; F69-E176 HydrophobicContact CE1-CG 3.38Å; F69-E176 HydrophobicContact CE2-CB 4.31Å; F69-E176 HydrophobicContact CZ-CB 3.75Å; F69-E176 HydrophobicContact CZ-CG 3.63Å; F69-L180 HydrophobicContact CE1-CD1 4.02Å; F69-L180 HydrophobicContact CZ-CD1 4.03Å; F69-L197 HydrophobicContact CE1-CD1 4.31Å
70	Y	94	Very high	89.5	Confident	13 Å²	13	56 Å²	56	5%	0.051	27%	0.271	C	S	.	.	H	α-helix	trans	-64.5	-40.9	-174.2	-66.4	-68.5	0	0	0	112.3	R63 F64 R68 E74 E176 L197 R201	R63-Y70 WeakPolarHBondContact CD-OH 3.22Å; R63-Y70 PolarHBondContact NH1-OH 3.2Å; F64-Y70 HydrophobicContact CD2-CE2 4.37Å; F64-Y70 HydrophobicContact CE2-CE2 4.46Å; R68-Y70 PolarHBondContact O-N 3.39Å; Y70-E74 WeakPolarHBondContact O-CB 3.4Å; Y70-E74 PolarHBondContact O-N 3.37Å; Y70-E176 PolarHBondContact OH-OE1 3.15Å; Y70-L197 HydrophobicContact CD1-CD1 3.68Å; Y70-L197 HydrophobicContact CD1-CG 4.34Å; Y70-L197 HydrophobicContact CE1-CD1 4.24Å; Y70-R201 HydrophobicContact CD1-CB 3.82Å; Y70-R201 HydrophobicContact CD1-CG 4.06Å; Y70-R201 HydrophobicContact CD2-CG 4.14Å; Y70-R201 HydrophobicContact CE1-CB 4.29Å; Y70-R201 HydrophobicContact CG-CB 4.05Å; Y70-R201 HydrophobicContact CG-CG 3.74Å
71	E	93.5	Very high	89.8	Confident	50 Å²	50	67.1 Å²	67.1	23%	0.234	31%	0.311	C	S	.	.	H	α-helix	trans	-66.9	-38.8	176.8	-61.7	75.8	-149.2	0	0	112	R68 F69 E74 N75 R201	R68-E71 WeakPolarHBondContact CB-OE2 3.11Å; R68-E71 IonicContact NE-OE2 3.94Å; F69-E71 PolarHBondContact O-N 2.79Å; E71-E74 PolarHBondContact O-N 2.9Å; E71-N75 VanDerWaalsContact O-CB 3.32Å; E71-N75 WeakPolarHBondContact O-CB 3.07Å; E71-N75 PolarHBondContact O-N 2.96Å; E71-N75 PolarHBondContact O-ND2 2.84Å; E71-R201 IonicContact OE1-CZ 3.54Å; E71-R201 IonicContact OE1-NE 3.57Å; E71-R201 IonicContact OE1-NH2 2.75Å; E71-R201 PolarHBondContact OE1-NH2 3.35Å
72	M	93.8	Very high	90.1	Very high	10 Å²	10	67.1 Å²	67.1	5%	0.049	31%	0.311	C	S	.	.	H	α-helix	trans	-71.1	-39.5	-178.2	-170.6	175.5	-57.6	0	0	112.6	R68 F69 S76 F92 I129 E133 L137	R68-M72 VanDerWaalsContact O-CB 3.26Å; R68-M72 WeakPolarHBondContact O-CB 3.46Å; R68-M72 PolarHBondContact O-N 2.91Å; F69-M72 PolarHBondContact O-N 2.92Å; M72-S76 VanDerWaalsContact O-CB 3.28Å; M72-S76 WeakPolarHBondContact O-CB 3.2Å; M72-S76 PolarHBondContact O-N 3.09Å; M72-F92 HydrophobicContact SD-CE1 3.89Å; M72-F92 HydrophobicContact SD-CZ 4.22Å; M72-I129 HydrophobicContact CG-CG2 4.32Å; M72-I129 HydrophobicContact SD-CD1 4.12Å; M72-I129 HydrophobicContact SD-CG1 4.42Å; M72-I129 HydrophobicContact SD-CG2 4.03Å; M72-E133 WeakPolarHBondContact CA-OE1 3.44Å; M72-E133 HydrophobicContact CE-CB 4.14Å; M72-L137 HydrophobicContact CE-CD1 3.74Å; M72-L137 HydrophobicContact CE-CD2 4.08Å; M72-L137 HydrophobicContact CE-CG 3.93Å; M72-L137 HydrophobicContact SD-CD1 3.74Å
73	V	95.9	Very high	90.3	Very high	0 Å²	0	62 Å²	62	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-69.4	-39.2	173.3	178.2	0	0	0	0	110.4	F69 S76 L77 L85 L88 F92 L197	F69-V73 HydrophobicContact CD2-CG2 4.12Å; F69-V73 HydrophobicContact CE1-CG2 4.23Å; F69-V73 HydrophobicContact CE2-CG2 3.79Å; F69-V73 HydrophobicContact CG-CG2 4.5Å; F69-V73 HydrophobicContact CZ-CG2 3.85Å; F69-V73 WeakPolarHBondContact O-CG2 3.25Å; F69-V73 PolarHBondContact O-N 3.08Å; V73-S76 PolarHBondContact O-N 3.24Å; V73-L77 HydrophobicContact CG1-CD1 3.79Å; V73-L77 HydrophobicContact CG1-CG 4.16Å; V73-L77 WeakPolarHBondContact O-CB 3.43Å; V73-L77 VanDerWaalsContact O-CG 3.27Å; V73-L77 WeakPolarHBondContact O-CG 3.32Å; V73-L77 PolarHBondContact O-N 3.02Å; V73-L85 HydrophobicContact CG1-CD2 3.94Å; V73-L88 HydrophobicContact CB-CD1 4.22Å; V73-L88 HydrophobicContact CG1-CD1 3.77Å; V73-L88 HydrophobicContact CG2-CD1 4.09Å; V73-F92 HydrophobicContact CG2-CE2 4.15Å; V73-F92 HydrophobicContact CG2-CZ 4.29Å; V73-L197 HydrophobicContact CB-CD1 3.86Å; V73-L197 HydrophobicContact CB-CD2 4.08Å; V73-L197 HydrophobicContact CG1-CD1 3.62Å; V73-L197 HydrophobicContact CG1-CD2 3.85Å; V73-L197 HydrophobicContact CG1-CG 4.29Å
74	E	95.1	Very high	90.7	Very high	27 Å²	27	64.6 Å²	64.6	13%	0.126	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-45.5	174.9	-176.9	179.5	-172.4	0	0	111.8	Y70 E71 R78 L194 L197 R201	Y70-E74 WeakPolarHBondContact O-CB 3.4Å; Y70-E74 PolarHBondContact O-N 3.37Å; E71-E74 PolarHBondContact O-N 2.9Å; E74-R78 WeakPolarHBondContact O-CB 3.21Å; E74-R78 VanDerWaalsContact O-CG 3.29Å; E74-R78 WeakPolarHBondContact O-CG 3.36Å; E74-R78 PolarHBondContact O-N 3.29Å; E74-R78 VanDerWaalsContact O-N 3.17Å; E74-R78 IonicContact OE1-CZ 3.1Å; E74-R78 IonicContact OE1-NH1 3.86Å; E74-R78 PolarHBondContact OE1-NH1 3Å; E74-R78 IonicContact OE1-NH2 2.7Å; E74-R78 PolarHBondContact OE1-NH2 3.08Å; E74-L194 HydrophobicContact CG-CD1 4.37Å; E74-L197 HydrophobicContact CB-CD2 3.74Å; E74-R201 IonicContact OE1-NH1 3.22Å; E74-R201 IonicContact OE2-CZ 2.65Å; E74-R201 IonicContact OE2-NH1 3.12Å; E74-R201 PolarHBondContact OE2-NH1 3.37Å; E74-R201 IonicContact OE2-NH2 3.71Å
75	N	93.7	Very high	91	Very high	72 Å²	72	64 Å²	64	39%	0.385	30%	0.303	S	S	.	.	H	α-helix	trans	-64.2	-44.9	175.7	-73.3	-23.4	0	0	0	111.7	E71 R78 C79 E133	E71-N75 VanDerWaalsContact O-CB 3.32Å; E71-N75 WeakPolarHBondContact O-CB 3.07Å; E71-N75 PolarHBondContact O-N 2.96Å; E71-N75 PolarHBondContact O-ND2 2.84Å; N75-R78 PolarHBondContact O-N 3.15Å; N75-C79 VanDerWaalsContact O-CB 3.27Å; N75-C79 WeakPolarHBondContact O-CB 3.33Å; N75-C79 PolarHBondContact O-N 2.85Å; N75-E133 PolarHBondContact ND2-OE1 3Å
76	S	95.3	Very high	91.4	Very high	2 Å²	2	61.3 Å²	61.3	1%	0.014	30%	0.298	C	S	.	.	H	α-helix	trans	-60.2	-54.3	177.6	175.6	0	0	0	0	111.8	M72 V73 R78 C79 Q80 A128	M72-S76 VanDerWaalsContact O-CB 3.28Å; M72-S76 WeakPolarHBondContact O-CB 3.2Å; M72-S76 PolarHBondContact O-N 3.09Å; V73-S76 PolarHBondContact O-N 3.24Å; S76-R78 PolarHBondContact O-N 2.95Å; S76-C79 PolarHBondContact O-N 2.89Å; S76-Q80 WeakPolarHBondContact O-CA 3.48Å; S76-Q80 WeakPolarHBondContact O-CB 3.43Å; S76-Q80 PolarHBondContact O-N 2.92Å; S76-A128 VanDerWaalsContact CB-O 3.23Å; S76-A128 WeakPolarHBondContact CB-O 3.11Å; S76-A128 PolarHBondContact OG-O 2.91Å
77	L	94.9	Very high	91.7	Very high	34 Å²	34	60.1 Å²	60.1	18%	0.178	30%	0.295	C	S	.	.	H	α-helix	trans	-63.6	-25.8	-178.4	-65.5	177	0	0	0	113.4	V73 E193 L194	V73-L77 HydrophobicContact CG1-CD1 3.79Å; V73-L77 HydrophobicContact CG1-CG 4.16Å; V73-L77 WeakPolarHBondContact O-CB 3.43Å; V73-L77 VanDerWaalsContact O-CG 3.27Å; V73-L77 WeakPolarHBondContact O-CG 3.32Å; V73-L77 PolarHBondContact O-N 3.02Å; L77-E193 HydrophobicContact CD1-CB 4.01Å; L77-E193 HydrophobicContact CD2-CB 4.33Å; L77-E193 WeakPolarHBondContact CD2-OE2 3.28Å; L77-L194 HydrophobicContact CD1-CB 4.4Å
78	R	93	Very high	91.9	Very high	129 Å²	129	59.9 Å²	59.9	49%	0.487	29%	0.293	S	S	.	.	H	α-helix	trans	-92.7	-33.7	179.1	-69.5	178.7	-179.3	166.5	5.7	114.5	E74 N75 S76 L194 E198	E74-R78 WeakPolarHBondContact O-CB 3.21Å; E74-R78 VanDerWaalsContact O-CG 3.29Å; E74-R78 WeakPolarHBondContact O-CG 3.36Å; E74-R78 PolarHBondContact O-N 3.29Å; E74-R78 VanDerWaalsContact O-N 3.17Å; E74-R78 IonicContact OE1-CZ 3.1Å; E74-R78 IonicContact OE1-NH1 3.86Å; E74-R78 PolarHBondContact OE1-NH1 3Å; E74-R78 IonicContact OE1-NH2 2.7Å; E74-R78 PolarHBondContact OE1-NH2 3.08Å; N75-R78 PolarHBondContact O-N 3.15Å; S76-R78 PolarHBondContact O-N 2.95Å; R78-L194 HydrophobicContact CG-CD1 4.23Å; R78-L194 HydrophobicContact CG-CD2 3.92Å; R78-E198 IonicContact CZ-OE1 3.12Å; R78-E198 IonicContact NH2-OE1 3.78Å; R78-E198 PolarHBondContact NH2-OE1 3.23Å
79	C	86.8	Confident	92.1	Very high	109 Å²	109	53.3 Å²	53.3	74%	0.736	27%	0.27	S	S	*	.	H	α-helix	trans	-112.5	-24.4	-170.5	-62.1	0	0	0	0	114.3	N75 S76	N75-C79 VanDerWaalsContact O-CB 3.27Å; N75-C79 WeakPolarHBondContact O-CB 3.33Å; N75-C79 PolarHBondContact O-N 2.85Å; S76-C79 PolarHBondContact O-N 2.89Å
80	Q	85.6	Confident	92.2	Very high	60 Å²	60	56.4 Å²	56.4	28%	0.28	28%	0.281	S	S	.	.	S	Bend	trans	-89.9	126.5	-174.3	-167.8	64.5	4.2	0	0	111.4	S76 G82 G83 Q126 S127	S76-Q80 WeakPolarHBondContact O-CA 3.48Å; S76-Q80 WeakPolarHBondContact O-CB 3.43Å; S76-Q80 PolarHBondContact O-N 2.92Å; Q80-G82 PolarHBondContact O-N 2.84Å; Q80-G83 PolarHBondContact O-N 3.35Å; Q80-Q126 PolarHBondContact NE2-O 3.01Å; Q80-S127 WeakPolarHBondContact CG-O 3.47Å; Q80-S127 PolarHBondContact NE2-O 3.16Å
81	R	80.1	Confident	92.3	Very high	250 Å²	250	55.8 Å²	55.8	94%	0.943	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	99.1	-172.8	-172.2	-178.5	-177.2	-172.5	-0.1	111.5
82	G	78.8	Confident	92.5	Very high	61 Å²	61	53.4 Å²	53.4	63%	0.629	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	12.9	-174.6	0	0	0	0	0	113.5	Q80 N84	Q80-G82 PolarHBondContact O-N 2.84Å; G82-N84 PolarHBondContact O-N 3.26Å; G82-N84 PolarHBondContact O-ND2 2.97Å
83	G	85.1	Confident	92.6	Very high	16 Å²	16	55.1 Å²	55.1	17%	0.165	28%	0.276	C	S	.	.			trans	-55.7	135.9	168.6	0	0	0	0	0	110.6	Q80	Q80-G83 PolarHBondContact O-N 3.35Å
84	N	94.3	Very high	92.6	Very high	56 Å²	56	55.1 Å²	55.1	30%	0.299	28%	0.276	S	S	.	.			trans	-155.5	160.6	-178.5	61.2	82.3	0	0	0	110.4	G82 K86 S87 L88 E193	G82-N84 PolarHBondContact O-N 3.26Å; G82-N84 PolarHBondContact O-ND2 2.97Å; N84-K86 VanDerWaalsContact C-N 3.26Å; N84-K86 PolarHBondContact O-N 2.94Å; N84-K86 WeakPolarHBondContact OD1-CB 3.38Å; N84-K86 PolarHBondContact OD1-N 2.57Å; N84-S87 PolarHBondContact N-OG 3.28Å; N84-S87 VanDerWaalsContact N-OG 3.08Å; N84-S87 PolarHBondContact O-N 2.7Å; N84-S87 PolarHBondContact O-OG 3.36Å; N84-S87 PolarHBondContact OD1-N 3.4Å; N84-L88 PolarHBondContact O-N 3.03Å; N84-L88 VanDerWaalsContact O-N 3.1Å; N84-E193 WeakPolarHBondContact CA-OE2 3.49Å; N84-E193 WeakPolarHBondContact CB-OE2 3.41Å
85	L	96.1	Very high	92.7	Very high	5 Å²	5	53.9 Å²	53.9	3%	0.026	27%	0.27	C	S	.	.	H	α-helix	trans	-56.6	-36.3	-175.3	-68.8	169.7	0	0	0	113.4	V73 L88 E89 L180 E193	V73-L85 HydrophobicContact CG1-CD2 3.94Å; L85-L88 PolarHBondContact O-N 3.47Å; L85-E89 PolarHBondContact O-N 3.4Å; L85-L180 HydrophobicContact CD1-CB 3.62Å; L85-L180 HydrophobicContact CD2-CB 4.01Å; L85-L180 HydrophobicContact CD2-CD1 3.89Å; L85-L180 HydrophobicContact CG-CB 4.47Å; L85-E193 WeakPolarHBondContact CB-OE1 3.42Å; L85-E193 HydrophobicContact CD1-CB 3.86Å; L85-E193 HydrophobicContact CD1-CG 3.74Å; L85-E193 HydrophobicContact CG-CB 4.02Å; L85-E193 HydrophobicContact CG-CG 4.02Å; L85-E193 PolarHBondContact N-OE1 3.05Å; L85-E193 PolarHBondContact N-OE2 3.09Å
86	K	95.5	Very high	92.8	Very high	162 Å²	162	51 Å²	51	70%	0.704	25%	0.254	S	S	*	.	H	α-helix	trans	-70.5	-36.1	178.1	-174.3	173.6	-178.3	173.8	0	113	N84 L88 R90	N84-K86 VanDerWaalsContact C-N 3.26Å; N84-K86 PolarHBondContact O-N 2.94Å; N84-K86 WeakPolarHBondContact OD1-CB 3.38Å; N84-K86 PolarHBondContact OD1-N 2.57Å; K86-L88 VanDerWaalsContact C-N 3.34Å; K86-R90 PolarHBondContact O-N 3.24Å
87	S	95.2	Very high	92.7	Very high	25 Å²	25	51.3 Å²	51.3	18%	0.175	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-37.5	173	67.4	0	0	0	0	111.9	N84 R90 A91	N84-S87 PolarHBondContact N-OG 3.28Å; N84-S87 VanDerWaalsContact N-OG 3.08Å; N84-S87 PolarHBondContact O-N 2.7Å; N84-S87 PolarHBondContact O-OG 3.36Å; N84-S87 PolarHBondContact OD1-N 3.4Å; S87-R90 PolarHBondContact O-N 2.84Å; S87-A91 WeakPolarHBondContact O-CB 3.38Å; S87-A91 PolarHBondContact O-N 3.27Å
88	L	96.8	Very high	92.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-69.3	-40.7	175.2	-77.5	158.1	0	0	0	112.4	V73 N84 L85 K86 R90 A91 F92 I129	V73-L88 HydrophobicContact CB-CD1 4.22Å; V73-L88 HydrophobicContact CG1-CD1 3.77Å; V73-L88 HydrophobicContact CG2-CD1 4.09Å; N84-L88 PolarHBondContact O-N 3.03Å; N84-L88 VanDerWaalsContact O-N 3.1Å; L85-L88 PolarHBondContact O-N 3.47Å; K86-L88 VanDerWaalsContact C-N 3.34Å; L88-R90 VanDerWaalsContact C-N 3.34Å; L88-R90 PolarHBondContact O-N 3.14Å; L88-A91 WeakPolarHBondContact O-CB 3.42Å; L88-A91 PolarHBondContact O-N 3.01Å; L88-A91 VanDerWaalsContact O-N 3.13Å; L88-F92 HydrophobicContact CB-CD2 4.47Å; L88-F92 HydrophobicContact CB-CE2 4.19Å; L88-F92 HydrophobicContact CD2-CE2 4.37Å; L88-F92 WeakPolarHBondContact O-CD2 3.24Å; L88-F92 WeakPolarHBondContact O-CG 3.47Å; L88-F92 PolarHBondContact O-N 3.24Å; L88-I129 HydrophobicContact CD2-CG1 4.11Å
89	E	96.9	Very high	92.6	Very high	37 Å²	37	43.6 Å²	43.6	17%	0.173	22%	0.224	C	C	.	.	H	α-helix	trans	-54.2	-50.4	171.7	-173.2	-168.5	161.3	0	0	110.8	L85 A91 F92 H93 Q174 C177 R178	L85-E89 PolarHBondContact O-N 3.4Å; E89-A91 VanDerWaalsContact C-N 3.3Å; E89-A91 PolarHBondContact O-N 2.87Å; E89-F92 PolarHBondContact O-N 2.81Å; E89-H93 WeakPolarHBondContact O-CB 3.35Å; E89-H93 PolarHBondContact O-N 2.69Å; E89-Q174 HydrophobicContact CG-CB 4.06Å; E89-Q174 HydrophobicContact CG-CG 4.1Å; E89-Q174 WeakPolarHBondContact O-CG 3.18Å; E89-C177 HydrophobicContact CB-CB 4.2Å; E89-R178 IonicContact OE1-CZ 3.73Å; E89-R178 IonicContact OE1-NE 3.71Å; E89-R178 PolarHBondContact OE1-NE 3.37Å; E89-R178 IonicContact OE1-NH2 2.73Å; E89-R178 PolarHBondContact OE1-NH2 2.82Å; E89-R178 IonicContact OE2-NE 3.19Å
90	R	95.7	Very high	92.9	Very high	66 Å²	66	38.4 Å²	38.4	25%	0.249	19%	0.189	C	C	.	.	H	α-helix	trans	-65.7	-30.7	177.5	-170.7	60.1	163.6	-158.1	-7.5	112.8	K86 S87 L88 T94 H124 D338	K86-R90 PolarHBondContact O-N 3.24Å; S87-R90 PolarHBondContact O-N 2.84Å; L88-R90 VanDerWaalsContact C-N 3.34Å; L88-R90 PolarHBondContact O-N 3.14Å; R90-T94 WeakPolarHBondContact O-CB 3.33Å; R90-T94 PolarHBondContact O-N 2.91Å; R90-T94 PolarHBondContact O-OG1 2.99Å; R90-H124 HydrophobicContact CG-CB 4.17Å; R90-H124 PolarHBondContact NE-CE1 2.92Å; R90-H124 VanDerWaalsContact NE-CE1 3.27Å; R90-H124 PolarHBondContact NE-NE2 3.09Å; R90-D338 IonicContact CZ-OD1 3.83Å; R90-D338 IonicContact NH1-OD1 3.53Å; R90-D338 PolarHBondContact NH1-OD1 3.36Å; R90-D338 IonicContact NH2-OD1 2.71Å; R90-D338 PolarHBondContact NH2-OD1 3.15Å
91	A	96.7	Very high	93.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-66.7	-50.4	173.2	0	0	0	0	0	111.6	S87 L88 E89 H93 T94 L95 H124 L125 A128 I129	S87-A91 WeakPolarHBondContact O-CB 3.38Å; S87-A91 PolarHBondContact O-N 3.27Å; L88-A91 WeakPolarHBondContact O-CB 3.42Å; L88-A91 PolarHBondContact O-N 3.01Å; L88-A91 VanDerWaalsContact O-N 3.13Å; E89-A91 VanDerWaalsContact C-N 3.3Å; E89-A91 PolarHBondContact O-N 2.87Å; A91-H93 VanDerWaalsContact C-N 3.32Å; A91-H93 PolarHBondContact O-N 3.15Å; A91-T94 PolarHBondContact O-N 3.05Å; A91-T94 VanDerWaalsContact O-N 3.14Å; A91-L95 WeakPolarHBondContact O-CG 3.45Å; A91-L95 PolarHBondContact O-N 2.78Å; A91-H124 WeakPolarHBondContact CB-O 3.21Å; A91-L125 HydrophobicContact CB-CD2 4.33Å; A91-L125 WeakPolarHBondContact O-CD2 3.37Å; A91-A128 HydrophobicContact CB-CB 3.96Å; A91-I129 HydrophobicContact CB-CD1 3.73Å; A91-I129 HydrophobicContact CB-CG1 4.09Å
92	F	97.5	Very high	93.7	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.3	-37.7	176.2	-67.2	-51.8	0	0	0	112	V67 F69 M72 V73 L88 E89 T94 L95 E96 I129 L170 A173 Q174	V67-F92 HydrophobicContact CG1-CE1 4.4Å; F69-F92 AromaticContact CD2-CE2 3.98Å; F69-F92 HydrophobicContact CD2-CE2 3.98Å; F69-F92 HydrophobicContact CD2-CZ 4.01Å; F69-F92 HydrophobicContact CE2-CD2 4.48Å; F69-F92 AromaticContact CE2-CE2 3.75Å; F69-F92 HydrophobicContact CE2-CE2 3.75Å; F69-F92 HydrophobicContact CE2-CZ 4.25Å; M72-F92 HydrophobicContact SD-CE1 3.89Å; M72-F92 HydrophobicContact SD-CZ 4.22Å; V73-F92 HydrophobicContact CG2-CE2 4.15Å; V73-F92 HydrophobicContact CG2-CZ 4.29Å; L88-F92 HydrophobicContact CB-CD2 4.47Å; L88-F92 HydrophobicContact CB-CE2 4.19Å; L88-F92 HydrophobicContact CD2-CE2 4.37Å; L88-F92 WeakPolarHBondContact O-CD2 3.24Å; L88-F92 WeakPolarHBondContact O-CG 3.47Å; L88-F92 PolarHBondContact O-N 3.24Å; E89-F92 PolarHBondContact O-N 2.81Å; F92-T94 PolarHBondContact O-N 3.01Å; F92-L95 HydrophobicContact CD1-CD1 4.22Å; F92-L95 PolarHBondContact O-N 3.43Å; F92-E96 WeakPolarHBondContact O-CB 3.45Å; F92-E96 PolarHBondContact O-N 2.85Å; F92-I129 HydrophobicContact CE1-CD1 4.41Å; F92-L170 HydrophobicContact CD1-CD2 3.89Å; F92-A173 HydrophobicContact CB-CB 4.15Å; F92-A173 HydrophobicContact CD1-CB 3.9Å; F92-A173 HydrophobicContact CD2-CB 3.68Å; F92-A173 HydrophobicContact CE1-CB 4.2Å; F92-A173 HydrophobicContact CE2-CB 3.99Å; F92-A173 HydrophobicContact CG-CB 3.64Å; F92-A173 HydrophobicContact CZ-CB 4.24Å; F92-Q174 HydrophobicContact CB-CG 3.87Å
93	H	96.1	Very high	94.2	Very high	47 Å²	47	23.8 Å²	23.8	22%	0.218	12%	0.117	C	C	.	.	H	α-helix	trans	-62.4	-39.6	172.3	-173	72	0	0	0	113.2	E89 A91 E96 T97 Q174	E89-H93 WeakPolarHBondContact O-CB 3.35Å; E89-H93 PolarHBondContact O-N 2.69Å; A91-H93 VanDerWaalsContact C-N 3.32Å; A91-H93 PolarHBondContact O-N 3.15Å; H93-E96 PolarHBondContact O-N 2.97Å; H93-T97 WeakPolarHBondContact O-CB 3.17Å; H93-T97 PolarHBondContact O-N 3.28Å; H93-T97 PolarHBondContact O-OG1 2.86Å; H93-Q174 VanDerWaalsContact CA-CD 3.48Å; H93-Q174 HydrophobicContact CB-CG 4.26Å; H93-Q174 VanDerWaalsContact CB-OE1 3.3Å; H93-Q174 PolarHBondContact ND1-OE1 3.23Å
94	T	96.1	Very high	94.4	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-69.4	-38.8	177.4	-58.5	0	0	0	0	110.8	R90 A91 F92 T97 I98 H124 L125 I340 L342	R90-T94 WeakPolarHBondContact O-CB 3.33Å; R90-T94 PolarHBondContact O-N 2.91Å; R90-T94 PolarHBondContact O-OG1 2.99Å; A91-T94 PolarHBondContact O-N 3.05Å; A91-T94 VanDerWaalsContact O-N 3.14Å; F92-T94 PolarHBondContact O-N 3.01Å; T94-T97 PolarHBondContact O-N 3.38Å; T94-I98 WeakPolarHBondContact O-CG1 3.46Å; T94-I98 PolarHBondContact O-N 2.92Å; T94-I98 VanDerWaalsContact O-N 3.09Å; T94-H124 HydrophobicContact CG2-CB 4.4Å; T94-H124 WeakPolarHBondContact OG1-CB 3.26Å; T94-H124 PolarHBondContact OG1-ND1 3.39Å; T94-L125 HydrophobicContact CG2-CD1 4.07Å; T94-L125 HydrophobicContact CG2-CD2 3.82Å; T94-L125 HydrophobicContact CG2-CG 3.91Å; T94-I340 HydrophobicContact CG2-CG2 4.09Å; T94-L342 HydrophobicContact CG2-CD1 3.88Å; T94-L342 HydrophobicContact CG2-CD2 4.11Å; T94-L342 HydrophobicContact CG2-CG 4.36Å
95	L	96.3	Very high	94.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.6	-40.8	173.4	-70.6	161.4	0	0	0	112.7	A91 F92 I98 C99 L125 I129 L134 L137 M138 I141 L170	A91-L95 WeakPolarHBondContact O-CG 3.45Å; A91-L95 PolarHBondContact O-N 2.78Å; F92-L95 HydrophobicContact CD1-CD1 4.22Å; F92-L95 PolarHBondContact O-N 3.43Å; L95-I98 WeakPolarHBondContact O-CB 3.26Å; L95-I98 PolarHBondContact O-N 3.07Å; L95-C99 PolarHBondContact O-N 2.76Å; L95-C99 VanDerWaalsContact O-N 3.12Å; L95-C99 PolarHBondContact O-SG 2.99Å; L95-L125 HydrophobicContact CD1-CD2 4.32Å; L95-L125 HydrophobicContact CD2-CD2 4.17Å; L95-L125 HydrophobicContact CG-CD2 3.74Å; L95-I129 HydrophobicContact CD1-CD1 3.7Å; L95-L134 HydrophobicContact CD2-CD1 4.01Å; L95-L137 HydrophobicContact CD1-CD1 3.65Å; L95-L137 HydrophobicContact CD2-CD1 4.46Å; L95-M138 HydrophobicContact CD2-CE 3.81Å; L95-I141 HydrophobicContact CD2-CD1 4.4Å; L95-L170 HydrophobicContact CB-CD1 3.91Å; L95-L170 HydrophobicContact CB-CD2 3.98Å; L95-L170 HydrophobicContact CB-CG 4.49Å; L95-L170 HydrophobicContact CD1-CD2 4.17Å
96	E	95.8	Very high	93.7	Very high	13 Å²	13	25.2 Å²	25.2	6%	0.061	12%	0.122	C	C	.	.	H	α-helix	trans	-58.7	-49.8	172.2	-171.2	-159.2	158.1	0	0	109.8	Y13 F92 H93 I98 C99 T100 A167 L170 Q174	Y13-E96 WeakPolarHBondContact CE2-OE1 3.37Å; Y13-E96 VanDerWaalsContact CZ-OE1 3.32Å; Y13-E96 VanDerWaalsContact OH-CD 3.28Å; Y13-E96 VanDerWaalsContact OH-CG 3.31Å; Y13-E96 WeakPolarHBondContact OH-CG 3.07Å; Y13-E96 PolarHBondContact OH-OE1 2.86Å; F92-E96 WeakPolarHBondContact O-CB 3.45Å; F92-E96 PolarHBondContact O-N 2.85Å; H93-E96 PolarHBondContact O-N 2.97Å; E96-I98 VanDerWaalsContact C-N 3.26Å; E96-I98 PolarHBondContact O-N 3.13Å; E96-C99 CarbonylContact O-C 3.52Å; E96-C99 WeakPolarHBondContact O-CA 3.36Å; E96-C99 WeakPolarHBondContact O-CB 3.44Å; E96-C99 PolarHBondContact O-N 2.86Å; E96-T100 HydrophobicContact CG-CG2 4.22Å; E96-T100 WeakPolarHBondContact O-CG2 3.49Å; E96-T100 PolarHBondContact O-N 3.25Å; E96-A167 HydrophobicContact CG-CB 4.45Å; E96-L170 HydrophobicContact CB-CB 4.07Å; E96-Q174 PolarHBondContact OE2-NE2 2.94Å
97	T	93.6	Very high	93.2	Very high	8 Å²	8	25.9 Å²	25.9	5%	0.049	12%	0.12	C	C	.	.	H	α-helix	trans	-57.4	-38.3	179.1	-64.8	0	0	0	0	112.4	H93 T94 T100 N101	H93-T97 WeakPolarHBondContact O-CB 3.17Å; H93-T97 PolarHBondContact O-N 3.28Å; H93-T97 PolarHBondContact O-OG1 2.86Å; T94-T97 PolarHBondContact O-N 3.38Å; T97-T100 WeakPolarHBondContact CA-OG1 2.83Å; T97-T100 PolarHBondContact O-N 2.7Å; T97-T100 PolarHBondContact O-OG1 3.02Å; T97-T100 VanDerWaalsContact O-OG1 3.1Å; T97-N101 VanDerWaalsContact O-CB 3.3Å; T97-N101 WeakPolarHBondContact O-CB 3.39Å; T97-N101 PolarHBondContact O-N 3.21Å; T97-N101 PolarHBondContact O-OD1 2.93Å
98	I	92.9	Very high	92.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-59.3	-47.7	171.3	-72.5	162.3	0	0	0	111.1	T94 L95 E96 L102 I114 L125 M138 I141 Y143 L342	T94-I98 WeakPolarHBondContact O-CG1 3.46Å; T94-I98 PolarHBondContact O-N 2.92Å; T94-I98 VanDerWaalsContact O-N 3.09Å; L95-I98 WeakPolarHBondContact O-CB 3.26Å; L95-I98 PolarHBondContact O-N 3.07Å; E96-I98 VanDerWaalsContact C-N 3.26Å; E96-I98 PolarHBondContact O-N 3.13Å; I98-L102 WeakPolarHBondContact O-CB 3.41Å; I98-L102 PolarHBondContact O-N 3.35Å; I98-L102 VanDerWaalsContact O-N 3.11Å; I98-I114 HydrophobicContact CB-CD1 4.39Å; I98-I114 HydrophobicContact CD1-CD1 3.89Å; I98-I114 HydrophobicContact CG1-CD1 3.91Å; I98-I114 HydrophobicContact CG2-CD1 3.58Å; I98-L125 HydrophobicContact CD1-CD1 4.17Å; I98-M138 HydrophobicContact CD1-CE 3.89Å; I98-I141 HydrophobicContact CG2-CD1 4.26Å; I98-I141 HydrophobicContact CG2-CG2 4.42Å; I98-Y143 HydrophobicContact CG2-CE2 3.73Å; I98-L342 HydrophobicContact CD1-CD1 3.8Å; I98-L342 HydrophobicContact CG1-CD1 3.54Å
99	C	93.1	Very high	92.3	Very high	0 Å²	0	35 Å²	35	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63	-43.3	177.3	-58.2	0	0	0	0	112	L95 E96 L102 L103 L163 A167	L95-C99 PolarHBondContact O-N 2.76Å; L95-C99 VanDerWaalsContact O-N 3.12Å; L95-C99 PolarHBondContact O-SG 2.99Å; E96-C99 CarbonylContact O-C 3.52Å; E96-C99 WeakPolarHBondContact O-CA 3.36Å; E96-C99 WeakPolarHBondContact O-CB 3.44Å; E96-C99 PolarHBondContact O-N 2.86Å; C99-L102 PolarHBondContact O-N 3.03Å; C99-L103 WeakPolarHBondContact O-CB 3.27Å; C99-L103 VanDerWaalsContact O-CG 3.32Å; C99-L103 WeakPolarHBondContact O-CG 3.43Å; C99-L103 PolarHBondContact O-N 3.43Å; C99-L163 HydrophobicContact CB-CD1 3.79Å; C99-L163 HydrophobicContact CB-CG 4.44Å; C99-A167 HydrophobicContact CB-CB 3.69Å
100	T	92.4	Very high	91.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-69.7	-37.1	-178.5	62.9	0	0	0	0	112.3	L17 R20 E96 T97 L103 L104 A167	L17-T100 HydrophobicContact CD1-CG2 3.89Å; L17-T100 HydrophobicContact CD2-CG2 3.41Å; L17-T100 VanDerWaalsContact CD2-CG2 3.41Å; L17-T100 HydrophobicContact CG-CG2 4.29Å; R20-T100 PolarHBondContact NH1-OG1 3.5Å; E96-T100 HydrophobicContact CG-CG2 4.22Å; E96-T100 WeakPolarHBondContact O-CG2 3.49Å; E96-T100 PolarHBondContact O-N 3.25Å; T97-T100 WeakPolarHBondContact CA-OG1 2.83Å; T97-T100 PolarHBondContact O-N 2.7Å; T97-T100 PolarHBondContact O-OG1 3.02Å; T97-T100 VanDerWaalsContact O-OG1 3.1Å; T100-L103 PolarHBondContact O-N 2.96Å; T100-L104 WeakPolarHBondContact O-CB 3.4Å; T100-L104 VanDerWaalsContact O-CG 3.27Å; T100-L104 WeakPolarHBondContact O-CG 3.36Å; T100-L104 PolarHBondContact O-N 2.92Å; T100-A167 HydrophobicContact CG2-CB 4.47Å
101	N	91.6	Very high	91.4	Very high	21 Å²	21	34.8 Å²	34.8	11%	0.112	16%	0.158	C	C	.	.	H	α-helix	trans	-67.4	-39.7	176.8	-72	7.5	0	0	0	111.1	T97 F105 F111 Y343	T97-N101 VanDerWaalsContact O-CB 3.3Å; T97-N101 WeakPolarHBondContact O-CB 3.39Å; T97-N101 PolarHBondContact O-N 3.21Å; T97-N101 PolarHBondContact O-OD1 2.93Å; N101-F105 PolarHBondContact O-N 3.22Å; N101-F111 HydrophobicContact CB-CD1 4.03Å; N101-F111 HydrophobicContact CB-CD2 3.87Å; N101-F111 HydrophobicContact CB-CE1 4.05Å; N101-F111 HydrophobicContact CB-CE2 3.86Å; N101-F111 HydrophobicContact CB-CG 3.96Å; N101-F111 HydrophobicContact CB-CZ 3.96Å; N101-F111 WeakPolarHBondContact O-CD2 3.37Å; N101-Y343 WeakPolarHBondContact ND2-CE2 3.48Å
102	L	91.1	Very high	91.1	Very high	8 Å²	8	38.4 Å²	38.4	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-67.2	-35.7	174.2	179.2	59.7	0	0	0	112.7	I98 C99 P106 I141 Y143 L153 L163	I98-L102 WeakPolarHBondContact O-CB 3.41Å; I98-L102 PolarHBondContact O-N 3.35Å; I98-L102 VanDerWaalsContact O-N 3.11Å; C99-L102 PolarHBondContact O-N 3.03Å; L102-P106 WeakPolarHBondContact O-CB 3.35Å; L102-P106 WeakPolarHBondContact O-CD 3.33Å; L102-I141 HydrophobicContact CD2-CG2 3.94Å; L102-Y143 HydrophobicContact CD2-CE2 4.28Å; L102-L153 HydrophobicContact CD1-CD1 4.06Å; L102-L153 HydrophobicContact CD1-CD2 3.64Å; L102-L153 HydrophobicContact CD1-CG 4.49Å; L102-L153 HydrophobicContact CD2-CD1 3.62Å; L102-L163 HydrophobicContact CB-CD2 4.11Å; L102-L163 HydrophobicContact CD2-CD2 3.66Å; L102-L163 HydrophobicContact CG-CD2 3.69Å
103	L	89.9	Confident	90.7	Very high	36 Å²	36	40 Å²	40	19%	0.188	18%	0.183	C	C	.	.	H	α-helix	trans	-67.3	-47.5	173.5	-79.1	165.8	0	0	0	113	L17 C99 T100 L163 R164 A167	L17-L103 HydrophobicContact CD1-CD1 4.42Å; C99-L103 WeakPolarHBondContact O-CB 3.27Å; C99-L103 VanDerWaalsContact O-CG 3.32Å; C99-L103 WeakPolarHBondContact O-CG 3.43Å; C99-L103 PolarHBondContact O-N 3.43Å; T100-L103 PolarHBondContact O-N 2.96Å; L103-L163 HydrophobicContact CD1-CG 4.19Å; L103-L163 HydrophobicContact CD2-CB 3.94Å; L103-L163 HydrophobicContact CD2-CD2 3.87Å; L103-L163 HydrophobicContact CD2-CG 3.9Å; L103-L163 HydrophobicContact CG-CB 4.33Å; L103-L163 HydrophobicContact CG-CD2 3.71Å; L103-L163 HydrophobicContact CG-CG 3.74Å; L103-R164 HydrophobicContact CD1-CB 4.45Å; L103-R164 HydrophobicContact CD1-CG 3.87Å; L103-R164 HydrophobicContact CD2-CG 3.91Å; L103-A167 HydrophobicContact CD1-CB 4.44Å
104	L	88.9	Confident	90.4	Very high	41 Å²	41	37.8 Å²	37.8	22%	0.215	17%	0.173	C	C	.	.	H	α-helix	trans	-81.1	-28.3	-172	-67.4	172	0	0	0	112.9	R20 T100 W107	R20-L104 HydrophobicContact CB-CD1 4.16Å; T100-L104 WeakPolarHBondContact O-CB 3.4Å; T100-L104 VanDerWaalsContact O-CG 3.27Å; T100-L104 WeakPolarHBondContact O-CG 3.36Å; T100-L104 PolarHBondContact O-N 2.92Å; L104-W107 WeakPolarHBondContact O-CH2 3.45Å
105	F	88.8	Confident	90.1	Very high	25 Å²	25	40.2 Å²	40.2	11%	0.11	18%	0.183	C	C	.	.			trans	-138	48.2	-172	-45.3	-73.1	0	0	0	114.4	E22 N101 W107 K108 F111	E22-F105 HydrophobicContact CG-CE1 3.5Å; E22-F105 HydrophobicContact CG-CZ 3.9Å; N101-F105 PolarHBondContact O-N 3.22Å; F105-W107 HydrophobicContact CB-CZ2 4.35Å; F105-W107 HydrophobicContact CD1-CH2 4.14Å; F105-W107 AromaticContact CD1-CZ2 3.85Å; F105-W107 HydrophobicContact CD1-CZ2 3.85Å; F105-W107 PolarHBondContact O-N 2.86Å; F105-K108 HydrophobicContact CB-CB 4.4Å; F105-K108 HydrophobicContact CB-CD 3.76Å; F105-K108 HydrophobicContact CB-CG 4Å; F105-K108 HydrophobicContact CG-CD 4.22Å; F105-K108 WeakPolarHBondContact O-CB 3.26Å; F105-K108 PolarHBondContact O-N 2.77Å; F105-F111 HydrophobicContact CB-CD2 3.73Å; F105-F111 HydrophobicContact CB-CE2 3.68Å; F105-F111 HydrophobicContact CD2-CD2 4.28Å; F105-F111 AromaticContact CD2-CE2 3.57Å; F105-F111 HydrophobicContact CD2-CE2 3.57Å; F105-F111 HydrophobicContact CD2-CZ 4.48Å; F105-F111 HydrophobicContact CG-CD2 4.46Å; F105-F111 AromaticContact CG-CE2 3.95Å; F105-F111 HydrophobicContact CG-CE2 3.95Å
106	P	87.2	Confident	89.8	Confident	41 Å²	41	41.4 Å²	41.4	27%	0.266	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-6.3	-173.2	24.9	-35.5	0	0	0	116.1	L102 R112	L102-P106 WeakPolarHBondContact O-CB 3.35Å; L102-P106 WeakPolarHBondContact O-CD 3.33Å; P106-R112 PolarHBondContact O-NE 3.43Å; P106-R112 PolarHBondContact O-NH2 3.26Å
107	W	84.2	Confident	89.4	Confident	175 Å²	175	46.1 Å²	46.1	66%	0.663	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-17.9	173.4	58.2	90.4	0	0	0	113.8	L104 F105	L104-W107 WeakPolarHBondContact O-CH2 3.45Å; F105-W107 HydrophobicContact CB-CZ2 4.35Å; F105-W107 HydrophobicContact CD1-CH2 4.14Å; F105-W107 AromaticContact CD1-CZ2 3.85Å; F105-W107 HydrophobicContact CD1-CZ2 3.85Å; F105-W107 PolarHBondContact O-N 2.86Å
108	K	87.8	Confident	89.2	Confident	43 Å²	43	46.4 Å²	46.4	19%	0.187	21%	0.212	C	C	.	.			trans	-73.9	137	-178.8	-70.1	-170.7	-173.9	178.4	0	110.9	E22 F105 E110 F111	E22-K108 WeakPolarHBondContact OE1-CE 3.32Å; E22-K108 IonicContact OE1-NZ 3.62Å; E22-K108 PolarHBondContact OE1-NZ 3.23Å; F105-K108 HydrophobicContact CB-CB 4.4Å; F105-K108 HydrophobicContact CB-CD 3.76Å; F105-K108 HydrophobicContact CB-CG 4Å; F105-K108 HydrophobicContact CG-CD 4.22Å; F105-K108 WeakPolarHBondContact O-CB 3.26Å; F105-K108 PolarHBondContact O-N 2.77Å; K108-E110 HydrophobicContact CB-CG 4.34Å; K108-E110 WeakPolarHBondContact CD-OE1 3.39Å; K108-F111 HydrophobicContact CB-CD2 3.8Å; K108-F111 HydrophobicContact CB-CE2 4.21Å; K108-F111 HydrophobicContact CB-CG 4.37Å; K108-F111 HydrophobicContact CD-CD2 4.18Å; K108-F111 HydrophobicContact CD-CE2 3.72Å; K108-F111 HydrophobicContact CD-CZ 4.43Å
109	K	85.6	Confident	89	Confident	173 Å²	173	48.1 Å²	48.1	75%	0.752	23%	0.23	S	C	*	.	S	Bend	trans	-79.3	-34.5	-169.4	-69.5	-175.9	178	-179.6	0	112	F111 R112 C113	K109-F111 VanDerWaalsContact C-N 3.29Å; K109-F111 PolarHBondContact O-N 3.12Å; K109-R112 WeakPolarHBondContact O-CA 3.37Å; K109-R112 WeakPolarHBondContact O-CB 3.17Å; K109-R112 PolarHBondContact O-N 2.92Å; K109-C113 PolarHBondContact O-N 3.09Å
110	E	85.9	Confident	88.8	Confident	82 Å²	82	49 Å²	49	38%	0.383	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-57	-40.5	172.6	58.5	-86.1	-150.1	0	0	111.9	K108 R112 C113 Y343	K108-E110 HydrophobicContact CB-CG 4.34Å; K108-E110 WeakPolarHBondContact CD-OE1 3.39Å; E110-R112 PolarHBondContact O-N 3.35Å; E110-C113 CarbonylContact O-C 3.54Å; E110-C113 PolarHBondContact O-N 3.11Å; E110-Y343 HydrophobicContact CB-CD1 4.2Å; E110-Y343 HydrophobicContact CB-CG 4.42Å; E110-Y343 WeakPolarHBondContact O-CD1 3.47Å
111	F	88.8	Confident	88.8	Confident	17 Å²	17	49.2 Å²	49.2	8%	0.075	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-80.8	-3.1	176.6	-52	-26.5	0	0	0	113.5	N101 F105 K108 K109 Y143 Y343	N101-F111 HydrophobicContact CB-CD1 4.03Å; N101-F111 HydrophobicContact CB-CD2 3.87Å; N101-F111 HydrophobicContact CB-CE1 4.05Å; N101-F111 HydrophobicContact CB-CE2 3.86Å; N101-F111 HydrophobicContact CB-CG 3.96Å; N101-F111 HydrophobicContact CB-CZ 3.96Å; N101-F111 WeakPolarHBondContact O-CD2 3.37Å; F105-F111 HydrophobicContact CB-CD2 3.73Å; F105-F111 HydrophobicContact CB-CE2 3.68Å; F105-F111 HydrophobicContact CD2-CD2 4.28Å; F105-F111 AromaticContact CD2-CE2 3.57Å; F105-F111 HydrophobicContact CD2-CE2 3.57Å; F105-F111 HydrophobicContact CD2-CZ 4.48Å; F105-F111 HydrophobicContact CG-CD2 4.46Å; F105-F111 AromaticContact CG-CE2 3.95Å; F105-F111 HydrophobicContact CG-CE2 3.95Å; K108-F111 HydrophobicContact CB-CD2 3.8Å; K108-F111 HydrophobicContact CB-CE2 4.21Å; K108-F111 HydrophobicContact CB-CG 4.37Å; K108-F111 HydrophobicContact CD-CD2 4.18Å; K108-F111 HydrophobicContact CD-CE2 3.72Å; K108-F111 HydrophobicContact CD-CZ 4.43Å; K109-F111 VanDerWaalsContact C-N 3.29Å; K109-F111 PolarHBondContact O-N 3.12Å; F111-Y143 PolarHBondContact O-OH 2.67Å; F111-Y343 AromaticContact CD1-CD1 3.75Å; F111-Y343 HydrophobicContact CD1-CD1 3.75Å; F111-Y343 HydrophobicContact CD1-CD2 4.11Å; F111-Y343 AromaticContact CD1-CE1 3.46Å; F111-Y343 HydrophobicContact CD1-CE1 3.46Å; F111-Y343 VanDerWaalsContact CD1-CE1 3.46Å; F111-Y343 AromaticContact CD1-CE2 3.84Å; F111-Y343 HydrophobicContact CD1-CE2 3.84Å; F111-Y343 HydrophobicContact CD1-CG 4.06Å; F111-Y343 AromaticContact CD1-CZ 3.5Å; F111-Y343 HydrophobicContact CE1-CD1 4.05Å; F111-Y343 AromaticContact CE1-CD2 3.61Å; F111-Y343 HydrophobicContact CE1-CD2 3.61Å; F111-Y343 AromaticContact CE1-CE1 4Å; F111-Y343 HydrophobicContact CE1-CE1 4Å; F111-Y343 AromaticContact CE1-CE2 3.53Å; F111-Y343 HydrophobicContact CE1-CE2 3.53Å; F111-Y343 AromaticContact CE1-CG 3.87Å; F111-Y343 HydrophobicContact CE1-CG 3.87Å; F111-Y343 AromaticContact CE1-CZ 3.74Å
112	R	89.2	Confident	88.8	Confident	76 Å²	76	50.6 Å²	50.6	29%	0.287	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-97.2	-8.4	169.4	-69.5	-179.3	170.8	-112.2	-7	113.4	P106 K109 E110 R152 L153 D155	P106-R112 PolarHBondContact O-NE 3.43Å; P106-R112 PolarHBondContact O-NH2 3.26Å; K109-R112 WeakPolarHBondContact O-CA 3.37Å; K109-R112 WeakPolarHBondContact O-CB 3.17Å; K109-R112 PolarHBondContact O-N 2.92Å; E110-R112 PolarHBondContact O-N 3.35Å; R112-R152 WeakPolarHBondContact O-CA 3.42Å; R112-L153 HydrophobicContact CB-CB 4.24Å; R112-L153 HydrophobicContact CG-CB 4.35Å; R112-L153 HydrophobicContact CG-CD2 4Å; R112-L153 PolarHBondContact O-N 2.94Å; R112-D155 IonicContact NH1-OD1 2.82Å
113	C	89	Confident	88.8	Confident	35 Å²	35	58.7 Å²	58.7	24%	0.236	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	92	-175.4	-171.8	0	0	0	0	112.4	K109 E110 F151 R152	K109-C113 PolarHBondContact O-N 3.09Å; E110-C113 CarbonylContact O-C 3.54Å; E110-C113 PolarHBondContact O-N 3.11Å; C113-F151 CarbonylContact C-O 3.53Å; C113-F151 VanDerWaalsContact CA-O 3.31Å; C113-F151 WeakPolarHBondContact CA-O 3.44Å; C113-R152 PolarHBondContact SG-NH1 3.35Å
114	I	90	Very high	89	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124.3	179	-54.2	174.2	0	0	0	109.7	I98 Y121 M138 Y143 Q150 F151 Y343	I98-I114 HydrophobicContact CB-CD1 4.39Å; I98-I114 HydrophobicContact CD1-CD1 3.89Å; I98-I114 HydrophobicContact CG1-CD1 3.91Å; I98-I114 HydrophobicContact CG2-CD1 3.58Å; I114-Y121 HydrophobicContact CG2-CD2 4.38Å; I114-M138 HydrophobicContact CD1-SD 4.43Å; I114-Y143 HydrophobicContact CD1-CD2 4.49Å; I114-Y143 HydrophobicContact CD1-CE1 4.02Å; I114-Y143 HydrophobicContact CD1-CE2 3.85Å; I114-Y143 HydrophobicContact CG1-CE1 4.09Å; I114-Q150 WeakPolarHBondContact O-CA 3.32Å; I114-F151 HydrophobicContact CB-CB 4.23Å; I114-F151 PolarHBondContact N-O 2.96Å; I114-F151 PolarHBondContact O-N 2.67Å; I114-Y343 HydrophobicContact CG1-CE1 4.18Å
115	K	89.6	Confident	89.3	Confident	51 Å²	51	56.8 Å²	56.8	22%	0.222	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.3	177	-74.4	163.7	172.6	-176	0	110	F117 T118 Q150 E345	K115-F117 HydrophobicContact CB-CD1 4.06Å; K115-F117 HydrophobicContact CB-CD2 4.47Å; K115-F117 HydrophobicContact CB-CE1 3.77Å; K115-F117 HydrophobicContact CB-CE2 4.21Å; K115-F117 HydrophobicContact CB-CG 4.42Å; K115-F117 HydrophobicContact CB-CZ 3.87Å; K115-F117 HydrophobicContact CD-CE1 4.18Å; K115-F117 HydrophobicContact CD-CE2 3.95Å; K115-F117 HydrophobicContact CD-CZ 3.52Å; K115-F117 HydrophobicContact CG-CE1 3.82Å; K115-F117 HydrophobicContact CG-CE2 4.38Å; K115-F117 HydrophobicContact CG-CZ 3.71Å; K115-F117 PolarHBondContact O-N 2.65Å; K115-F117 VanDerWaalsContact O-N 3.14Å; K115-T118 HydrophobicContact CB-CG2 3.99Å; K115-T118 PolarHBondContact O-N 3.44Å; K115-T118 PolarHBondContact O-OG1 2.87Å; K115-Q150 HydrophobicContact CG-CG 4.01Å; K115-E345 VanDerWaalsContact NZ-CD 3.34Å; K115-E345 IonicContact NZ-OE1 2.7Å; K115-E345 PolarHBondContact NZ-OE1 3.4Å
116	T	90.2	Very high	89.5	Confident	24 Å²	24	59.9 Å²	59.9	15%	0.147	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	1.5	-177.7	71.1	0	0	0	0	114.1	Y121 S149 F151	T116-Y121 VanDerWaalsContact CB-CE1 3.5Å; T116-Y121 HydrophobicContact CG2-CD2 4.46Å; T116-Y121 HydrophobicContact CG2-CE1 4Å; T116-Y121 HydrophobicContact CG2-CE2 3.82Å; T116-Y121 WeakPolarHBondContact O-CD1 3.27Å; T116-S149 WeakPolarHBondContact CG2-O 3.45Å; T116-S149 PolarHBondContact N-O 2.84Å; T116-S149 WeakPolarHBondContact OG1-CB 3.44Å; T116-S149 PolarHBondContact OG1-O 3.35Å; T116-F151 HydrophobicContact CG2-CD2 3.69Å; T116-F151 HydrophobicContact CG2-CE2 3.61Å
117	F	87.9	Confident	89.7	Confident	113 Å²	113	59.9 Å²	59.9	50%	0.496	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	9.2	-180	56.4	-97.1	0	0	0	113.4	K115	K115-F117 HydrophobicContact CB-CD1 4.06Å; K115-F117 HydrophobicContact CB-CD2 4.47Å; K115-F117 HydrophobicContact CB-CE1 3.77Å; K115-F117 HydrophobicContact CB-CE2 4.21Å; K115-F117 HydrophobicContact CB-CG 4.42Å; K115-F117 HydrophobicContact CB-CZ 3.87Å; K115-F117 HydrophobicContact CD-CE1 4.18Å; K115-F117 HydrophobicContact CD-CE2 3.95Å; K115-F117 HydrophobicContact CD-CZ 3.52Å; K115-F117 HydrophobicContact CG-CE1 3.82Å; K115-F117 HydrophobicContact CG-CE2 4.38Å; K115-F117 HydrophobicContact CG-CZ 3.71Å; K115-F117 PolarHBondContact O-N 2.65Å; K115-F117 VanDerWaalsContact O-N 3.14Å
118	T	88.9	Confident	90.2	Very high	13 Å²	13	51.5 Å²	51.5	8%	0.08	25%	0.25	C	S	.	.	S	Bend	trans	-79.1	153.2	173.4	61	0	0	0	0	111.7	K115 Y121 V122 L342	K115-T118 HydrophobicContact CB-CG2 3.99Å; K115-T118 PolarHBondContact O-N 3.44Å; K115-T118 PolarHBondContact O-OG1 2.87Å; T118-Y121 PolarHBondContact O-N 3.44Å; T118-V122 PolarHBondContact O-N 2.98Å; T118-L342 WeakPolarHBondContact CG2-O 3.4Å; T118-L342 PolarHBondContact OG1-O 2.89Å
119	G	89.6	Confident	90.5	Very high	36 Å²	36	49.5 Å²	49.5	37%	0.371	24%	0.242	S	C	.	.	H	α-helix	trans	-52.3	-56.3	-175.5	0	0	0	0	0	113	Y121 V122 Y123	G119-Y121 VanDerWaalsContact C-N 3.32Å; G119-Y121 PolarHBondContact O-N 2.84Å; G119-V122 PolarHBondContact O-N 3.23Å; G119-Y123 WeakPolarHBondContact O-CB 3.46Å; G119-Y123 WeakPolarHBondContact O-CD2 3.3Å; G119-Y123 PolarHBondContact O-N 3.2Å
120	P	88.8	Confident	90.7	Very high	20 Å²	20	43.4 Å²	43.4	13%	0.13	22%	0.221	C	C	.	.	H	α-helix	trans	-66.8	-28.5	-178.6	-22.2	34.8	0	0	0	113.9	H124 L125 I340 D341 L342	P120-H124 WeakPolarHBondContact O-CA 3.45Å; P120-H124 WeakPolarHBondContact O-CB 3.41Å; P120-H124 PolarHBondContact O-N 2.91Å; P120-L125 PolarHBondContact O-N 3.08Å; P120-I340 HydrophobicContact CB-CG2 3.86Å; P120-I340 HydrophobicContact CG-CG2 4.23Å; P120-D341 WeakPolarHBondContact CD-O 3.48Å; P120-D341 WeakPolarHBondContact CG-O 3.26Å; P120-L342 HydrophobicContact CB-CD2 3.8Å; P120-L342 HydrophobicContact CB-CG 4.03Å
121	Y	92.3	Very high	90.9	Very high	3 Å²	3	42.7 Å²	42.7	1%	0.012	22%	0.22	C	C	.	.	I	π-helix	trans	-63.7	-50.5	172.4	-175.9	-76.2	0	0	0	110.4	I114 T116 T118 G119 L125 Q126 L134 M138 F151	I114-Y121 HydrophobicContact CG2-CD2 4.38Å; T116-Y121 VanDerWaalsContact CB-CE1 3.5Å; T116-Y121 HydrophobicContact CG2-CD2 4.46Å; T116-Y121 HydrophobicContact CG2-CE1 4Å; T116-Y121 HydrophobicContact CG2-CE2 3.82Å; T116-Y121 WeakPolarHBondContact O-CD1 3.27Å; T118-Y121 PolarHBondContact O-N 3.44Å; G119-Y121 VanDerWaalsContact C-N 3.32Å; G119-Y121 PolarHBondContact O-N 2.84Å; Y121-L125 HydrophobicContact CD2-CD1 3.8Å; Y121-L125 HydrophobicContact CE2-CD1 4.26Å; Y121-L125 HydrophobicContact CG-CD1 4.34Å; Y121-L125 WeakPolarHBondContact O-CA 3.39Å; Y121-L125 VanDerWaalsContact O-CB 3.29Å; Y121-L125 WeakPolarHBondContact O-CB 3.29Å; Y121-L125 PolarHBondContact O-N 3.49Å; Y121-L125 VanDerWaalsContact O-N 3.08Å; Y121-Q126 HydrophobicContact CD1-CB 4.38Å; Y121-Q126 HydrophobicContact CE1-CB 4.12Å; Y121-Q126 PolarHBondContact O-N 3.07Å; Y121-L134 HydrophobicContact CE1-CD2 4.14Å; Y121-L134 HydrophobicContact CE2-CD2 4.01Å; Y121-L134 VanDerWaalsContact OH-CD2 3.26Å; Y121-L134 WeakPolarHBondContact OH-CD2 3.45Å; Y121-M138 HydrophobicContact CE2-CE 4.33Å; Y121-F151 HydrophobicContact CE2-CD2 4.24Å; Y121-F151 AromaticContact CE2-CE2 3.94Å; Y121-F151 HydrophobicContact CE2-CE2 3.94Å; Y121-F151 WeakPolarHBondContact OH-CE2 3.49Å
122	V	91.3	Very high	91	Very high	50 Å²	50	44.8 Å²	44.8	30%	0.303	24%	0.24	S	C	.	.	I	π-helix	trans	-69.3	-43.7	-177.8	178	0	0	0	0	111.6	T118 G119 S127	T118-V122 PolarHBondContact O-N 2.98Å; G119-V122 PolarHBondContact O-N 3.23Å; V122-S127 PolarHBondContact O-N 2.91Å
123	Y	91.7	Very high	91.1	Very high	179 Å²	179	42.5 Å²	42.5	70%	0.702	23%	0.232	S	C	*	.	I	π-helix	trans	-90.3	-20.2	-172	-64.6	-59.5	0	0	0	115.4	G119 S127	G119-Y123 WeakPolarHBondContact O-CB 3.46Å; G119-Y123 WeakPolarHBondContact O-CD2 3.3Å; G119-Y123 PolarHBondContact O-N 3.2Å; Y123-S127 WeakPolarHBondContact O-CB 3.45Å; Y123-S127 PolarHBondContact O-OG 3.21Å
124	H	93.9	Very high	91.3	Very high	36 Å²	36	40.8 Å²	40.8	17%	0.167	22%	0.221	C	C	.	.	I	π-helix	trans	-107.7	-39.3	173.4	-50.4	160.2	0	0	0	113.3	R90 A91 T94 P120 S127	R90-H124 HydrophobicContact CG-CB 4.17Å; R90-H124 PolarHBondContact NE-CE1 2.92Å; R90-H124 VanDerWaalsContact NE-CE1 3.27Å; R90-H124 PolarHBondContact NE-NE2 3.09Å; A91-H124 WeakPolarHBondContact CB-O 3.21Å; T94-H124 HydrophobicContact CG2-CB 4.4Å; T94-H124 WeakPolarHBondContact OG1-CB 3.26Å; T94-H124 PolarHBondContact OG1-ND1 3.39Å; P120-H124 WeakPolarHBondContact O-CA 3.45Å; P120-H124 WeakPolarHBondContact O-CB 3.41Å; P120-H124 PolarHBondContact O-N 2.91Å; H124-S127 PolarHBondContact O-OG 3.41Å
125	L	94.5	Very high	91.3	Very high	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	I	π-helix	trans	-92.3	-63.2	-173.1	-53.9	178.2	0	0	0	111.6	A91 T94 L95 I98 P120 Y121 S127 A128 I129 L134 M138	A91-L125 HydrophobicContact CB-CD2 4.33Å; A91-L125 WeakPolarHBondContact O-CD2 3.37Å; T94-L125 HydrophobicContact CG2-CD1 4.07Å; T94-L125 HydrophobicContact CG2-CD2 3.82Å; T94-L125 HydrophobicContact CG2-CG 3.91Å; L95-L125 HydrophobicContact CD1-CD2 4.32Å; L95-L125 HydrophobicContact CD2-CD2 4.17Å; L95-L125 HydrophobicContact CG-CD2 3.74Å; I98-L125 HydrophobicContact CD1-CD1 4.17Å; P120-L125 PolarHBondContact O-N 3.08Å; Y121-L125 HydrophobicContact CD2-CD1 3.8Å; Y121-L125 HydrophobicContact CE2-CD1 4.26Å; Y121-L125 HydrophobicContact CG-CD1 4.34Å; Y121-L125 WeakPolarHBondContact O-CA 3.39Å; Y121-L125 VanDerWaalsContact O-CB 3.29Å; Y121-L125 WeakPolarHBondContact O-CB 3.29Å; Y121-L125 PolarHBondContact O-N 3.49Å; Y121-L125 VanDerWaalsContact O-N 3.08Å; L125-S127 PolarHBondContact O-N 3.35Å; L125-A128 PolarHBondContact O-N 3.24Å; L125-A128 VanDerWaalsContact O-N 3.09Å; L125-I129 PolarHBondContact O-N 2.98Å; L125-L134 HydrophobicContact CB-CD1 4.09Å; L125-L134 HydrophobicContact CB-CD2 3.73Å; L125-L134 HydrophobicContact CD1-CD1 4.26Å; L125-M138 HydrophobicContact CD1-CE 3.89Å
126	Q	92.4	Very high	91.4	Very high	90 Å²	90	46 Å²	46	42%	0.421	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-19.7	-177.1	-165.1	179.8	9.3	0	0	113.1	Q80 Y121	Q80-Q126 PolarHBondContact NE2-O 3.01Å; Y121-Q126 HydrophobicContact CD1-CB 4.38Å; Y121-Q126 HydrophobicContact CE1-CB 4.12Å; Y121-Q126 PolarHBondContact O-N 3.07Å
127	S	92.1	Very high	91.6	Very high	41 Å²	41	45.3 Å²	45.3	29%	0.287	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-21.9	173.7	63	0	0	0	0	113.7	Q80 V122 Y123 H124 L125	Q80-S127 WeakPolarHBondContact CG-O 3.47Å; Q80-S127 PolarHBondContact NE2-O 3.16Å; V122-S127 PolarHBondContact O-N 2.91Å; Y123-S127 WeakPolarHBondContact O-CB 3.45Å; Y123-S127 PolarHBondContact O-OG 3.21Å; H124-S127 PolarHBondContact O-OG 3.41Å; L125-S127 PolarHBondContact O-N 3.35Å
128	A	94.8	Very high	91.8	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.9	-29.5	-169.5	0	0	0	0	0	115	S76 A91 L125	S76-A128 VanDerWaalsContact CB-O 3.23Å; S76-A128 WeakPolarHBondContact CB-O 3.11Å; S76-A128 PolarHBondContact OG-O 2.91Å; A91-A128 HydrophobicContact CB-CB 3.96Å; L125-A128 PolarHBondContact O-N 3.24Å; L125-A128 VanDerWaalsContact O-N 3.09Å
129	I	93.6	Very high	91.9	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	24%	0.243	C	C	.	.	S	Bend	trans	-118.8	141.9	-176.4	-61.2	174.5	0	0	0	109.2	M72 L88 A91 F92 L95 L125 E133 L134 L137	M72-I129 HydrophobicContact CG-CG2 4.32Å; M72-I129 HydrophobicContact SD-CD1 4.12Å; M72-I129 HydrophobicContact SD-CG1 4.42Å; M72-I129 HydrophobicContact SD-CG2 4.03Å; L88-I129 HydrophobicContact CD2-CG1 4.11Å; A91-I129 HydrophobicContact CB-CD1 3.73Å; A91-I129 HydrophobicContact CB-CG1 4.09Å; F92-I129 HydrophobicContact CE1-CD1 4.41Å; L95-I129 HydrophobicContact CD1-CD1 3.7Å; L125-I129 PolarHBondContact O-N 2.98Å; I129-E133 HydrophobicContact CG2-CB 3.73Å; I129-L134 HydrophobicContact CG2-CB 4.2Å; I129-L137 HydrophobicContact CD1-CD1 4.33Å
130	S	91.1	Very high	91.9	Very high	45 Å²	45	47 Å²	47	32%	0.315	24%	0.238	S	C	.	.			trans	-68.3	147.3	179.9	79.1	0	0	0	0	112	A132 E133 L134	S130-A132 PolarHBondContact O-N 2.77Å; S130-A132 VanDerWaalsContact O-N 3.09Å; S130-E133 VanDerWaalsContact CB-OE2 3.24Å; S130-E133 WeakPolarHBondContact CB-OE2 3.17Å; S130-E133 PolarHBondContact N-OE2 2.77Å; S130-E133 PolarHBondContact O-N 2.67Å; S130-E133 VanDerWaalsContact OG-CD 3.23Å; S130-E133 WeakPolarHBondContact OG-CG 3.5Å; S130-E133 PolarHBondContact OG-N 2.84Å; S130-E133 PolarHBondContact OG-OE2 3.05Å; S130-L134 WeakPolarHBondContact O-CB 3.21Å; S130-L134 PolarHBondContact O-N 3Å
131	D	90.3	Very high	92.1	Very high	67 Å²	67	46.4 Å²	46.4	36%	0.358	23%	0.234	S	C	.	.	H	α-helix	trans	-61.2	-22.2	-176.4	-172.3	41.5	0	0	0	113.5	R135	D131-R135 WeakPolarHBondContact O-CB 3.15Å; D131-R135 VanDerWaalsContact O-CZ 3.29Å; D131-R135 PolarHBondContact O-N 2.79Å; D131-R135 PolarHBondContact O-NH2 2.88Å; D131-R135 IonicContact OD1-CZ 2.71Å; D131-R135 IonicContact OD1-NH1 3.17Å; D131-R135 PolarHBondContact OD1-NH1 2.84Å; D131-R135 IonicContact OD1-NH2 2.73Å; D131-R135 IonicContact OD2-CZ 3.58Å; D131-R135 IonicContact OD2-NH1 3.74Å; D131-R135 PolarHBondContact OD2-NH1 3.45Å; D131-R135 IonicContact OD2-NH2 3.13Å; D131-R135 PolarHBondContact OD2-NH2 3.47Å
132	A	90.1	Very high	92	Very high	61 Å²	61	47 Å²	47	50%	0.504	24%	0.241	S	C	.	.	H	α-helix	trans	-79.7	-41.3	173	0	0	0	0	0	113	S130 T136	S130-A132 PolarHBondContact O-N 2.77Å; S130-A132 VanDerWaalsContact O-N 3.09Å; A132-T136 PolarHBondContact O-N 2.86Å; A132-T136 VanDerWaalsContact O-N 3.16Å; A132-T136 PolarHBondContact O-OG1 3.05Å
133	E	91.4	Very high	92	Very high	27 Å²	27	44.7 Å²	44.7	13%	0.126	23%	0.227	C	C	.	.	H	α-helix	trans	-68.5	-41.1	174.8	-71.4	163.4	138.7	0	0	110.8	M72 N75 I129 S130 T136 L137	M72-E133 WeakPolarHBondContact CA-OE1 3.44Å; M72-E133 HydrophobicContact CE-CB 4.14Å; N75-E133 PolarHBondContact ND2-OE1 3Å; I129-E133 HydrophobicContact CG2-CB 3.73Å; S130-E133 VanDerWaalsContact CB-OE2 3.24Å; S130-E133 WeakPolarHBondContact CB-OE2 3.17Å; S130-E133 PolarHBondContact N-OE2 2.77Å; S130-E133 PolarHBondContact O-N 2.67Å; S130-E133 VanDerWaalsContact OG-CD 3.23Å; S130-E133 WeakPolarHBondContact OG-CG 3.5Å; S130-E133 PolarHBondContact OG-N 2.84Å; S130-E133 PolarHBondContact OG-OE2 3.05Å; E133-T136 CarbonylContact O-C 3.48Å; E133-T136 WeakPolarHBondContact O-CA 3.4Å; E133-T136 WeakPolarHBondContact O-CB 3.16Å; E133-T136 PolarHBondContact O-N 3.3Å; E133-L137 PolarHBondContact O-N 2.77Å
134	L	92.4	Very high	91.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.1	-46.1	177.8	-171.5	54.1	0	0	0	111.6	L95 Y121 L125 I129 S130 T136 L137 M138	L95-L134 HydrophobicContact CD2-CD1 4.01Å; Y121-L134 HydrophobicContact CE1-CD2 4.14Å; Y121-L134 HydrophobicContact CE2-CD2 4.01Å; Y121-L134 VanDerWaalsContact OH-CD2 3.26Å; Y121-L134 WeakPolarHBondContact OH-CD2 3.45Å; L125-L134 HydrophobicContact CB-CD1 4.09Å; L125-L134 HydrophobicContact CB-CD2 3.73Å; L125-L134 HydrophobicContact CD1-CD1 4.26Å; I129-L134 HydrophobicContact CG2-CB 4.2Å; S130-L134 WeakPolarHBondContact O-CB 3.21Å; S130-L134 PolarHBondContact O-N 3Å; L134-T136 PolarHBondContact O-N 3.33Å; L134-L137 PolarHBondContact O-N 3.18Å; L134-M138 HydrophobicContact CD1-CE 3.77Å; L134-M138 HydrophobicContact CG-CE 4.48Å; L134-M138 WeakPolarHBondContact O-CB 3.37Å; L134-M138 WeakPolarHBondContact O-CG 3.09Å; L134-M138 PolarHBondContact O-N 3.24Å
135	R	91.4	Very high	91.5	Very high	88 Å²	88	40.1 Å²	40.1	33%	0.332	22%	0.222	S	C	.	.	H	α-helix	trans	-58.7	-31	169.7	-90.1	-171	-71.7	-79.7	-2.3	113.3	D131 R139 C145 F151	D131-R135 WeakPolarHBondContact O-CB 3.15Å; D131-R135 VanDerWaalsContact O-CZ 3.29Å; D131-R135 PolarHBondContact O-N 2.79Å; D131-R135 PolarHBondContact O-NH2 2.88Å; D131-R135 IonicContact OD1-CZ 2.71Å; D131-R135 IonicContact OD1-NH1 3.17Å; D131-R135 PolarHBondContact OD1-NH1 2.84Å; D131-R135 IonicContact OD1-NH2 2.73Å; D131-R135 IonicContact OD2-CZ 3.58Å; D131-R135 IonicContact OD2-NH1 3.74Å; D131-R135 PolarHBondContact OD2-NH1 3.45Å; D131-R135 IonicContact OD2-NH2 3.13Å; D131-R135 PolarHBondContact OD2-NH2 3.47Å; R135-R139 WeakPolarHBondContact O-CB 3.45Å; R135-R139 PolarHBondContact O-N 3.11Å; R135-C145 HydrophobicContact CG-CB 4.17Å; R135-F151 HydrophobicContact CB-CZ 4.48Å; R135-F151 HydrophobicContact CG-CE1 3.94Å; R135-F151 HydrophobicContact CG-CZ 3.64Å
136	T	91.5	Very high	90.8	Very high	72 Å²	72	42.4 Å²	42.4	44%	0.442	23%	0.234	S	C	.	.	H	α-helix	trans	-75.5	-45.3	179.1	-58.9	0	0	0	0	111.3	A132 E133 L134 R139 T140	A132-T136 PolarHBondContact O-N 2.86Å; A132-T136 VanDerWaalsContact O-N 3.16Å; A132-T136 PolarHBondContact O-OG1 3.05Å; E133-T136 CarbonylContact O-C 3.48Å; E133-T136 WeakPolarHBondContact O-CA 3.4Å; E133-T136 WeakPolarHBondContact O-CB 3.16Å; E133-T136 PolarHBondContact O-N 3.3Å; L134-T136 PolarHBondContact O-N 3.33Å; T136-R139 WeakPolarHBondContact O-CB 3.2Å; T136-R139 PolarHBondContact O-N 3.44Å; T136-T140 PolarHBondContact O-N 2.87Å; T136-T140 PolarHBondContact O-OG1 2.95Å; T136-T140 VanDerWaalsContact O-OG1 3.09Å
137	L	93	Very high	89.7	Confident	10 Å²	10	46.9 Å²	46.9	5%	0.052	26%	0.255	C	S	.	.	H	α-helix	trans	-58.9	-48.2	172.9	-72.9	169.1	0	0	0	112	M72 L95 I129 E133 L134 R139 T140 I141	M72-L137 HydrophobicContact CE-CD1 3.74Å; M72-L137 HydrophobicContact CE-CD2 4.08Å; M72-L137 HydrophobicContact CE-CG 3.93Å; M72-L137 HydrophobicContact SD-CD1 3.74Å; L95-L137 HydrophobicContact CD1-CD1 3.65Å; L95-L137 HydrophobicContact CD2-CD1 4.46Å; I129-L137 HydrophobicContact CD1-CD1 4.33Å; E133-L137 PolarHBondContact O-N 2.77Å; L134-L137 PolarHBondContact O-N 3.18Å; L137-R139 PolarHBondContact O-N 2.9Å; L137-T140 WeakPolarHBondContact O-CA 3.5Å; L137-T140 WeakPolarHBondContact O-CB 3.34Å; L137-T140 PolarHBondContact O-N 2.84Å; L137-I141 WeakPolarHBondContact O-CG1 3.44Å; L137-I141 PolarHBondContact O-N 3.04Å
138	M	92.6	Very high	88.7	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.1	-38	177.6	-68.2	-65.8	173.1	0	0	111.8	L95 I98 I114 Y121 L125 L134 I141 G142 Y143 F151	L95-M138 HydrophobicContact CD2-CE 3.81Å; I98-M138 HydrophobicContact CD1-CE 3.89Å; I114-M138 HydrophobicContact CD1-SD 4.43Å; Y121-M138 HydrophobicContact CE2-CE 4.33Å; L125-M138 HydrophobicContact CD1-CE 3.89Å; L134-M138 HydrophobicContact CD1-CE 3.77Å; L134-M138 HydrophobicContact CG-CE 4.48Å; L134-M138 WeakPolarHBondContact O-CB 3.37Å; L134-M138 WeakPolarHBondContact O-CG 3.09Å; L134-M138 PolarHBondContact O-N 3.24Å; M138-I141 PolarHBondContact O-N 3.09Å; M138-I141 HydrophobicContact SD-CD1 4.3Å; M138-G142 PolarHBondContact O-N 3.43Å; M138-G142 VanDerWaalsContact O-N 3.08Å; M138-Y143 CarbonylContact C-O 3.27Å; M138-Y143 PolarHBondContact O-N 3.37Å; M138-Y143 HydrophobicContact SD-CD2 4.29Å; M138-F151 HydrophobicContact CB-CD1 3.51Å; M138-F151 HydrophobicContact CB-CE1 3.36Å; M138-F151 HydrophobicContact CB-CG 4.27Å; M138-F151 HydrophobicContact CB-CZ 4.04Å; M138-F151 HydrophobicContact CG-CD1 3.85Å; M138-F151 HydrophobicContact CG-CD2 4.33Å; M138-F151 HydrophobicContact CG-CE1 3.65Å; M138-F151 HydrophobicContact CG-CE2 4.17Å; M138-F151 HydrophobicContact CG-CG 4.17Å; M138-F151 HydrophobicContact CG-CZ 3.81Å
139	R	90.8	Very high	88	Confident	151 Å²	151	52.9 Å²	52.9	57%	0.57	29%	0.289	S	S	*	.	H	α-helix	trans	-64.9	-41.2	172.6	-164.7	-171	-61.2	104.8	-4	112.5	R135 T136 L137 I141 G142 Y143	R135-R139 WeakPolarHBondContact O-CB 3.45Å; R135-R139 PolarHBondContact O-N 3.11Å; T136-R139 WeakPolarHBondContact O-CB 3.2Å; T136-R139 PolarHBondContact O-N 3.44Å; L137-R139 PolarHBondContact O-N 2.9Å; R139-I141 VanDerWaalsContact C-N 3.26Å; R139-I141 PolarHBondContact O-N 3.16Å; R139-G142 PolarHBondContact O-N 2.71Å; R139-G142 VanDerWaalsContact O-N 3.09Å; R139-Y143 WeakPolarHBondContact CA-O 3.16Å; R139-Y143 PolarHBondContact N-O 3.45Å
140	T	90.9	Very high	87.7	Confident	46 Å²	46	54.3 Å²	54.3	28%	0.282	30%	0.295	S	S	.	.	H	α-helix	trans	-64.7	-29	175.2	-50	0	0	0	0	112.5	T136 L137 H162 L166	T136-T140 PolarHBondContact O-N 2.87Å; T136-T140 PolarHBondContact O-OG1 2.95Å; T136-T140 VanDerWaalsContact O-OG1 3.09Å; L137-T140 WeakPolarHBondContact O-CA 3.5Å; L137-T140 WeakPolarHBondContact O-CB 3.34Å; L137-T140 PolarHBondContact O-N 2.84Å; T140-H162 PolarHBondContact O-NE2 3.24Å; T140-L166 HydrophobicContact CG2-CD1 4.17Å; T140-L166 HydrophobicContact CG2-CD2 3.99Å
141	I	91.9	Very high	87.6	Confident	8 Å²	8	52.3 Å²	52.3	4%	0.041	28%	0.281	C	S	.	.	H	α-helix	trans	-74.6	-29.2	172.5	-60.5	166.8	0	0	0	111.7	L95 I98 L102 L137 M138 R139 Y143 L163 L166	L95-I141 HydrophobicContact CD2-CD1 4.4Å; I98-I141 HydrophobicContact CG2-CD1 4.26Å; I98-I141 HydrophobicContact CG2-CG2 4.42Å; L102-I141 HydrophobicContact CD2-CG2 3.94Å; L137-I141 WeakPolarHBondContact O-CG1 3.44Å; L137-I141 PolarHBondContact O-N 3.04Å; M138-I141 PolarHBondContact O-N 3.09Å; M138-I141 HydrophobicContact SD-CD1 4.3Å; R139-I141 VanDerWaalsContact C-N 3.26Å; R139-I141 PolarHBondContact O-N 3.16Å; I141-Y143 HydrophobicContact CB-CD2 4.06Å; I141-Y143 HydrophobicContact CB-CE2 4.27Å; I141-Y143 HydrophobicContact CG2-CD2 3.8Å; I141-Y143 HydrophobicContact CG2-CE2 3.52Å; I141-L163 HydrophobicContact CG2-CD1 3.87Å; I141-L166 HydrophobicContact CB-CD2 4.29Å; I141-L166 HydrophobicContact CG1-CD2 3.56Å
142	G	90.4	Very high	87.6	Confident	15 Å²	15	53.2 Å²	53.2	16%	0.155	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	121.1	6.8	178.9	0	0	0	0	0	115.2	M138 R139 L154	M138-G142 PolarHBondContact O-N 3.43Å; M138-G142 VanDerWaalsContact O-N 3.08Å; R139-G142 PolarHBondContact O-N 2.71Å; R139-G142 VanDerWaalsContact O-N 3.09Å; G142-L154 PolarHBondContact O-N 2.98Å
143	Y	91.6	Very high	87.6	Confident	2 Å²	2	51.1 Å²	51.1	1%	0.008	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	138.2	177.4	-59.4	-88.9	0	0	0	112.8	I98 L102 F111 I114 M138 R139 I141 F151 R152 L153	I98-Y143 HydrophobicContact CG2-CE2 3.73Å; L102-Y143 HydrophobicContact CD2-CE2 4.28Å; F111-Y143 PolarHBondContact O-OH 2.67Å; I114-Y143 HydrophobicContact CD1-CD2 4.49Å; I114-Y143 HydrophobicContact CD1-CE1 4.02Å; I114-Y143 HydrophobicContact CD1-CE2 3.85Å; I114-Y143 HydrophobicContact CG1-CE1 4.09Å; M138-Y143 CarbonylContact C-O 3.27Å; M138-Y143 PolarHBondContact O-N 3.37Å; M138-Y143 HydrophobicContact SD-CD2 4.29Å; R139-Y143 WeakPolarHBondContact CA-O 3.16Å; R139-Y143 PolarHBondContact N-O 3.45Å; I141-Y143 HydrophobicContact CB-CD2 4.06Å; I141-Y143 HydrophobicContact CB-CE2 4.27Å; I141-Y143 HydrophobicContact CG2-CD2 3.8Å; I141-Y143 HydrophobicContact CG2-CE2 3.52Å; Y143-F151 HydrophobicContact CD1-CB 4.2Å; Y143-F151 HydrophobicContact CG-CB 4.21Å; Y143-R152 CarbonylContact C-O 3.2Å; Y143-R152 VanDerWaalsContact CA-O 3.26Å; Y143-R152 WeakPolarHBondContact CA-O 3.41Å; Y143-L153 HydrophobicContact CD1-CB 4.04Å; Y143-L153 HydrophobicContact CD1-CD1 4.26Å; Y143-L153 HydrophobicContact CE1-CB 3.99Å; Y143-L153 HydrophobicContact CE1-CD1 4.12Å; Y143-L153 HydrophobicContact CG-CD1 4.48Å
144	T	89.6	Confident	87.3	Confident	62 Å²	62	54.1 Å²	54.1	38%	0.38	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	142.3	163.6	49.1	0	0	0	0	110.5	F151 R152 L154	T144-F151 CarbonylContact O-C 3.36Å; T144-F151 VanDerWaalsContact O-CA 3.31Å; T144-F151 WeakPolarHBondContact O-CA 3.4Å; T144-R152 PolarHBondContact N-O 2.95Å; T144-R152 PolarHBondContact O-N 3.42Å; T144-R152 PolarHBondContact OG1-O 2.89Å; T144-L154 HydrophobicContact CG2-CD1 4.07Å; T144-L154 HydrophobicContact CG2-CD2 3.92Å; T144-L154 HydrophobicContact CG2-CG 3.99Å
145	C	86.1	Confident	86	Confident	57 Å²	57	61 Å²	61	39%	0.385	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	120.1	172.1	-167.3	0	0	0	0	109.2	R135 F151	R135-C145 HydrophobicContact CG-CB 4.17Å; C145-F151 HydrophobicContact CB-CD1 4.02Å; C145-F151 HydrophobicContact CB-CE1 3.63Å; C145-F151 HydrophobicContact CB-CZ 4.11Å
146	D	79.8	Confident	84.4	Confident	48 Å²	48	64.8 Å²	64.8	26%	0.257	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	163	173.4	-161.8	-5	0	0	0	110.8	D148 S149 Q150 R152	D146-D148 PolarHBondContact O-N 3.19Å; D146-S149 PolarHBondContact O-N 3.4Å; D146-Q150 WeakPolarHBondContact CB-O 3.15Å; D146-Q150 PolarHBondContact N-O 2.98Å; D146-R152 IonicContact OD2-CZ 3.55Å; D146-R152 IonicContact OD2-NE 2.78Å; D146-R152 PolarHBondContact OD2-NE 2.88Å; D146-R152 IonicContact OD2-NH2 3.45Å; D146-R152 PolarHBondContact OD2-NH2 2.87Å
147	H	69	Low	82.8	Confident	184 Å²	184	64.2 Å²	64.2	85%	0.852	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.6	176.6	-54.1	-69.1	0	0	0	112	S149	H147-S149 PolarHBondContact O-N 3.4Å
148	D	70.7	Confident	81.2	Confident	103 Å²	103	65.6 Å²	65.6	55%	0.551	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	17.9	179.8	-69.6	-17.8	0	0	0	114.8	D146 Q150 R152	D146-D148 PolarHBondContact O-N 3.19Å; D148-Q150 VanDerWaalsContact C-N 3.34Å; D148-Q150 PolarHBondContact O-N 2.82Å; D148-Q150 PolarHBondContact O-NE2 2.69Å; D148-R152 IonicContact OD2-NH2 3.81Å
149	S	79.6	Confident	80.4	Confident	64 Å²	64	70.6 Å²	70.6	45%	0.448	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	48.7	-176.7	-52.8	0	0	0	0	112.4	T116 D146 H147	T116-S149 WeakPolarHBondContact CG2-O 3.45Å; T116-S149 PolarHBondContact N-O 2.84Å; T116-S149 WeakPolarHBondContact OG1-CB 3.44Å; T116-S149 PolarHBondContact OG1-O 3.35Å; D146-S149 PolarHBondContact O-N 3.4Å; H147-S149 PolarHBondContact O-N 3.4Å
150	Q	87.4	Confident	80.2	Confident	31 Å²	31	66.2 Å²	66.2	15%	0.145	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	142.6	-179.8	-77.3	164.8	65.1	0	0	109.6	I114 K115 D146 D148	I114-Q150 WeakPolarHBondContact O-CA 3.32Å; K115-Q150 HydrophobicContact CG-CG 4.01Å; D146-Q150 WeakPolarHBondContact CB-O 3.15Å; D146-Q150 PolarHBondContact N-O 2.98Å; D148-Q150 VanDerWaalsContact C-N 3.34Å; D148-Q150 PolarHBondContact O-N 2.82Å; D148-Q150 PolarHBondContact O-NE2 2.69Å
151	F	90.1	Very high	80.2	Confident	2 Å²	2	67 Å²	67	1%	0.009	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	112.1	172.8	-78.3	-81.6	0	0	0	109.6	C113 I114 T116 Y121 R135 M138 Y143 T144 C145	C113-F151 CarbonylContact C-O 3.53Å; C113-F151 VanDerWaalsContact CA-O 3.31Å; C113-F151 WeakPolarHBondContact CA-O 3.44Å; I114-F151 HydrophobicContact CB-CB 4.23Å; I114-F151 PolarHBondContact N-O 2.96Å; I114-F151 PolarHBondContact O-N 2.67Å; T116-F151 HydrophobicContact CG2-CD2 3.69Å; T116-F151 HydrophobicContact CG2-CE2 3.61Å; Y121-F151 HydrophobicContact CE2-CD2 4.24Å; Y121-F151 AromaticContact CE2-CE2 3.94Å; Y121-F151 HydrophobicContact CE2-CE2 3.94Å; Y121-F151 WeakPolarHBondContact OH-CE2 3.49Å; R135-F151 HydrophobicContact CB-CZ 4.48Å; R135-F151 HydrophobicContact CG-CE1 3.94Å; R135-F151 HydrophobicContact CG-CZ 3.64Å; M138-F151 HydrophobicContact CB-CD1 3.51Å; M138-F151 HydrophobicContact CB-CE1 3.36Å; M138-F151 HydrophobicContact CB-CG 4.27Å; M138-F151 HydrophobicContact CB-CZ 4.04Å; M138-F151 HydrophobicContact CG-CD1 3.85Å; M138-F151 HydrophobicContact CG-CD2 4.33Å; M138-F151 HydrophobicContact CG-CE1 3.65Å; M138-F151 HydrophobicContact CG-CE2 4.17Å; M138-F151 HydrophobicContact CG-CG 4.17Å; M138-F151 HydrophobicContact CG-CZ 3.81Å; Y143-F151 HydrophobicContact CD1-CB 4.2Å; Y143-F151 HydrophobicContact CG-CB 4.21Å; T144-F151 CarbonylContact O-C 3.36Å; T144-F151 VanDerWaalsContact O-CA 3.31Å; T144-F151 WeakPolarHBondContact O-CA 3.4Å; C145-F151 HydrophobicContact CB-CD1 4.02Å; C145-F151 HydrophobicContact CB-CE1 3.63Å; C145-F151 HydrophobicContact CB-CZ 4.11Å
152	R	90.2	Very high	80.1	Confident	86 Å²	86	70.2 Å²	70.2	33%	0.325	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	135.5	178.3	-55.6	-166.7	-160.7	-71.3	-1.5	110.1	R112 C113 Y143 T144 D146 D148	R112-R152 WeakPolarHBondContact O-CA 3.42Å; C113-R152 PolarHBondContact SG-NH1 3.35Å; Y143-R152 CarbonylContact C-O 3.2Å; Y143-R152 VanDerWaalsContact CA-O 3.26Å; Y143-R152 WeakPolarHBondContact CA-O 3.41Å; T144-R152 PolarHBondContact N-O 2.95Å; T144-R152 PolarHBondContact O-N 3.42Å; T144-R152 PolarHBondContact OG1-O 2.89Å; D146-R152 IonicContact OD2-CZ 3.55Å; D146-R152 IonicContact OD2-NE 2.78Å; D146-R152 PolarHBondContact OD2-NE 2.88Å; D146-R152 IonicContact OD2-NH2 3.45Å; D146-R152 PolarHBondContact OD2-NH2 2.87Å; D148-R152 IonicContact OD2-NH2 3.81Å
153	L	89.8	Confident	80.2	Confident	17 Å²	17	70.1 Å²	70.1	9%	0.089	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	136.6	176.5	-170.4	77.4	0	0	0	109.8	L102 R112 Y143	L102-L153 HydrophobicContact CD1-CD1 4.06Å; L102-L153 HydrophobicContact CD1-CD2 3.64Å; L102-L153 HydrophobicContact CD1-CG 4.49Å; L102-L153 HydrophobicContact CD2-CD1 3.62Å; R112-L153 HydrophobicContact CB-CB 4.24Å; R112-L153 HydrophobicContact CG-CB 4.35Å; R112-L153 HydrophobicContact CG-CD2 4Å; R112-L153 PolarHBondContact O-N 2.94Å; Y143-L153 HydrophobicContact CD1-CB 4.04Å; Y143-L153 HydrophobicContact CD1-CD1 4.26Å; Y143-L153 HydrophobicContact CE1-CB 3.99Å; Y143-L153 HydrophobicContact CE1-CD1 4.12Å; Y143-L153 HydrophobicContact CG-CD1 4.48Å
154	L	83.9	Confident	80.4	Confident	91 Å²	91	73.5 Å²	73.5	48%	0.476	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-65.4	136.5	168.7	-72	162.3	0	0	0	110.3	G142 T144 H156	G142-L154 PolarHBondContact O-N 2.98Å; T144-L154 HydrophobicContact CG2-CD1 4.07Å; T144-L154 HydrophobicContact CG2-CD2 3.92Å; T144-L154 HydrophobicContact CG2-CG 3.99Å; L154-H156 CarbonylContact O-C 3.51Å; L154-H156 PolarHBondContact O-N 2.87Å
155	D	64.9	Low	80.6	Confident	144 Å²	144	73.1 Å²	73.1	77%	0.77	39%	0.392	S	S	*	.	S	Bend	trans	-64.3	-14.6	-173	-89.1	-43.2	0	0	0	115	R112 P157	R112-D155 IonicContact NH1-OD1 2.82Å; D155-P157 WeakPolarHBondContact O-CD 3.46Å
156	H	57.8	Low	81	Confident	167 Å²	167	70.5 Å²	70.5	77%	0.773	37%	0.374	S	S	*	.	S	Bend	trans	-94.3	93.6	161.3	-158.8	77.3	0	0	0	108.7	L154 G158	L154-H156 CarbonylContact O-C 3.51Å; L154-H156 PolarHBondContact O-N 2.87Å; H156-G158 PolarHBondContact O-N 3.43Å
157	P	58.4	Low	81.8	Confident	60 Å²	60	68.2 Å²	68.2	39%	0.39	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-58.4	129.8	171	25.9	-33.7	0	0	0	108.2	D155	D155-P157 WeakPolarHBondContact O-CD 3.46Å
158	G	59.4	Low	83	Confident	40 Å²	40	59.4 Å²	59.4	41%	0.412	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-59.5	164.8	178.7	0	0	0	0	0	112	H156 S160	H156-G158 PolarHBondContact O-N 3.43Å; G158-S160 PolarHBondContact O-N 2.93Å; G158-S160 VanDerWaalsContact O-N 3.15Å
159	D	75.4	Confident	84.2	Confident	105 Å²	105	54.6 Å²	54.6	56%	0.561	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-48.1	125.1	-179.1	177.7	10	0	0	0	111.2	S161 H162 L163	D159-S161 PolarHBondContact O-N 2.93Å; D159-S161 VanDerWaalsContact O-N 3.07Å; D159-S161 WeakPolarHBondContact OD1-CB 3.31Å; D159-S161 PolarHBondContact OD1-N 2.82Å; D159-S161 WeakPolarHBondContact OD2-CB 3.44Å; D159-H162 HydrophobicContact CB-CB 4.28Å; D159-H162 WeakPolarHBondContact O-CA 3.42Å; D159-H162 WeakPolarHBondContact O-CB 3.12Å; D159-H162 PolarHBondContact O-N 2.9Å; D159-L163 PolarHBondContact O-N 3.5Å
160	S	86.5	Confident	85.1	Confident	58 Å²	58	51.6 Å²	51.6	41%	0.406	28%	0.275	S	S	.	.	H	α-helix	trans	-56.3	-23.9	176.1	72.3	0	0	0	0	112.6	G158 R164	G158-S160 PolarHBondContact O-N 2.93Å; G158-S160 VanDerWaalsContact O-N 3.15Å; S160-R164 WeakPolarHBondContact O-CB 3.27Å; S160-R164 VanDerWaalsContact O-CG 3.27Å; S160-R164 WeakPolarHBondContact O-CG 3.35Å; S160-R164 PolarHBondContact O-N 3.21Å; S160-R164 PolarHBondContact O-NH1 3.37Å; S160-R164 PolarHBondContact OG-NH1 2.95Å
161	S	90.9	Very high	85.5	Confident	63 Å²	63	50.3 Å²	50.3	44%	0.441	27%	0.268	S	S	.	.	H	α-helix	trans	-67.5	-50.8	171	-161.7	0	0	0	0	111.6	D159 L163 R164 Q165	D159-S161 PolarHBondContact O-N 2.93Å; D159-S161 VanDerWaalsContact O-N 3.07Å; D159-S161 WeakPolarHBondContact OD1-CB 3.31Å; D159-S161 PolarHBondContact OD1-N 2.82Å; D159-S161 WeakPolarHBondContact OD2-CB 3.44Å; S161-L163 VanDerWaalsContact C-N 3.32Å; S161-L163 PolarHBondContact O-N 3.44Å; S161-R164 PolarHBondContact O-N 3.5Å; S161-Q165 WeakPolarHBondContact O-CB 3.43Å; S161-Q165 PolarHBondContact O-N 3.23Å
162	H	91.4	Very high	85.8	Confident	75 Å²	75	50.3 Å²	50.3	35%	0.347	27%	0.268	S	S	.	.	H	α-helix	trans	-55.2	-45.7	173.6	166.9	98.8	0	0	0	111.4	M66 T140 D159 Q165 L166	M66-H162 WeakPolarHBondContact CE-CE1 3.1Å; M66-H162 WeakPolarHBondContact CE-ND1 3.36Å; T140-H162 PolarHBondContact O-NE2 3.24Å; D159-H162 HydrophobicContact CB-CB 4.28Å; D159-H162 WeakPolarHBondContact O-CA 3.42Å; D159-H162 WeakPolarHBondContact O-CB 3.12Å; D159-H162 PolarHBondContact O-N 2.9Å; H162-Q165 PolarHBondContact O-N 3.1Å; H162-L166 WeakPolarHBondContact O-CB 3.39Å; H162-L166 PolarHBondContact O-N 2.64Å
163	L	92.4	Very high	86.1	Confident	13 Å²	13	46.2 Å²	46.2	7%	0.068	25%	0.253	C	S	.	.	H	α-helix	trans	-70.2	-36.4	-179.1	-174.1	60.7	0	0	0	113	C99 L102 L103 I141 D159 S161 L166 A167	C99-L163 HydrophobicContact CB-CD1 3.79Å; C99-L163 HydrophobicContact CB-CG 4.44Å; L102-L163 HydrophobicContact CB-CD2 4.11Å; L102-L163 HydrophobicContact CD2-CD2 3.66Å; L102-L163 HydrophobicContact CG-CD2 3.69Å; L103-L163 HydrophobicContact CD1-CG 4.19Å; L103-L163 HydrophobicContact CD2-CB 3.94Å; L103-L163 HydrophobicContact CD2-CD2 3.87Å; L103-L163 HydrophobicContact CD2-CG 3.9Å; L103-L163 HydrophobicContact CG-CB 4.33Å; L103-L163 HydrophobicContact CG-CD2 3.71Å; L103-L163 HydrophobicContact CG-CG 3.74Å; I141-L163 HydrophobicContact CG2-CD1 3.87Å; D159-L163 PolarHBondContact O-N 3.5Å; S161-L163 VanDerWaalsContact C-N 3.32Å; S161-L163 PolarHBondContact O-N 3.44Å; L163-L166 HydrophobicContact CD1-CD2 4.5Å; L163-A167 WeakPolarHBondContact O-CB 3.46Å; L163-A167 PolarHBondContact O-N 3.17Å
164	R	94.3	Very high	86.4	Confident	73 Å²	73	45.5 Å²	45.5	28%	0.275	25%	0.249	S	C	.	.	H	α-helix	trans	-62	-43.4	168.8	-77	-179.8	-165.6	87.9	-9.9	111.4	F10 V14 L103 S160 S161 L166 A167 F168	F10-R164 HydrophobicContact CE2-CB 4.2Å; F10-R164 HydrophobicContact CZ-CB 4.06Å; V14-R164 HydrophobicContact CG2-CG 4.46Å; L103-R164 HydrophobicContact CD1-CB 4.45Å; L103-R164 HydrophobicContact CD1-CG 3.87Å; L103-R164 HydrophobicContact CD2-CG 3.91Å; S160-R164 WeakPolarHBondContact O-CB 3.27Å; S160-R164 VanDerWaalsContact O-CG 3.27Å; S160-R164 WeakPolarHBondContact O-CG 3.35Å; S160-R164 PolarHBondContact O-N 3.21Å; S160-R164 PolarHBondContact O-NH1 3.37Å; S160-R164 PolarHBondContact OG-NH1 2.95Å; S161-R164 PolarHBondContact O-N 3.5Å; R164-L166 VanDerWaalsContact C-N 3.34Å; R164-A167 PolarHBondContact O-N 2.93Å; R164-F168 WeakPolarHBondContact O-CB 3.29Å; R164-F168 PolarHBondContact O-N 2.85Å
165	Q	94.3	Very high	87	Confident	55 Å²	55	41.2 Å²	41.2	26%	0.257	23%	0.227	S	C	.	.	H	α-helix	trans	-67.1	-36.1	-178.7	-175	58.2	96.9	0	0	111.8	M66 S161 H162 E169	M66-Q165 HydrophobicContact SD-CB 3.95Å; M66-Q165 HydrophobicContact SD-CG 3.57Å; M66-Q165 VanDerWaalsContact SD-CG 3.57Å; S161-Q165 WeakPolarHBondContact O-CB 3.43Å; S161-Q165 PolarHBondContact O-N 3.23Å; H162-Q165 PolarHBondContact O-N 3.1Å; Q165-E169 WeakPolarHBondContact O-CG 3.43Å; Q165-E169 PolarHBondContact O-N 3.32Å
166	L	95.2	Very high	88.4	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-69	-46.1	174.4	-177.8	61	0	0	0	112.1	M66 V67 T140 I141 H162 L163 R164 F168 E169 L170	M66-L166 HydrophobicContact CB-CD1 4.02Å; M66-L166 HydrophobicContact CE-CB 3.8Å; M66-L166 HydrophobicContact CE-CD1 4.32Å; M66-L166 HydrophobicContact SD-CB 4.11Å; V67-L166 HydrophobicContact CG2-CD1 4.17Å; T140-L166 HydrophobicContact CG2-CD1 4.17Å; T140-L166 HydrophobicContact CG2-CD2 3.99Å; I141-L166 HydrophobicContact CB-CD2 4.29Å; I141-L166 HydrophobicContact CG1-CD2 3.56Å; H162-L166 WeakPolarHBondContact O-CB 3.39Å; H162-L166 PolarHBondContact O-N 2.64Å; L163-L166 HydrophobicContact CD1-CD2 4.5Å; R164-L166 VanDerWaalsContact C-N 3.34Å; L166-F168 VanDerWaalsContact C-N 3.26Å; L166-F168 PolarHBondContact O-N 3.13Å; L166-E169 PolarHBondContact O-N 3.14Å; L166-E169 VanDerWaalsContact O-N 3.09Å; L166-L170 HydrophobicContact CG-CD1 4.2Å; L166-L170 WeakPolarHBondContact O-CG 3.27Å; L166-L170 PolarHBondContact O-N 2.94Å
167	A	95.6	Very high	90.3	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-56	-44.2	173.6	0	0	0	0	0	110.6	Y13 E96 C99 T100 L103 L163 R164 E169 L170 F171	Y13-A167 HydrophobicContact CE1-CB 4.21Å; Y13-A167 WeakPolarHBondContact OH-CB 3.4Å; E96-A167 HydrophobicContact CG-CB 4.45Å; C99-A167 HydrophobicContact CB-CB 3.69Å; T100-A167 HydrophobicContact CG2-CB 4.47Å; L103-A167 HydrophobicContact CD1-CB 4.44Å; L163-A167 WeakPolarHBondContact O-CB 3.46Å; L163-A167 PolarHBondContact O-N 3.17Å; R164-A167 PolarHBondContact O-N 2.93Å; A167-E169 PolarHBondContact O-N 3.37Å; A167-L170 PolarHBondContact O-N 3Å; A167-F171 WeakPolarHBondContact O-CB 3.41Å; A167-F171 PolarHBondContact O-N 3.44Å
168	F	95.8	Very high	92.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.8	-34.9	175.2	-175.8	-115	0	0	0	114	R6 L9 F10 Y13 R164 L166 F171 L172	R6-F168 HydrophobicContact CG-CE1 3.94Å; R6-F168 HydrophobicContact CG-CZ 4.49Å; L9-F168 HydrophobicContact CB-CZ 4.17Å; L9-F168 HydrophobicContact CD2-CE2 4.15Å; L9-F168 HydrophobicContact CD2-CZ 3.9Å; L9-F168 HydrophobicContact CG-CE2 3.9Å; L9-F168 HydrophobicContact CG-CZ 3.89Å; F10-F168 HydrophobicContact CB-CD1 4.28Å; F10-F168 HydrophobicContact CB-CE1 3.95Å; F10-F168 HydrophobicContact CB-CE2 4.32Å; F10-F168 HydrophobicContact CB-CZ 3.96Å; F10-F168 HydrophobicContact CD2-CB 3.76Å; F10-F168 AromaticContact CD2-CD1 3.8Å; F10-F168 HydrophobicContact CD2-CD1 3.8Å; F10-F168 HydrophobicContact CD2-CD2 4.05Å; F10-F168 HydrophobicContact CD2-CE1 4.33Å; F10-F168 AromaticContact CD2-CG 3.6Å; F10-F168 HydrophobicContact CD2-CG 3.6Å; F10-F168 HydrophobicContact CE2-CB 3.97Å; F10-F168 HydrophobicContact CE2-CG 4.31Å; F10-F168 HydrophobicContact CG-CD1 4.4Å; Y13-F168 HydrophobicContact CD1-CB 3.87Å; Y13-F168 AromaticContact CD1-CD2 3.62Å; Y13-F168 HydrophobicContact CD1-CD2 3.62Å; Y13-F168 HydrophobicContact CD1-CG 4.19Å; Y13-F168 HydrophobicContact CD2-CD2 4.23Å; Y13-F168 HydrophobicContact CE1-CB 3.87Å; Y13-F168 HydrophobicContact CE1-CD2 4.28Å; Y13-F168 AromaticContact CG-CD2 3.6Å; Y13-F168 HydrophobicContact CG-CD2 3.6Å; Y13-F168 HydrophobicContact CG-CE2 4.25Å; R164-F168 WeakPolarHBondContact O-CB 3.29Å; R164-F168 PolarHBondContact O-N 2.85Å; L166-F168 VanDerWaalsContact C-N 3.26Å; L166-F168 PolarHBondContact O-N 3.13Å; F168-F171 AromaticContact CD2-CD1 3.87Å; F168-F171 HydrophobicContact CD2-CD1 3.87Å; F168-F171 AromaticContact CE2-CD1 3.97Å; F168-F171 HydrophobicContact CE2-CD1 3.97Å; F168-F171 HydrophobicContact CE2-CE1 4.23Å; F168-F171 WeakPolarHBondContact O-CB 3.36Å; F168-F171 PolarHBondContact O-N 3.46Å; F168-L172 HydrophobicContact CD1-CD1 3.99Å; F168-L172 HydrophobicContact CD1-CG 4.45Å; F168-L172 HydrophobicContact CE1-CD1 3.63Å; F168-L172 HydrophobicContact CE1-CG 4.19Å; F168-L172 HydrophobicContact CE2-CG 4.47Å; F168-L172 HydrophobicContact CZ-CD1 4.06Å; F168-L172 HydrophobicContact CZ-CD2 4.3Å; F168-L172 HydrophobicContact CZ-CG 4.21Å; F168-L172 WeakPolarHBondContact O-CG 3.28Å; F168-L172 PolarHBondContact O-N 2.98Å
169	E	95.5	Very high	93.8	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-72	-31.5	173.6	-67.7	-136.2	151.1	0	0	112.9	R6 F64 R65 M66 V67 Q165 L166 A167 L172 A173	R6-E169 IonicContact CZ-OE1 2.65Å; R6-E169 IonicContact NH1-OE1 3.62Å; R6-E169 IonicContact NH2-OE1 2.89Å; R6-E169 PolarHBondContact NH2-OE1 2.95Å; F64-E169 HydrophobicContact CD1-CB 4.49Å; R65-E169 VanDerWaalsContact N-CD 3.29Å; R65-E169 PolarHBondContact N-OE1 2.99Å; R65-E169 PolarHBondContact N-OE2 3.47Å; M66-E169 WeakPolarHBondContact CA-OE2 3.45Å; M66-E169 PolarHBondContact N-OE2 3.12Å; V67-E169 HydrophobicContact CG2-CB 3.8Å; V67-E169 PolarHBondContact N-OE2 3.22Å; V67-E169 VanDerWaalsContact N-OE2 3.13Å; Q165-E169 WeakPolarHBondContact O-CG 3.43Å; Q165-E169 PolarHBondContact O-N 3.32Å; L166-E169 PolarHBondContact O-N 3.14Å; L166-E169 VanDerWaalsContact O-N 3.09Å; A167-E169 PolarHBondContact O-N 3.37Å; E169-L172 PolarHBondContact O-N 2.73Å; E169-A173 WeakPolarHBondContact O-CB 3.38Å; E169-A173 PolarHBondContact O-N 3.02Å
170	L	97.3	Very high	94.8	Very high	2 Å²	2	20.4 Å²	20.4	1%	0.01	10%	0.103	C	C	.	.	H	α-helix	trans	-71.3	-32.3	172.2	-66.7	163.5	0	0	0	111.9	V67 F92 L95 E96 L166 A167 A173 Q174	V67-L170 HydrophobicContact CG2-CD2 4.1Å; V67-L170 HydrophobicContact CG2-CG 4.32Å; F92-L170 HydrophobicContact CD1-CD2 3.89Å; L95-L170 HydrophobicContact CB-CD1 3.91Å; L95-L170 HydrophobicContact CB-CD2 3.98Å; L95-L170 HydrophobicContact CB-CG 4.49Å; L95-L170 HydrophobicContact CD1-CD2 4.17Å; E96-L170 HydrophobicContact CB-CB 4.07Å; L166-L170 HydrophobicContact CG-CD1 4.2Å; L166-L170 WeakPolarHBondContact O-CG 3.27Å; L166-L170 PolarHBondContact O-N 2.94Å; A167-L170 PolarHBondContact O-N 3Å; L170-A173 WeakPolarHBondContact O-CB 3.47Å; L170-A173 PolarHBondContact O-N 2.87Å; L170-Q174 PolarHBondContact O-N 2.65Å; L170-Q174 PolarHBondContact O-NE2 3.46Å
171	F	96.8	Very high	95.3	Very high	4 Å²	4	19 Å²	19	2%	0.018	10%	0.098	C	C	.	.	H	α-helix	trans	-65.8	-45.1	167.8	170.3	-100.2	0	0	0	112.1	Y13 L45 L46 A49 A167 F168 A173 Q174 A175	Y13-F171 HydrophobicContact CD2-CB 4.29Å; Y13-F171 AromaticContact CD2-CD1 3.86Å; Y13-F171 HydrophobicContact CD2-CD1 3.86Å; Y13-F171 HydrophobicContact CD2-CD2 4.07Å; Y13-F171 HydrophobicContact CD2-CE1 4.19Å; Y13-F171 HydrophobicContact CD2-CE2 4.4Å; Y13-F171 AromaticContact CD2-CG 3.8Å; Y13-F171 HydrophobicContact CD2-CG 3.8Å; Y13-F171 HydrophobicContact CD2-CZ 4.47Å; Y13-F171 HydrophobicContact CE2-CB 3.7Å; Y13-F171 HydrophobicContact CE2-CD1 4.13Å; Y13-F171 AromaticContact CE2-CD2 3.84Å; Y13-F171 HydrophobicContact CE2-CD2 3.84Å; Y13-F171 AromaticContact CE2-CG 3.61Å; Y13-F171 HydrophobicContact CE2-CG 3.61Å; L45-F171 HydrophobicContact CB-CZ 4.38Å; L45-F171 HydrophobicContact CD2-CE2 4.36Å; L45-F171 HydrophobicContact CD2-CZ 4.01Å; L45-F171 HydrophobicContact CG-CE1 4.47Å; L45-F171 HydrophobicContact CG-CE2 4.42Å; L45-F171 HydrophobicContact CG-CZ 3.77Å; L46-F171 HydrophobicContact CB-CE2 3.9Å; L46-F171 HydrophobicContact CB-CZ 4.31Å; L46-F171 HydrophobicContact CD1-CD2 4.35Å; L46-F171 HydrophobicContact CD1-CE2 3.93Å; L46-F171 HydrophobicContact CD1-CZ 4.33Å; L46-F171 HydrophobicContact CG-CE2 4.46Å; A49-F171 HydrophobicContact CB-CE1 3.57Å; A49-F171 HydrophobicContact CB-CZ 3.77Å; A167-F171 WeakPolarHBondContact O-CB 3.41Å; A167-F171 PolarHBondContact O-N 3.44Å; F168-F171 AromaticContact CD2-CD1 3.87Å; F168-F171 HydrophobicContact CD2-CD1 3.87Å; F168-F171 AromaticContact CE2-CD1 3.97Å; F168-F171 HydrophobicContact CE2-CD1 3.97Å; F168-F171 HydrophobicContact CE2-CE1 4.23Å; F168-F171 WeakPolarHBondContact O-CB 3.36Å; F168-F171 PolarHBondContact O-N 3.46Å; F171-A173 VanDerWaalsContact C-N 3.26Å; F171-A173 PolarHBondContact O-N 2.93Å; F171-Q174 WeakPolarHBondContact O-CB 3.23Å; F171-Q174 PolarHBondContact O-N 3.46Å; F171-A175 PolarHBondContact O-N 3.27Å
172	L	95.5	Very high	95.5	Very high	1 Å²	1	20.3 Å²	20.3	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-65	-27.8	172.6	-70.8	176.6	0	0	0	112.9	L9 A49 L53 F64 F168 E169 A175 E176	L9-L172 HydrophobicContact CD2-CD2 4.07Å; A49-L172 HydrophobicContact CB-CD2 4.3Å; L53-L172 HydrophobicContact CD1-CD2 4.27Å; F64-L172 HydrophobicContact CE1-CB 3.95Å; F168-L172 HydrophobicContact CD1-CD1 3.99Å; F168-L172 HydrophobicContact CD1-CG 4.45Å; F168-L172 HydrophobicContact CE1-CD1 3.63Å; F168-L172 HydrophobicContact CE1-CG 4.19Å; F168-L172 HydrophobicContact CE2-CG 4.47Å; F168-L172 HydrophobicContact CZ-CD1 4.06Å; F168-L172 HydrophobicContact CZ-CD2 4.3Å; F168-L172 HydrophobicContact CZ-CG 4.21Å; F168-L172 WeakPolarHBondContact O-CG 3.28Å; F168-L172 PolarHBondContact O-N 2.98Å; E169-L172 PolarHBondContact O-N 2.73Å; L172-A175 PolarHBondContact O-N 2.81Å; L172-E176 PolarHBondContact O-N 2.96Å
173	A	96.4	Very high	95.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-68.3	-38.3	175.3	0	0	0	0	0	111.7	F64 F69 F92 E169 L170 F171 A175 C177	F64-A173 HydrophobicContact CE1-CB 4.04Å; F64-A173 HydrophobicContact CZ-CB 4.5Å; F69-A173 HydrophobicContact CD2-CB 3.67Å; F69-A173 HydrophobicContact CE2-CB 3.9Å; F69-A173 WeakPolarHBondContact CE2-O 3.44Å; F92-A173 HydrophobicContact CB-CB 4.15Å; F92-A173 HydrophobicContact CD1-CB 3.9Å; F92-A173 HydrophobicContact CD2-CB 3.68Å; F92-A173 HydrophobicContact CE1-CB 4.2Å; F92-A173 HydrophobicContact CE2-CB 3.99Å; F92-A173 HydrophobicContact CG-CB 3.64Å; F92-A173 HydrophobicContact CZ-CB 4.24Å; E169-A173 WeakPolarHBondContact O-CB 3.38Å; E169-A173 PolarHBondContact O-N 3.02Å; L170-A173 WeakPolarHBondContact O-CB 3.47Å; L170-A173 PolarHBondContact O-N 2.87Å; F171-A173 VanDerWaalsContact C-N 3.26Å; F171-A173 PolarHBondContact O-N 2.93Å; A173-A175 VanDerWaalsContact C-N 3.34Å; A173-C177 WeakPolarHBondContact O-CB 3.38Å; A173-C177 PolarHBondContact O-N 2.98Å; A173-C177 PolarHBondContact O-SG 3.43Å
174	Q	97.3	Very high	95.9	Very high	3 Å²	3	17.8 Å²	17.8	1%	0.014	9%	0.088	C	C	.	.	H	α-helix	trans	-60.4	-44.3	169.6	-68.9	157.8	76.3	0	0	111.1	L46 E89 F92 H93 E96 L170 F171 C177 R178	L46-Q174 HydrophobicContact CD1-CB 3.92Å; L46-Q174 HydrophobicContact CD2-CB 4.36Å; E89-Q174 HydrophobicContact CG-CB 4.06Å; E89-Q174 HydrophobicContact CG-CG 4.1Å; E89-Q174 WeakPolarHBondContact O-CG 3.18Å; F92-Q174 HydrophobicContact CB-CG 3.87Å; H93-Q174 VanDerWaalsContact CA-CD 3.48Å; H93-Q174 HydrophobicContact CB-CG 4.26Å; H93-Q174 VanDerWaalsContact CB-OE1 3.3Å; H93-Q174 PolarHBondContact ND1-OE1 3.23Å; E96-Q174 PolarHBondContact OE2-NE2 2.94Å; L170-Q174 PolarHBondContact O-N 2.65Å; L170-Q174 PolarHBondContact O-NE2 3.46Å; F171-Q174 WeakPolarHBondContact O-CB 3.23Å; F171-Q174 PolarHBondContact O-N 3.46Å; Q174-C177 WeakPolarHBondContact O-CB 3.44Å; Q174-C177 PolarHBondContact O-N 3.37Å; Q174-R178 PolarHBondContact O-N 2.91Å
175	A	95.9	Very high	96	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.4	-43.3	179.9	0	0	0	0	0	113	L46 A49 L53 F171 L172 A173 R178 L179	L46-A175 HydrophobicContact CD1-CB 3.81Å; A49-A175 HydrophobicContact CB-CB 3.84Å; L53-A175 HydrophobicContact CD1-CB 3.6Å; F171-A175 PolarHBondContact O-N 3.27Å; L172-A175 PolarHBondContact O-N 2.81Å; A173-A175 VanDerWaalsContact C-N 3.34Å; A175-R178 PolarHBondContact O-N 3.01Å; A175-L179 PolarHBondContact O-N 2.96Å
176	E	95.4	Very high	96.1	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-70.8	-32.4	175.8	-173	78.2	177.3	0	0	111.5	L53 R63 F64 F69 Y70 L172 L179 L180 R200	L53-E176 HydrophobicContact CD1-CB 4.13Å; R63-E176 IonicContact NH1-OE1 2.77Å; F64-E176 HydrophobicContact CE2-CB 4.37Å; F64-E176 HydrophobicContact CE2-CG 4.28Å; F64-E176 HydrophobicContact CZ-CB 3.94Å; F64-E176 HydrophobicContact CZ-CG 4.36Å; F69-E176 HydrophobicContact CD1-CG 4.14Å; F69-E176 HydrophobicContact CE1-CB 4Å; F69-E176 HydrophobicContact CE1-CG 3.38Å; F69-E176 HydrophobicContact CE2-CB 4.31Å; F69-E176 HydrophobicContact CZ-CB 3.75Å; F69-E176 HydrophobicContact CZ-CG 3.63Å; Y70-E176 PolarHBondContact OH-OE1 3.15Å; L172-E176 PolarHBondContact O-N 2.96Å; E176-L179 PolarHBondContact O-N 2.92Å; E176-L180 WeakPolarHBondContact O-CB 3.09Å; E176-L180 VanDerWaalsContact O-CG 3.26Å; E176-L180 WeakPolarHBondContact O-CG 3.31Å; E176-L180 PolarHBondContact O-N 3.15Å; E176-R200 VanDerWaalsContact OE1-CG 3.23Å; E176-R200 WeakPolarHBondContact OE1-CG 3.39Å; E176-R200 IonicContact OE1-CZ 3.72Å; E176-R200 IonicContact OE1-NE 2.96Å; E176-R200 PolarHBondContact OE1-NE 3.45Å; E176-R200 IonicContact OE1-NH2 2.67Å; E176-R200 PolarHBondContact OE1-NH2 2.73Å; E176-R200 IonicContact OE2-CZ 2.69Å; E176-R200 IonicContact OE2-NE 3.01Å; E176-R200 IonicContact OE2-NH2 2.84Å; E176-R200 PolarHBondContact OE2-NH2 3.24Å
177	C	97.1	Very high	96.1	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.014	11%	0.11	C	C	.	.	H	α-helix	trans	-61	-42.6	169.1	-82.7	0	0	0	0	112.5	E89 A173 Q174 L180 G181	E89-C177 HydrophobicContact CB-CB 4.2Å; A173-C177 WeakPolarHBondContact O-CB 3.38Å; A173-C177 PolarHBondContact O-N 2.98Å; A173-C177 PolarHBondContact O-SG 3.43Å; Q174-C177 WeakPolarHBondContact O-CB 3.44Å; Q174-C177 PolarHBondContact O-N 3.37Å; C177-L180 PolarHBondContact O-N 3.42Å; C177-G181 PolarHBondContact O-N 3.41Å; C177-G181 VanDerWaalsContact O-N 3.07Å
178	R	96.4	Very high	95.9	Very high	73 Å²	73	29.4 Å²	29.4	28%	0.275	15%	0.15	S	C	.	.	H	α-helix	trans	-62.2	-46.8	173.4	-72.6	-176.9	178.8	-153.3	-3.7	111.6	L46 T50 E89 Q174 A175 L180 G181 E182	L46-R178 VanDerWaalsContact CD2-CZ 3.42Å; T50-R178 HydrophobicContact CG2-CB 4.08Å; E89-R178 IonicContact OE1-CZ 3.73Å; E89-R178 IonicContact OE1-NE 3.71Å; E89-R178 PolarHBondContact OE1-NE 3.37Å; E89-R178 IonicContact OE1-NH2 2.73Å; E89-R178 PolarHBondContact OE1-NH2 2.82Å; E89-R178 IonicContact OE2-NE 3.19Å; Q174-R178 PolarHBondContact O-N 2.91Å; A175-R178 PolarHBondContact O-N 3.01Å; R178-L180 VanDerWaalsContact C-N 3.31Å; R178-L180 PolarHBondContact O-N 2.87Å; R178-G181 CarbonylContact O-C 3.55Å; R178-G181 WeakPolarHBondContact O-CA 3.41Å; R178-G181 PolarHBondContact O-N 2.71Å; R178-E182 PolarHBondContact O-N 2.92Å
179	L	95.1	Very high	95.6	Very high	4 Å²	4	32.6 Å²	32.6	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-38.7	178.1	-165.6	73.3	0	0	0	112.3	T50 L53 A175 E176 G181 E182 V183 R200 A207	T50-L179 HydrophobicContact CG2-CB 4.12Å; T50-L179 HydrophobicContact CG2-CD1 4.13Å; L53-L179 HydrophobicContact CB-CD2 4.09Å; A175-L179 PolarHBondContact O-N 2.96Å; E176-L179 PolarHBondContact O-N 2.92Å; L179-G181 VanDerWaalsContact C-N 3.34Å; L179-E182 WeakPolarHBondContact O-CB 3.45Å; L179-E182 PolarHBondContact O-N 3.36Å; L179-V183 WeakPolarHBondContact O-CG2 3.35Å; L179-V183 PolarHBondContact O-N 3.37Å; L179-R200 VanDerWaalsContact CD2-CZ 3.45Å; L179-A207 HydrophobicContact CD1-CB 3.94Å; L179-A207 HydrophobicContact CG-CB 4.45Å
180	L	96	Very high	95.2	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-37.1	172.6	-72.3	167.6	0	0	0	112.1	F69 L85 E176 C177 R178 V183 V184 A196 L197 R200	F69-L180 HydrophobicContact CE1-CD1 4.02Å; F69-L180 HydrophobicContact CZ-CD1 4.03Å; L85-L180 HydrophobicContact CD1-CB 3.62Å; L85-L180 HydrophobicContact CD2-CB 4.01Å; L85-L180 HydrophobicContact CD2-CD1 3.89Å; L85-L180 HydrophobicContact CG-CB 4.47Å; E176-L180 WeakPolarHBondContact O-CB 3.09Å; E176-L180 VanDerWaalsContact O-CG 3.26Å; E176-L180 WeakPolarHBondContact O-CG 3.31Å; E176-L180 PolarHBondContact O-N 3.15Å; C177-L180 PolarHBondContact O-N 3.42Å; R178-L180 VanDerWaalsContact C-N 3.31Å; R178-L180 PolarHBondContact O-N 2.87Å; L180-V183 WeakPolarHBondContact O-CB 3.45Å; L180-V183 PolarHBondContact O-N 3.47Å; L180-V184 WeakPolarHBondContact O-CG2 3.49Å; L180-V184 PolarHBondContact O-N 2.92Å; L180-V184 VanDerWaalsContact O-N 3.08Å; L180-A196 HydrophobicContact CD2-CB 4.34Å; L180-L197 HydrophobicContact CD1-CD1 3.62Å; L180-R200 HydrophobicContact CD2-CB 3.69Å; L180-R200 HydrophobicContact CD2-CG 3.86Å
181	G	96.3	Very high	94.9	Very high	30 Å²	30	34.5 Å²	34.5	31%	0.309	20%	0.197	S	C	.	.	H	α-helix	trans	-62	-41	171	0	0	0	0	0	112.7	C177 R178 L179 V184 A185	C177-G181 PolarHBondContact O-N 3.41Å; C177-G181 VanDerWaalsContact O-N 3.07Å; R178-G181 CarbonylContact O-C 3.55Å; R178-G181 WeakPolarHBondContact O-CA 3.41Å; R178-G181 PolarHBondContact O-N 2.71Å; L179-G181 VanDerWaalsContact C-N 3.34Å; G181-V184 PolarHBondContact O-N 3.19Å; G181-A185 WeakPolarHBondContact O-CB 3.42Å; G181-A185 PolarHBondContact O-N 3.01Å
182	E	95.8	Very high	94.8	Very high	89 Å²	89	36.9 Å²	36.9	42%	0.416	22%	0.215	S	C	.	.	H	α-helix	trans	-61.8	-42.4	172.6	-68.2	174.2	-158.2	0	0	111.8	R178 L179 V184 A185 L186 A207	R178-E182 PolarHBondContact O-N 2.92Å; L179-E182 WeakPolarHBondContact O-CB 3.45Å; L179-E182 PolarHBondContact O-N 3.36Å; E182-V184 PolarHBondContact O-N 2.96Å; E182-A185 PolarHBondContact O-N 2.89Å; E182-L186 VanDerWaalsContact O-CB 3.28Å; E182-L186 WeakPolarHBondContact O-CB 3.45Å; E182-L186 VanDerWaalsContact O-CG 3.23Å; E182-L186 WeakPolarHBondContact O-CG 3.26Å; E182-L186 PolarHBondContact O-N 3.45Å; E182-A207 HydrophobicContact CB-CB 4.04Å
183	V	96.3	Very high	94.8	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-57.1	-47.7	174.3	173	0	0	0	0	111.3	L179 L180 L186 A187 A196 A207 C210 A211 L214	L179-V183 WeakPolarHBondContact O-CG2 3.35Å; L179-V183 PolarHBondContact O-N 3.37Å; L180-V183 WeakPolarHBondContact O-CB 3.45Å; L180-V183 PolarHBondContact O-N 3.47Å; V183-L186 PolarHBondContact O-N 3.44Å; V183-A187 VanDerWaalsContact O-CB 3.26Å; V183-A187 WeakPolarHBondContact O-CB 2.98Å; V183-A187 PolarHBondContact O-N 3.3Å; V183-A196 HydrophobicContact CB-CB 4.18Å; V183-A196 HydrophobicContact CG1-CB 3.68Å; V183-A207 HydrophobicContact CG2-CB 4.04Å; V183-C210 HydrophobicContact CB-CB 4.44Å; V183-C210 HydrophobicContact CG1-CB 3.81Å; V183-C210 HydrophobicContact CG2-CB 3.68Å; V183-A211 WeakPolarHBondContact O-CB 2.96Å; V183-L214 HydrophobicContact CG1-CD1 3.53Å
184	V	96.6	Very high	94.8	Very high	35 Å²	35	41.5 Å²	41.5	21%	0.212	24%	0.237	C	C	.	.	H	α-helix	trans	-65.2	-43.5	179.5	175.1	0	0	0	0	111.4	L180 G181 E182 A187 R188 E193 A196	L180-V184 WeakPolarHBondContact O-CG2 3.49Å; L180-V184 PolarHBondContact O-N 2.92Å; L180-V184 VanDerWaalsContact O-N 3.08Å; G181-V184 PolarHBondContact O-N 3.19Å; E182-V184 PolarHBondContact O-N 2.96Å; V184-A187 PolarHBondContact O-N 3.01Å; V184-R188 PolarHBondContact O-N 2.97Å; V184-E193 HydrophobicContact CG2-CG 4.28Å; V184-A196 HydrophobicContact CG2-CB 3.64Å
185	A	96	Very high	94.7	Very high	72 Å²	72	44.2 Å²	44.2	60%	0.595	25%	0.25	S	C	*	.	H	α-helix	trans	-63	-45.2	177.5	0	0	0	0	0	112	G181 E182 A187 R188	G181-A185 WeakPolarHBondContact O-CB 3.42Å; G181-A185 PolarHBondContact O-N 3.01Å; E182-A185 PolarHBondContact O-N 2.89Å; A185-A187 VanDerWaalsContact C-N 3.3Å; A185-A187 PolarHBondContact O-N 2.88Å; A185-R188 PolarHBondContact O-N 3.24Å; A185-R188 VanDerWaalsContact O-N 3.12Å
186	L	96.7	Very high	94.7	Very high	77 Å²	77	44.2 Å²	44.2	40%	0.403	25%	0.25	S	C	.	.	H	α-helix	trans	-68.9	-27.2	176.1	-68.6	171.8	0	0	0	112.2	E182 V183 R188 A207 A211 R215	E182-L186 VanDerWaalsContact O-CB 3.28Å; E182-L186 WeakPolarHBondContact O-CB 3.45Å; E182-L186 VanDerWaalsContact O-CG 3.23Å; E182-L186 WeakPolarHBondContact O-CG 3.26Å; E182-L186 PolarHBondContact O-N 3.45Å; V183-L186 PolarHBondContact O-N 3.44Å; L186-R188 PolarHBondContact O-N 3.43Å; L186-A207 HydrophobicContact CD1-CB 4.08Å; L186-A211 HydrophobicContact CB-CB 3.44Å; L186-A211 VanDerWaalsContact CB-CB 3.44Å; L186-R215 PolarHBondContact O-NH1 2.71Å
187	A	94.8	Very high	94.7	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.7	172.6	0	0	0	0	0	112.8	V183 V184 A185 G189 S190 A191 A211 L214	V183-A187 VanDerWaalsContact O-CB 3.26Å; V183-A187 WeakPolarHBondContact O-CB 2.98Å; V183-A187 PolarHBondContact O-N 3.3Å; V184-A187 PolarHBondContact O-N 3.01Å; A185-A187 VanDerWaalsContact C-N 3.3Å; A185-A187 PolarHBondContact O-N 2.88Å; A187-G189 PolarHBondContact O-N 3.32Å; A187-G189 VanDerWaalsContact O-N 3.15Å; A187-S190 WeakPolarHBondContact O-CB 3.49Å; A187-S190 PolarHBondContact O-N 2.59Å; A187-A191 HydrophobicContact CB-CB 4.05Å; A187-A211 HydrophobicContact CB-CB 4.36Å; A187-L214 HydrophobicContact CB-CB 4.42Å; A187-L214 HydrophobicContact CB-CD1 4.43Å
188	R	91.7	Very high	94.5	Very high	223 Å²	223	48 Å²	48	84%	0.842	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	31.1	174.3	-61.9	-179.4	178.8	-174.5	-1	114.4	V184 A185 L186	V184-R188 PolarHBondContact O-N 2.97Å; A185-R188 PolarHBondContact O-N 3.24Å; A185-R188 VanDerWaalsContact O-N 3.12Å; L186-R188 PolarHBondContact O-N 3.43Å
189	G	88.1	Confident	94.3	Very high	68 Å²	68	46.2 Å²	46.2	70%	0.701	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.7	-7.4	-179.2	0	0	0	0	0	115.5	A187 A191	A187-G189 PolarHBondContact O-N 3.32Å; A187-G189 VanDerWaalsContact O-N 3.15Å; G189-A191 PolarHBondContact O-N 3.36Å; G189-A191 VanDerWaalsContact O-N 3.08Å
190	S	87.4	Confident	94.2	Very high	30 Å²	30	46.1 Å²	46.1	21%	0.21	26%	0.262	C	S	.	.	S	Bend	trans	-70.9	8.3	173.3	-66.4	0	0	0	0	114.6	A187 D218	A187-S190 WeakPolarHBondContact O-CB 3.49Å; A187-S190 PolarHBondContact O-N 2.59Å; S190-D218 WeakPolarHBondContact CB-OD2 3.39Å; S190-D218 PolarHBondContact OG-OD2 2.95Å
191	A	91.7	Very high	94	Very high	12 Å²	12	50.2 Å²	50.2	10%	0.099	28%	0.278	C	S	.	.	S	Bend	trans	-160.1	149.1	178.5	0	0	0	0	0	112.6	A187 G189 E195 L214	A187-A191 HydrophobicContact CB-CB 4.05Å; G189-A191 PolarHBondContact O-N 3.36Å; G189-A191 VanDerWaalsContact O-N 3.08Å; A191-E195 HydrophobicContact CB-CB 4.27Å; A191-L214 HydrophobicContact CB-CB 4.05Å; A191-L214 HydrophobicContact CB-CD1 3.7Å; A191-L214 HydrophobicContact CB-CD2 3.95Å; A191-L214 HydrophobicContact CB-CG 4.09Å
192	S	94.5	Very high	93.5	Very high	55 Å²	55	51.9 Å²	51.9	39%	0.385	30%	0.296	S	S	.	.			trans	-85.1	165.2	166.6	60.8	0	0	0	0	112.9	L194 E195 A196	S192-L194 PolarHBondContact O-N 3.41Å; S192-E195 WeakPolarHBondContact CB-OE2 3.18Å; S192-E195 PolarHBondContact N-OE2 3.27Å; S192-E195 PolarHBondContact O-N 3.3Å; S192-E195 WeakPolarHBondContact OG-CG 3.45Å; S192-E195 PolarHBondContact OG-N 3.21Å; S192-E195 PolarHBondContact OG-OE2 2.99Å; S192-A196 PolarHBondContact O-N 3.25Å
193	E	95.9	Very high	93.1	Very high	56 Å²	56	48.4 Å²	48.4	26%	0.262	28%	0.281	S	S	.	.	H	α-helix	trans	-57	-36.2	174	-62.4	-169.4	146.1	0	0	112.6	L77 N84 L85 V184 L197	L77-E193 HydrophobicContact CD1-CB 4.01Å; L77-E193 HydrophobicContact CD2-CB 4.33Å; L77-E193 WeakPolarHBondContact CD2-OE2 3.28Å; N84-E193 WeakPolarHBondContact CA-OE2 3.49Å; N84-E193 WeakPolarHBondContact CB-OE2 3.41Å; L85-E193 WeakPolarHBondContact CB-OE1 3.42Å; L85-E193 HydrophobicContact CD1-CB 3.86Å; L85-E193 HydrophobicContact CD1-CG 3.74Å; L85-E193 HydrophobicContact CG-CB 4.02Å; L85-E193 HydrophobicContact CG-CG 4.02Å; L85-E193 PolarHBondContact N-OE1 3.05Å; L85-E193 PolarHBondContact N-OE2 3.09Å; V184-E193 HydrophobicContact CG2-CG 4.28Å; E193-L197 WeakPolarHBondContact O-CB 3.18Å; E193-L197 PolarHBondContact O-N 2.6Å
194	L	95.6	Very high	92.6	Very high	41 Å²	41	55 Å²	55	22%	0.215	31%	0.306	C	S	.	.	H	α-helix	trans	-68.2	-40.6	177.5	179.1	63.5	0	0	0	111.7	E74 L77 R78 S192 L197 E198	E74-L194 HydrophobicContact CG-CD1 4.37Å; L77-L194 HydrophobicContact CD1-CB 4.4Å; R78-L194 HydrophobicContact CG-CD1 4.23Å; R78-L194 HydrophobicContact CG-CD2 3.92Å; S192-L194 PolarHBondContact O-N 3.41Å; L194-L197 HydrophobicContact CD1-CD2 4.39Å; L194-L197 WeakPolarHBondContact O-CB 3.28Å; L194-L197 PolarHBondContact O-N 2.92Å; L194-E198 HydrophobicContact CD1-CG 4.32Å; L194-E198 HydrophobicContact CG-CG 4.48Å; L194-E198 WeakPolarHBondContact CG-OE1 3.43Å; L194-E198 WeakPolarHBondContact O-CB 3.25Å; L194-E198 VanDerWaalsContact O-CG 3.29Å; L194-E198 WeakPolarHBondContact O-CG 3.29Å; L194-E198 PolarHBondContact O-N 3.23Å
195	E	95	Very high	92.3	Very high	60 Å²	60	57 Å²	57	28%	0.28	32%	0.315	S	S	.	.	H	α-helix	trans	-69.1	-35.5	176.9	-73.9	170.2	93.8	0	0	113	A191 S192 L197 L199 L214 R217	A191-E195 HydrophobicContact CB-CB 4.27Å; S192-E195 WeakPolarHBondContact CB-OE2 3.18Å; S192-E195 PolarHBondContact N-OE2 3.27Å; S192-E195 PolarHBondContact O-N 3.3Å; S192-E195 WeakPolarHBondContact OG-CG 3.45Å; S192-E195 PolarHBondContact OG-N 3.21Å; S192-E195 PolarHBondContact OG-OE2 2.99Å; E195-L197 VanDerWaalsContact C-N 3.35Å; E195-L199 WeakPolarHBondContact O-CB 3.41Å; E195-L199 PolarHBondContact O-N 2.87Å; E195-L214 HydrophobicContact CB-CD2 4.28Å; E195-R217 VanDerWaalsContact CG-NH2 3.31Å; E195-R217 IonicContact OE1-CZ 3.98Å; E195-R217 IonicContact OE1-NH2 3.66Å; E195-R217 PolarHBondContact OE1-NH2 3.43Å
196	A	95.5	Very high	92	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-43.6	171.9	0	0	0	0	0	111	L180 V183 V184 S192 R200 L214	L180-A196 HydrophobicContact CD2-CB 4.34Å; V183-A196 HydrophobicContact CB-CB 4.18Å; V183-A196 HydrophobicContact CG1-CB 3.68Å; V184-A196 HydrophobicContact CG2-CB 3.64Å; S192-A196 PolarHBondContact O-N 3.25Å; A196-R200 WeakPolarHBondContact O-CB 3.39Å; A196-R200 PolarHBondContact O-N 3.04Å; A196-L214 HydrophobicContact CB-CD1 4.44Å
197	L	95.4	Very high	91.8	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-50.9	174.1	-175.8	80.2	0	0	0	112.1	F69 Y70 V73 E74 L180 E193 L194 E195 L199 R200 R201	F69-L197 HydrophobicContact CE1-CD1 4.31Å; Y70-L197 HydrophobicContact CD1-CD1 3.68Å; Y70-L197 HydrophobicContact CD1-CG 4.34Å; Y70-L197 HydrophobicContact CE1-CD1 4.24Å; V73-L197 HydrophobicContact CB-CD1 3.86Å; V73-L197 HydrophobicContact CB-CD2 4.08Å; V73-L197 HydrophobicContact CG1-CD1 3.62Å; V73-L197 HydrophobicContact CG1-CD2 3.85Å; V73-L197 HydrophobicContact CG1-CG 4.29Å; E74-L197 HydrophobicContact CB-CD2 3.74Å; L180-L197 HydrophobicContact CD1-CD1 3.62Å; E193-L197 WeakPolarHBondContact O-CB 3.18Å; E193-L197 PolarHBondContact O-N 2.6Å; L194-L197 HydrophobicContact CD1-CD2 4.39Å; L194-L197 WeakPolarHBondContact O-CB 3.28Å; L194-L197 PolarHBondContact O-N 2.92Å; E195-L197 VanDerWaalsContact C-N 3.35Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 3.32Å; L197-R200 PolarHBondContact O-N 2.97Å; L197-R201 VanDerWaalsContact O-CB 3.28Å; L197-R201 WeakPolarHBondContact O-CB 3.48Å; L197-R201 PolarHBondContact O-N 3.23Å
198	E	93.8	Very high	91.8	Very high	80 Å²	80	56 Å²	56	37%	0.374	31%	0.307	S	S	.	.	H	α-helix	trans	-61.1	-40.7	-177.7	-75.8	172.3	-177.1	0	0	111.9	R78 L194	R78-E198 IonicContact CZ-OE1 3.12Å; R78-E198 IonicContact NH2-OE1 3.78Å; R78-E198 PolarHBondContact NH2-OE1 3.23Å; L194-E198 HydrophobicContact CD1-CG 4.32Å; L194-E198 HydrophobicContact CG-CG 4.48Å; L194-E198 WeakPolarHBondContact CG-OE1 3.43Å; L194-E198 WeakPolarHBondContact O-CB 3.25Å; L194-E198 VanDerWaalsContact O-CG 3.29Å; L194-E198 WeakPolarHBondContact O-CG 3.29Å; L194-E198 PolarHBondContact O-N 3.23Å
199	L	93.1	Very high	91.9	Very high	37 Å²	37	46.2 Å²	46.2	19%	0.194	28%	0.276	C	S	.	.	H	α-helix	trans	-67.5	-52.7	173.2	177.6	62	0	0	0	111.7	E195 L197 R201 G202 C203 C210 A213 L214	E195-L199 WeakPolarHBondContact O-CB 3.41Å; E195-L199 PolarHBondContact O-N 2.87Å; L197-L199 VanDerWaalsContact C-N 3.34Å; L197-L199 PolarHBondContact O-N 3.32Å; L199-R201 PolarHBondContact O-N 2.86Å; L199-G202 PolarHBondContact O-N 3.17Å; L199-C203 HydrophobicContact CD1-CB 4.27Å; L199-C203 PolarHBondContact O-N 3.27Å; L199-C203 PolarHBondContact O-SG 2.66Å; L199-C210 HydrophobicContact CD2-CB 4.18Å; L199-C210 VanDerWaalsContact CD2-O 3.27Å; L199-C210 WeakPolarHBondContact CD2-O 3.49Å; L199-A213 HydrophobicContact CD2-CB 3.98Å; L199-L214 HydrophobicContact CB-CD2 4.43Å; L199-L214 HydrophobicContact CD2-CD1 4.17Å; L199-L214 HydrophobicContact CD2-CD2 3.98Å; L199-L214 HydrophobicContact CD2-CG 3.67Å
200	R	92.3	Very high	92.2	Very high	1 Å²	1	43 Å²	43	0%	0.004	24%	0.243	C	C	.	.	H	α-helix	trans	-60.6	-32.3	-176.3	177.8	62.1	179.9	175.4	1.2	112.1	L53 R63 E176 L179 L180 A196 L197 G202 D205	L53-R200 PolarHBondContact O-NH2 2.94Å; R63-R200 PolarHBondContact NH1-O 2.53Å; E176-R200 VanDerWaalsContact OE1-CG 3.23Å; E176-R200 WeakPolarHBondContact OE1-CG 3.39Å; E176-R200 IonicContact OE1-CZ 3.72Å; E176-R200 IonicContact OE1-NE 2.96Å; E176-R200 PolarHBondContact OE1-NE 3.45Å; E176-R200 IonicContact OE1-NH2 2.67Å; E176-R200 PolarHBondContact OE1-NH2 2.73Å; E176-R200 IonicContact OE2-CZ 2.69Å; E176-R200 IonicContact OE2-NE 3.01Å; E176-R200 IonicContact OE2-NH2 2.84Å; E176-R200 PolarHBondContact OE2-NH2 3.24Å; L179-R200 VanDerWaalsContact CD2-CZ 3.45Å; L180-R200 HydrophobicContact CD2-CB 3.69Å; L180-R200 HydrophobicContact CD2-CG 3.86Å; A196-R200 WeakPolarHBondContact O-CB 3.39Å; A196-R200 PolarHBondContact O-N 3.04Å; L197-R200 PolarHBondContact O-N 2.97Å; R200-G202 VanDerWaalsContact C-N 3.27Å; R200-G202 PolarHBondContact O-N 3.29Å; R200-D205 PolarHBondContact NH1-O 2.96Å
201	R	91.1	Very high	92.6	Very high	86 Å²	86	41.5 Å²	41.5	33%	0.325	23%	0.233	S	C	.	.	H	α-helix	trans	-64.1	-27.2	173.1	-172.7	-173.4	-170.2	179.8	9.1	113.2	P60 Y70 E71 E74 L197 L199	P60-R201 WeakPolarHBondContact CB-O 3.48Å; P60-R201 VanDerWaalsContact CG-O 3.26Å; P60-R201 WeakPolarHBondContact CG-O 3.35Å; Y70-R201 HydrophobicContact CD1-CB 3.82Å; Y70-R201 HydrophobicContact CD1-CG 4.06Å; Y70-R201 HydrophobicContact CD2-CG 4.14Å; Y70-R201 HydrophobicContact CE1-CB 4.29Å; Y70-R201 HydrophobicContact CG-CB 4.05Å; Y70-R201 HydrophobicContact CG-CG 3.74Å; E71-R201 IonicContact OE1-CZ 3.54Å; E71-R201 IonicContact OE1-NE 3.57Å; E71-R201 IonicContact OE1-NH2 2.75Å; E71-R201 PolarHBondContact OE1-NH2 3.35Å; E74-R201 IonicContact OE1-NH1 3.22Å; E74-R201 IonicContact OE2-CZ 2.65Å; E74-R201 IonicContact OE2-NH1 3.12Å; E74-R201 PolarHBondContact OE2-NH1 3.37Å; E74-R201 IonicContact OE2-NH2 3.71Å; L197-R201 VanDerWaalsContact O-CB 3.28Å; L197-R201 WeakPolarHBondContact O-CB 3.48Å; L197-R201 PolarHBondContact O-N 3.23Å; L199-R201 PolarHBondContact O-N 2.86Å
202	G	87.1	Confident	92.7	Very high	66 Å²	66	44.9 Å²	44.9	68%	0.68	25%	0.246	S	C	*	.	H	α-helix	trans	-97.4	-30.6	178.7	0	0	0	0	0	114.6	L199 R200	L199-G202 PolarHBondContact O-N 3.17Å; R200-G202 VanDerWaalsContact C-N 3.27Å; R200-G202 PolarHBondContact O-N 3.29Å
203	C	85.8	Confident	92.7	Very high	16 Å²	16	43.8 Å²	43.8	11%	0.108	24%	0.241	C	C	.	.			trans	-100	164.6	-169.8	78.6	0	0	0	0	114.9	R63 L199 D205 C210	R63-C203 PolarHBondContact NH2-O 2.95Å; L199-C203 HydrophobicContact CD1-CB 4.27Å; L199-C203 PolarHBondContact O-N 3.27Å; L199-C203 PolarHBondContact O-SG 2.66Å; C203-D205 VanDerWaalsContact CB-OD2 3.29Å; C203-D205 WeakPolarHBondContact CB-OD2 3.36Å; C203-C210 PolarHBondContact SG-SG 3.06Å
204	R	87.4	Confident	92.7	Very high	140 Å²	140	41.2 Å²	41.2	53%	0.528	23%	0.229	S	C	.	.			trans	-115.6	35.3	173.6	-71.1	-175.8	63.5	-121.8	-2.9	111.1	Q57	Q57-R204 HydrophobicContact CB-CB 4.26Å; Q57-R204 VanDerWaalsContact CD-C 3.41Å; Q57-R204 WeakPolarHBondContact CG-O 3.45Å; Q57-R204 VanDerWaalsContact O-CZ 3.31Å; Q57-R204 PolarHBondContact O-NE 3.18Å; Q57-R204 PolarHBondContact O-NH2 2.89Å; Q57-R204 PolarHBondContact OE1-O 3.1Å; Q57-R204 VanDerWaalsContact OE1-O 3.14Å
205	D	88.4	Confident	92.6	Very high	75 Å²	75	42.9 Å²	42.9	40%	0.401	23%	0.232	S	C	.	.			trans	-99.2	154.6	178.8	-52.1	-51.7	0	0	0	110.7	Q57 R200 C203 C210	Q57-D205 PolarHBondContact NE2-O 3.37Å; Q57-D205 PolarHBondContact OE1-O 3.29Å; R200-D205 PolarHBondContact NH1-O 2.96Å; C203-D205 VanDerWaalsContact CB-OD2 3.29Å; C203-D205 WeakPolarHBondContact CB-OD2 3.36Å; D205-C210 PolarHBondContact O-SG 3.18Å
206	D	91.4	Very high	92.5	Very high	73 Å²	73	46.4 Å²	46.4	39%	0.39	24%	0.243	S	C	.	.			trans	-76.6	-179.8	174.9	76.2	-29.7	0	0	0	111.1	G54 Q57 A208 G209 C210	G54-D206 WeakPolarHBondContact O-CB 3.13Å; Q57-D206 VanDerWaalsContact NE2-CA 3.35Å; Q57-D206 VanDerWaalsContact NE2-N 3.19Å; D206-A208 PolarHBondContact O-N 3.24Å; D206-A208 PolarHBondContact OD1-N 2.91Å; D206-G209 PolarHBondContact O-N 2.95Å; D206-G209 PolarHBondContact OD1-N 2.86Å; D206-C210 WeakPolarHBondContact O-CB 3.35Å; D206-C210 PolarHBondContact O-N 3.08Å; D206-C210 PolarHBondContact O-SG 2.73Å
207	A	92.6	Very high	92.2	Very high	7 Å²	7	51.8 Å²	51.8	6%	0.058	26%	0.263	C	S	.	.	H	α-helix	trans	-59.9	-35.6	-178.8	0	0	0	0	0	112.3	L179 E182 V183 L186 A211	L179-A207 HydrophobicContact CD1-CB 3.94Å; L179-A207 HydrophobicContact CG-CB 4.45Å; E182-A207 HydrophobicContact CB-CB 4.04Å; V183-A207 HydrophobicContact CG2-CB 4.04Å; L186-A207 HydrophobicContact CD1-CB 4.08Å; A207-A211 WeakPolarHBondContact O-CB 3.47Å; A207-A211 PolarHBondContact O-N 3.48Å; A207-A211 VanDerWaalsContact O-N 3.09Å
208	A	94.1	Very high	91.8	Very high	48 Å²	48	55.3 Å²	55.3	40%	0.397	28%	0.282	S	S	.	.	H	α-helix	trans	-71.1	-45.6	178.7	0	0	0	0	0	112.8	D206 A211 E212	D206-A208 PolarHBondContact O-N 3.24Å; D206-A208 PolarHBondContact OD1-N 2.91Å; A208-A211 PolarHBondContact O-N 2.99Å; A208-E212 WeakPolarHBondContact O-CB 3.44Å; A208-E212 PolarHBondContact O-N 2.96Å
209	G	93.7	Very high	91.3	Very high	18 Å²	18	54.7 Å²	54.7	19%	0.186	29%	0.287	C	S	.	.	H	α-helix	trans	-66.3	-43.3	177.4	0	0	0	0	0	112.7	D206 A211 E212 A213	D206-G209 PolarHBondContact O-N 2.95Å; D206-G209 PolarHBondContact OD1-N 2.86Å; G209-A211 PolarHBondContact O-N 3.04Å; G209-E212 PolarHBondContact O-N 3.49Å; G209-A213 PolarHBondContact O-N 3.43Å
210	C	94.1	Very high	90.8	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-55.5	-51.7	171.2	-69	0	0	0	0	110.9	V183 L199 C203 D205 D206 E212 A213 L214	V183-C210 HydrophobicContact CB-CB 4.44Å; V183-C210 HydrophobicContact CG1-CB 3.81Å; V183-C210 HydrophobicContact CG2-CB 3.68Å; L199-C210 HydrophobicContact CD2-CB 4.18Å; L199-C210 VanDerWaalsContact CD2-O 3.27Å; L199-C210 WeakPolarHBondContact CD2-O 3.49Å; C203-C210 PolarHBondContact SG-SG 3.06Å; D205-C210 PolarHBondContact O-SG 3.18Å; D206-C210 WeakPolarHBondContact O-CB 3.35Å; D206-C210 PolarHBondContact O-N 3.08Å; D206-C210 PolarHBondContact O-SG 2.73Å; C210-E212 VanDerWaalsContact C-N 3.29Å; C210-E212 PolarHBondContact O-N 2.73Å; C210-A213 PolarHBondContact O-N 3.26Å; C210-L214 WeakPolarHBondContact O-CG 3.48Å; C210-L214 PolarHBondContact O-N 2.71Å
211	A	95.6	Very high	90.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-62.9	-34.5	178.9	0	0	0	0	0	112.8	V183 L186 A187 A207 A208 G209 L214 R215	V183-A211 WeakPolarHBondContact O-CB 2.96Å; L186-A211 HydrophobicContact CB-CB 3.44Å; L186-A211 VanDerWaalsContact CB-CB 3.44Å; A187-A211 HydrophobicContact CB-CB 4.36Å; A207-A211 WeakPolarHBondContact O-CB 3.47Å; A207-A211 PolarHBondContact O-N 3.48Å; A207-A211 VanDerWaalsContact O-N 3.09Å; A208-A211 PolarHBondContact O-N 2.99Å; G209-A211 PolarHBondContact O-N 3.04Å; A211-L214 PolarHBondContact O-N 3.36Å; A211-R215 VanDerWaalsContact O-CG 3.32Å; A211-R215 WeakPolarHBondContact O-CG 3.34Å; A211-R215 PolarHBondContact O-N 3.18Å; A211-R215 PolarHBondContact O-NH1 2.84Å
212	E	95.3	Very high	89.2	Confident	82 Å²	82	57.8 Å²	57.8	38%	0.383	32%	0.324	S	S	.	.	H	α-helix	trans	-70.4	-41.2	176.2	-161.7	-173.6	-146.2	0	0	112.6	A208 G209 C210 L214 R215 R216	A208-E212 WeakPolarHBondContact O-CB 3.44Å; A208-E212 PolarHBondContact O-N 2.96Å; G209-E212 PolarHBondContact O-N 3.49Å; C210-E212 VanDerWaalsContact C-N 3.29Å; C210-E212 PolarHBondContact O-N 2.73Å; E212-L214 VanDerWaalsContact C-N 3.3Å; E212-L214 PolarHBondContact O-N 3.31Å; E212-R215 VanDerWaalsContact CA-NH2 3.33Å; E212-R215 VanDerWaalsContact CB-NH2 3.31Å; E212-R215 PolarHBondContact O-N 2.78Å; E212-R216 WeakPolarHBondContact O-CG 3.47Å; E212-R216 PolarHBondContact O-N 2.82Å; E212-R216 IonicContact OE1-CZ 2.71Å; E212-R216 IonicContact OE1-NH2 2.71Å; E212-R216 PolarHBondContact OE1-NH2 3.44Å; E212-R216 VanDerWaalsContact OE1-NH2 3.1Å; E212-R216 IonicContact OE2-CZ 3.21Å; E212-R216 IonicContact OE2-NH1 3.63Å; E212-R216 PolarHBondContact OE2-NH1 3.23Å; E212-R216 IonicContact OE2-NH2 2.84Å; E212-R216 PolarHBondContact OE2-NH2 3Å
213	A	94.1	Very high	88.7	Confident	33 Å²	33	58.3 Å²	58.3	27%	0.273	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-39	172.8	0	0	0	0	0	111.9	L199 G209 C210 R216 R217	L199-A213 HydrophobicContact CD2-CB 3.98Å; G209-A213 PolarHBondContact O-N 3.43Å; C210-A213 PolarHBondContact O-N 3.26Å; A213-R216 PolarHBondContact O-N 2.95Å; A213-R217 WeakPolarHBondContact O-CB 2.93Å; A213-R217 PolarHBondContact O-N 3.11Å
214	L	94.9	Very high	88.2	Confident	1 Å²	1	63 Å²	63	1%	0.005	33%	0.334	C	S	.	.	H	α-helix	trans	-63.5	-49.4	173.4	-68.4	164.6	0	0	0	112	V183 A187 A191 E195 A196 L199 C210 A211 E212 R216 R217 D218	V183-L214 HydrophobicContact CG1-CD1 3.53Å; A187-L214 HydrophobicContact CB-CB 4.42Å; A187-L214 HydrophobicContact CB-CD1 4.43Å; A191-L214 HydrophobicContact CB-CB 4.05Å; A191-L214 HydrophobicContact CB-CD1 3.7Å; A191-L214 HydrophobicContact CB-CD2 3.95Å; A191-L214 HydrophobicContact CB-CG 4.09Å; E195-L214 HydrophobicContact CB-CD2 4.28Å; A196-L214 HydrophobicContact CB-CD1 4.44Å; L199-L214 HydrophobicContact CB-CD2 4.43Å; L199-L214 HydrophobicContact CD2-CD1 4.17Å; L199-L214 HydrophobicContact CD2-CD2 3.98Å; L199-L214 HydrophobicContact CD2-CG 3.67Å; C210-L214 WeakPolarHBondContact O-CG 3.48Å; C210-L214 PolarHBondContact O-N 2.71Å; A211-L214 PolarHBondContact O-N 3.36Å; E212-L214 VanDerWaalsContact C-N 3.3Å; E212-L214 PolarHBondContact O-N 3.31Å; L214-R216 VanDerWaalsContact C-N 3.29Å; L214-R216 PolarHBondContact O-N 3.41Å; L214-R217 WeakPolarHBondContact O-CB 3.37Å; L214-R217 PolarHBondContact O-N 2.67Å; L214-R217 VanDerWaalsContact O-N 3.08Å; L214-D218 PolarHBondContact O-N 3.4Å
215	R	94.3	Very high	87.4	Confident	76 Å²	76	58.6 Å²	58.6	29%	0.287	33%	0.327	S	S	.	.	H	α-helix	trans	-59.9	-36.2	176	-68.4	-177.4	-47.3	-97.8	-1.1	112.7	L186 A211 E212 S219	L186-R215 PolarHBondContact O-NH1 2.71Å; A211-R215 VanDerWaalsContact O-CG 3.32Å; A211-R215 WeakPolarHBondContact O-CG 3.34Å; A211-R215 PolarHBondContact O-N 3.18Å; A211-R215 PolarHBondContact O-NH1 2.84Å; E212-R215 VanDerWaalsContact CA-NH2 3.33Å; E212-R215 VanDerWaalsContact CB-NH2 3.31Å; E212-R215 PolarHBondContact O-N 2.78Å; R215-S219 WeakPolarHBondContact O-CB 3.26Å; R215-S219 PolarHBondContact O-N 2.8Å; R215-S219 PolarHBondContact O-OG 2.81Å
216	R	91.9	Very high	86.4	Confident	135 Å²	135	63.1 Å²	63.1	51%	0.509	34%	0.339	S	S	.	.	H	α-helix	trans	-65.1	-43.4	172.4	-74	-179.2	-177.4	107.3	4	111.8	E212 A213 L214 S219 L220	E212-R216 WeakPolarHBondContact O-CG 3.47Å; E212-R216 PolarHBondContact O-N 2.82Å; E212-R216 IonicContact OE1-CZ 2.71Å; E212-R216 IonicContact OE1-NH2 2.71Å; E212-R216 PolarHBondContact OE1-NH2 3.44Å; E212-R216 VanDerWaalsContact OE1-NH2 3.1Å; E212-R216 IonicContact OE2-CZ 3.21Å; E212-R216 IonicContact OE2-NH1 3.63Å; E212-R216 PolarHBondContact OE2-NH1 3.23Å; E212-R216 IonicContact OE2-NH2 2.84Å; E212-R216 PolarHBondContact OE2-NH2 3Å; A213-R216 PolarHBondContact O-N 2.95Å; L214-R216 VanDerWaalsContact C-N 3.29Å; L214-R216 PolarHBondContact O-N 3.41Å; R216-S219 PolarHBondContact O-N 3Å; R216-L220 WeakPolarHBondContact O-CG 3.29Å; R216-L220 PolarHBondContact O-N 3.43Å
217	R	89.6	Confident	85.2	Confident	112 Å²	112	65.9 Å²	65.9	42%	0.423	35%	0.353	S	S	.	.	H	α-helix	trans	-63.6	-44.3	179	-171.4	174.4	76.7	-170.7	8.1	112.1	E195 A213 L214 L220 G221	E195-R217 VanDerWaalsContact CG-NH2 3.31Å; E195-R217 IonicContact OE1-CZ 3.98Å; E195-R217 IonicContact OE1-NH2 3.66Å; E195-R217 PolarHBondContact OE1-NH2 3.43Å; A213-R217 WeakPolarHBondContact O-CB 2.93Å; A213-R217 PolarHBondContact O-N 3.11Å; L214-R217 WeakPolarHBondContact O-CB 3.37Å; L214-R217 PolarHBondContact O-N 2.67Å; L214-R217 VanDerWaalsContact O-N 3.08Å; R217-L220 PolarHBondContact O-N 3.32Å; R217-G221 PolarHBondContact O-N 2.97Å
218	D	87.1	Confident	83.7	Confident	76 Å²	76	70 Å²	70	41%	0.406	38%	0.381	S	S	.	.	H	α-helix	trans	-60.9	-47.2	174.5	179.9	37.4	0	0	0	111.6	S190 L214 L220 G221 A222	S190-D218 WeakPolarHBondContact CB-OD2 3.39Å; S190-D218 PolarHBondContact OG-OD2 2.95Å; L214-D218 PolarHBondContact O-N 3.4Å; D218-L220 PolarHBondContact O-N 2.81Å; D218-G221 PolarHBondContact O-N 2.94Å; D218-G221 VanDerWaalsContact O-N 3.13Å; D218-A222 PolarHBondContact O-N 2.95Å
219	S	83.9	Confident	81.9	Confident	66 Å²	66	73 Å²	73	46%	0.462	40%	0.395	S	S	.	.	H	α-helix	trans	-57.2	-46.6	175.8	-57.2	0	0	0	0	112.5	R215 R216 A222 D223	R215-S219 WeakPolarHBondContact O-CB 3.26Å; R215-S219 PolarHBondContact O-N 2.8Å; R215-S219 PolarHBondContact O-OG 2.81Å; R216-S219 PolarHBondContact O-N 3Å; S219-A222 PolarHBondContact O-N 3.18Å; S219-D223 PolarHBondContact O-N 2.89Å
220	L	82.1	Confident	80	Confident	112 Å²	112	81.7 Å²	81.7	59%	0.586	42%	0.422	S	S	*	.	H	α-helix	trans	-64	-39.3	176.1	-73.5	165.1	0	0	0	112.2	R216 R217 D218 D223 I224	R216-L220 WeakPolarHBondContact O-CG 3.29Å; R216-L220 PolarHBondContact O-N 3.43Å; R217-L220 PolarHBondContact O-N 3.32Å; D218-L220 PolarHBondContact O-N 2.81Å; L220-D223 PolarHBondContact O-N 2.82Å; L220-I224 WeakPolarHBondContact O-CB 3.28Å; L220-I224 VanDerWaalsContact O-CG1 3.28Å; L220-I224 WeakPolarHBondContact O-CG1 3.43Å; L220-I224 PolarHBondContact O-N 3.45Å
221	G	77.1	Confident	77.8	Confident	40 Å²	40	86.6 Å²	86.6	41%	0.412	45%	0.453	S	S	.	.	H	α-helix	trans	-62	-43.2	174.1	0	0	0	0	0	112.5	R217 D218 I224 A225	R217-G221 PolarHBondContact O-N 2.97Å; D218-G221 PolarHBondContact O-N 2.94Å; D218-G221 VanDerWaalsContact O-N 3.13Å; G221-I224 PolarHBondContact O-N 2.93Å; G221-A225 WeakPolarHBondContact O-CB 3.45Å; G221-A225 PolarHBondContact O-N 2.98Å
222	A	72.6	Confident	75.6	Confident	37 Å²	37	93.7 Å²	93.7	31%	0.306	49%	0.491	S	S	.	.	H	α-helix	trans	-63.8	-40.4	176.4	0	0	0	0	0	112.5	D218 S219 A225 R226	D218-A222 PolarHBondContact O-N 2.95Å; S219-A222 PolarHBondContact O-N 3.18Å; A222-A225 PolarHBondContact O-N 3.43Å; A222-R226 WeakPolarHBondContact O-CD 3.22Å; A222-R226 VanDerWaalsContact O-CG 3.24Å; A222-R226 WeakPolarHBondContact O-CG 3.38Å; A222-R226 PolarHBondContact O-N 3.29Å
223	D	76.3	Confident	73.4	Confident	77 Å²	77	97.4 Å²	97.4	41%	0.412	51%	0.513	S	S	.	.	H	α-helix	trans	-73.3	-36.6	177.5	-74.7	-27.3	0	0	0	113	S219 L220 A225 R226 L227	S219-D223 PolarHBondContact O-N 2.89Å; L220-D223 PolarHBondContact O-N 2.82Å; D223-A225 VanDerWaalsContact C-N 3.32Å; D223-A225 PolarHBondContact O-N 2.89Å; D223-R226 PolarHBondContact O-N 2.96Å; D223-R226 VanDerWaalsContact OD1-CD 3.32Å; D223-R226 WeakPolarHBondContact OD1-CD 3.27Å; D223-R226 IonicContact OD1-CZ 3.9Å; D223-R226 IonicContact OD1-NE 2.66Å; D223-R226 IonicContact OD1-NH1 3.66Å; D223-R226 PolarHBondContact OD1-NH1 3.34Å; D223-L227 WeakPolarHBondContact O-CG 3.14Å; D223-L227 PolarHBondContact O-N 2.7Å
224	I	75.4	Confident	71.4	Confident	114 Å²	114	102.6 Å²	102.6	59%	0.585	54%	0.535	S	S	*	.	H	α-helix	trans	-62.2	-40.7	169.8	-69.8	166.5	0	0	0	110.8	L220 G221 L227 S228	L220-I224 WeakPolarHBondContact O-CB 3.28Å; L220-I224 VanDerWaalsContact O-CG1 3.28Å; L220-I224 WeakPolarHBondContact O-CG1 3.43Å; L220-I224 PolarHBondContact O-N 3.45Å; G221-I224 PolarHBondContact O-N 2.93Å; I224-L227 PolarHBondContact O-N 2.78Å; I224-S228 PolarHBondContact O-N 3.07Å; I224-S228 PolarHBondContact O-OG 3.33Å
225	A	70.2	Confident	68.9	Low	48 Å²	48	111.1 Å²	111.1	40%	0.397	58%	0.575	S	S	.	*	H	α-helix	trans	-64.5	-38.2	174.7	0	0	0	0	0	112.5	G221 A222 D223 L227 S228 V229	G221-A225 WeakPolarHBondContact O-CB 3.45Å; G221-A225 PolarHBondContact O-N 2.98Å; A222-A225 PolarHBondContact O-N 3.43Å; D223-A225 VanDerWaalsContact C-N 3.32Å; D223-A225 PolarHBondContact O-N 2.89Å; A225-L227 VanDerWaalsContact C-N 3.34Å; A225-L227 PolarHBondContact O-N 3.04Å; A225-S228 PolarHBondContact O-N 3Å; A225-S228 PolarHBondContact O-OG 3.43Å; A225-V229 WeakPolarHBondContact O-CB 3.48Å; A225-V229 WeakPolarHBondContact O-CG2 3.44Å; A225-V229 PolarHBondContact O-N 2.91Å; A225-V229 VanDerWaalsContact O-N 3.16Å
226	R	68.8	Low	66.2	Low	171 Å²	171	118.2 Å²	118.2	65%	0.645	60%	0.601	S	S	*	*	H	α-helix	trans	-65.3	-35	174.1	-72.9	159.7	175	170.2	-0.9	112.7	A222 D223	A222-R226 WeakPolarHBondContact O-CD 3.22Å; A222-R226 VanDerWaalsContact O-CG 3.24Å; A222-R226 WeakPolarHBondContact O-CG 3.38Å; A222-R226 PolarHBondContact O-N 3.29Å; D223-R226 PolarHBondContact O-N 2.96Å; D223-R226 VanDerWaalsContact OD1-CD 3.32Å; D223-R226 WeakPolarHBondContact OD1-CD 3.27Å; D223-R226 IonicContact OD1-CZ 3.9Å; D223-R226 IonicContact OD1-NE 2.66Å; D223-R226 IonicContact OD1-NH1 3.66Å; D223-R226 PolarHBondContact OD1-NH1 3.34Å
227	L	66.3	Low	63.8	Low	131 Å²	131	117.7 Å²	117.7	69%	0.686	62%	0.616	S	S	*	*	H	α-helix	trans	-73	-42	176.3	-69.6	170.4	0	0	0	112	D223 I224 A225 V229 R230	D223-L227 WeakPolarHBondContact O-CG 3.14Å; D223-L227 PolarHBondContact O-N 2.7Å; I224-L227 PolarHBondContact O-N 2.78Å; A225-L227 VanDerWaalsContact C-N 3.34Å; A225-L227 PolarHBondContact O-N 3.04Å; L227-V229 VanDerWaalsContact C-N 3.28Å; L227-V229 PolarHBondContact O-N 3.08Å; L227-R230 WeakPolarHBondContact O-CB 3.23Å; L227-R230 PolarHBondContact O-N 3.29Å
228	S	60.6	Low	61.3	Low	92 Å²	92	121.5 Å²	121.5	64%	0.643	64%	0.638	S	S	*	*	H	α-helix	trans	-72.8	-16.1	179.2	64.6	0	0	0	0	114.5	I224 A225 R230	I224-S228 PolarHBondContact O-N 3.07Å; I224-S228 PolarHBondContact O-OG 3.33Å; A225-S228 PolarHBondContact O-N 3Å; A225-S228 PolarHBondContact O-OG 3.43Å; S228-R230 VanDerWaalsContact C-N 3.34Å
229	V	56	Low	58.9	Low	113 Å²	113	122 Å²	122	69%	0.685	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	0.4	175.8	170	0	0	0	0	112.9	A225 L227 P231	A225-V229 WeakPolarHBondContact O-CB 3.48Å; A225-V229 WeakPolarHBondContact O-CG2 3.44Å; A225-V229 PolarHBondContact O-N 2.91Å; A225-V229 VanDerWaalsContact O-N 3.16Å; L227-V229 VanDerWaalsContact C-N 3.28Å; L227-V229 PolarHBondContact O-N 3.08Å; V229-P231 WeakPolarHBondContact O-CD 3.46Å
230	R	53.4	Low	56.6	Low	200 Å²	200	126.3 Å²	126.3	76%	0.755	67%	0.665	S	S	*	*			trans	-64.9	113.4	164.5	-73.7	-76	171.8	159.9	-2.5	109.3	L227 S228	L227-R230 WeakPolarHBondContact O-CB 3.23Å; L227-R230 PolarHBondContact O-N 3.29Å; S228-R230 VanDerWaalsContact C-N 3.34Å
231	P	48.1	Very low	54.7	Low	102 Å²	102	130.5 Å²	130.5	66%	0.662	68%	0.681	S	S	*	*			trans	-65.2	140.9	172.3	-13.8	30.4	0	0	0	108.6	V229 D233	V229-P231 WeakPolarHBondContact O-CD 3.46Å; P231-D233 PolarHBondContact O-N 3.37Å
232	L	48.9	Very low	53	Low	149 Å²	149	135.8 Å²	135.8	78%	0.78	70%	0.699	S	S	*	*			trans	-70.5	118.3	155.3	-80.6	80.3	0	0	0	106.5	I234	L232-I234 HydrophobicContact CB-CD1 4.26Å; L232-I234 HydrophobicContact CB-CG1 3.95Å; L232-I234 PolarHBondContact O-N 3.37Å
233	D	50	Low	51.3	Low	161 Å²	161	145.6 Å²	145.6	86%	0.861	73%	0.729	S	S	*	*			trans	-70.1	72.8	171.3	-78.5	-52.7	0	0	0	110.1	P231 E235	P231-D233 PolarHBondContact O-N 3.37Å; D233-E235 PolarHBondContact O-N 2.98Å; D233-E235 VanDerWaalsContact O-N 3.11Å
234	I	51.6	Low	49.6	Very low	142 Å²	142	154 Å²	154	73%	0.728	75%	0.754	S	S	*	*			trans	-76.8	97.7	173.3	-62.5	177	0	0	0	108	L232	L232-I234 HydrophobicContact CB-CD1 4.26Å; L232-I234 HydrophobicContact CB-CG1 3.95Å; L232-I234 PolarHBondContact O-N 3.37Å
235	E	43.2	Very low	47.6	Very low	179 Å²	179	152 Å²	152	84%	0.836	76%	0.762	S	S	*	*			trans	21.2	115	160.5	-58.5	-166	141	0	0	118.2	D233	D233-E235 PolarHBondContact O-N 2.98Å; D233-E235 VanDerWaalsContact O-N 3.11Å
236	R	37.4	Very low	45.9	Very low	225 Å²	225	155.8 Å²	155.8	85%	0.849	79%	0.786	S	S	*	*			trans	-105.4	127.3	145.7	-97.7	-168.9	170.2	103	0.5	110	H238	R236-H238 PolarHBondContact O-N 2.75Å
237	P	41.1	Very low	44.6	Very low	125 Å²	125	158.8 Å²	158.8	81%	0.812	80%	0.797	S	S	*	*			trans	-73.4	115.3	179.9	28.7	-33.6	0	0	0	110.7	A239	P237-A239 PolarHBondContact O-N 3.33Å
238	H	37.4	Very low	43.7	Very low	192 Å²	192	158.3 Å²	158.3	89%	0.889	80%	0.802	S	S	*	*			trans	-76.9	104.2	174.3	-80.7	-81.6	0	0	0	111.1	R236 H240	R236-H238 PolarHBondContact O-N 2.75Å; H238-H240 PolarHBondContact O-N 3.49Å
239	A	36	Very low	42.6	Very low	87 Å²	87	159.2 Å²	159.2	72%	0.719	81%	0.808	S	S	*	*			trans	-72.6	118.3	176.1	0	0	0	0	0	112	P237	P237-A239 PolarHBondContact O-N 3.33Å
240	H	37	Very low	41.9	Very low	155 Å²	155	162.9 Å²	162.9	72%	0.718	82%	0.815	S	S	*	*			trans	37.9	106.9	153.3	-53.1	-69.1	0	0	0	120.1	H238	H238-H240 PolarHBondContact O-N 3.49Å
241	H	41.8	Very low	41.4	Very low	201 Å²	201	157.6 Å²	157.6	93%	0.931	81%	0.808	S	S	*	*				-128.2	135.3	125.8	-86.1	-65.1	0	0	0	110.5
242	L	40.6	Very low	41	Very low	151 Å²	151	159.3 Å²	159.3	79%	0.791	82%	0.817	S	S	*	*			trans	-100.5	117.1	-170	-73	162.9	0	0	0	112.1
243	R	37.3	Very low	40.8	Very low	243 Å²	243	159 Å²	159	92%	0.917	82%	0.816	S	S	*	*			trans	-142.3	85.6	150.1	-93.5	-63.6	167.1	167.1	-2.2	112.7
244	R	39.4	Very low	40.5	Very low	252 Å²	252	157.6 Å²	157.6	95%	0.951	81%	0.813	S	S	*	*			trans	-8.2	116.2	153.3	-172.4	-174.6	-58	-145.8	1.3	115.9
245	G	33.7	Very low	40.1	Very low	73 Å²	73	157.1 Å²	157.1	75%	0.753	82%	0.817	S	S	*	*			trans	-160.1	129.7	170.4	0	0	0	0	0	111.7
246	S	34.2	Very low	40.1	Very low	128 Å²	128	156.8 Å²	156.8	90%	0.895	82%	0.821	S	S	*	*			trans	-59.2	141.6	-162.4	-51	0	0	0	0	117.9
247	R	42.2	Very low	40	Very low	233 Å²	233	149.9 Å²	149.9	88%	0.879	82%	0.819	S	S	*	*			trans	-71	171.5	152.1	-92.5	-171.8	-178.7	-160.6	1.9	110.4
248	P	47.7	Very low	39.9	Very low	122 Å²	122	149.3 Å²	149.3	79%	0.792	83%	0.825	S	S	*	*			cis	-132.4	170	16.9	41.9	-25.8	0	0	0	117.2
249	S	38.5	Very low	39.7	Very low	110 Å²	110	143.8 Å²	143.8	77%	0.769	82%	0.821	S	S	*	*			trans	-72.7	155.2	169.3	-39.7	0	0	0	0	113
250	K	40.5	Very low	39.8	Very low	191 Å²	191	146.9 Å²	146.9	83%	0.83	82%	0.82	S	S	*	*			trans	-118.9	113.9	154	-77.6	-173.2	176	-173	0	106.4
251	S	43.1	Very low	39.6	Very low	88 Å²	88	148.1 Å²	148.1	62%	0.615	82%	0.818	S	S	*	*				55.8	101.9	89.9	70.7	0	0	0	0	111.8
252	V	39.3	Very low	39.4	Very low	139 Å²	139	146.1 Å²	146.1	84%	0.842	81%	0.809	S	S	*	*			trans	-93.8	109.1	169.8	175.9	0	0	0	0	106.7
253	D	45.3	Very low	39.7	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	81%	0.806	S	S	*	*			trans	-86.9	141.7	172.4	-68.6	-55.5	0	0	0	110.1
254	V	43	Very low	39.5	Very low	132 Å²	132	137 Å²	137	80%	0.8	80%	0.798	S	S	*	*			trans	-102.5	125.4	178.5	174.8	0	0	0	0	108.8
255	T	42.5	Very low	39.3	Very low	133 Å²	133	131 Å²	131	82%	0.816	79%	0.789	S	S	*	*			trans	-141.8	126.1	169.3	51.6	0	0	0	0	111
256	D	43.4	Very low	39.3	Very low	172 Å²	172	134.8 Å²	134.8	92%	0.92	79%	0.792	S	S	*	*			trans	-67.5	157.6	164.8	-90.8	-58.6	0	0	0	112.1
257	G	35.9	Very low	39.6	Very low	79 Å²	79	137.6 Å²	137.6	81%	0.814	79%	0.788	S	S	*	*			trans	176	98.6	173.1	0	0	0	0	0	113.8
258	A	39.4	Very low	39.7	Very low	113 Å²	113	132.4 Å²	132.4	93%	0.934	78%	0.784	S	S	*	*			trans	-92.5	145.4	175.7	0	0	0	0	0	112.1
259	G	33.6	Very low	39.3	Very low	77 Å²	77	134.2 Å²	134.2	79%	0.794	79%	0.786	S	S	*	*			trans	169.6	70.9	176.2	0	0	0	0	0	118.8
260	H	37.8	Very low	39.4	Very low	152 Å²	152	136.9 Å²	136.9	70%	0.704	79%	0.79	S	S	*	*			trans	30.9	136.1	145.6	-95.5	-23.6	0	0	0	125.3
261	W	32.5	Very low	39.3	Very low	181 Å²	181	137.6 Å²	137.6	69%	0.686	79%	0.794	S	S	*	*			trans	76.4	105.4	140.8	-60.1	137.8	0	0	0	123.7
262	H	37.9	Very low	38.9	Very low	159 Å²	159	137.9 Å²	137.9	74%	0.736	80%	0.801	S	S	*	*				59.2	159.3	123.8	-72.9	-25.2	0	0	0	122.7
263	P	46.7	Very low	38.8	Very low	111 Å²	111	136.8 Å²	136.8	72%	0.721	80%	0.8	S	S	*	*			cis	-140	176.5	-41.9	40.3	-23.9	0	0	0	115.2
264	A	33.1	Very low	38.4	Very low	90 Å²	90	138.3 Å²	138.3	74%	0.744	81%	0.807	S	S	*	*			trans	86.3	156.3	150.8	0	0	0	0	0	121.6
265	V	34.3	Very low	38	Very low	127 Å²	127	136.8 Å²	136.8	77%	0.77	80%	0.802	S	S	*	*			trans	62	105.6	169.5	-167.5	0	0	0	0	115.1
266	N	34.1	Very low	37.7	Very low	153 Å²	153	136.2 Å²	136.2	82%	0.818	79%	0.793	S	S	*	*			cis	-154	175.3	48.6	-128.6	-30.7	0	0	0	114
267	K	41.1	Very low	37.2	Very low	187 Å²	187	138.4 Å²	138.4	81%	0.813	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-99.5	154	-166.2	-63.2	175.4	-178.1	175.1	0	115.3
268	P	44.7	Very low	37.1	Very low	123 Å²	123	142 Å²	142	80%	0.799	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-74.1	165.3	164.5	33.7	-36.1	0	0	0	112.4
269	I	38.2	Very low	36.7	Very low	160 Å²	160	144 Å²	144	82%	0.821	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-93.6	132.3	-176.3	-62.2	171.9	0	0	0	111.2
270	L	40.8	Very low	37.6	Very low	166 Å²	166	145.3 Å²	145.3	87%	0.869	77%	0.767	S	S	*	*			trans	-136.7	137.9	164.6	-70.5	176.6	0	0	0	110.4
271	K	39.2	Very low	37.2	Very low	207 Å²	207	145.5 Å²	145.5	90%	0.9	77%	0.772	S	S	*	*			trans	-154.7	147.9	163.9	-77.9	-167.9	178.7	-178	0	108.4
272	A	35.1	Very low	37.1	Very low	93 Å²	93	145.4 Å²	145.4	77%	0.769	78%	0.776	S	S	*	*			cis	-163.2	157.4	-21.6	0	0	0	0	0	108.1
273	S	37.3	Very low	36.8	Very low	116 Å²	116	143 Å²	143	81%	0.811	77%	0.773	S	S	*	*			trans	-119.1	137.4	-175.1	-42.5	0	0	0	0	112.6
274	L	35.5	Very low	36.2	Very low	174 Å²	174	144.1 Å²	144.1	91%	0.911	77%	0.773	S	S	*	*			trans	-145.2	124.6	165.3	-61.7	172.8	0	0	0	105.9
275	S	35.9	Very low	36.2	Very low	99 Å²	99	145.5 Å²	145.5	69%	0.692	77%	0.772	S	S	*	*			cis	82.8	103.4	17	-157.9	0	0	0	0	116.2
276	L	34.5	Very low	36.2	Very low	122 Å²	122	147.3 Å²	147.3	64%	0.639	77%	0.772	S	S	*	*				164.4	126.3	113.1	-85	175.6	0	0	0	114.3
277	R	34.2	Very low	36.3	Very low	218 Å²	218	148.6 Å²	148.6	82%	0.823	77%	0.773	S	S	*	*			trans	59	170.7	143.9	-64.6	171.9	-178	136.8	0.6	119.9
278	K	32.8	Very low	36.1	Very low	154 Å²	154	145.1 Å²	145.1	67%	0.67	76%	0.764	S	S	*	*			cis	-171.3	119	-43.2	-178.7	-169.5	169.3	-157.3	0	110.3
279	E	31.2	Very low	35.8	Very low	156 Å²	156	147 Å²	147	73%	0.729	76%	0.763	S	S	*	*			trans	59.6	-177.2	162.4	-64.3	178.3	175.3	0	0	116.5
280	P	53.7	Low	35.8	Very low	104 Å²	104	147.3 Å²	147.3	68%	0.675	76%	0.759	S	S	*	*				-140	-179.1	-78.7	44.8	-28.4	0	0	0	117.1
281	L	29.1	Very low	35.5	Very low	155 Å²	155	146 Å²	146	81%	0.812	75%	0.753	S	S	*	*			trans	87.5	155.3	155.7	-62.4	171.8	0	0	0	122.5
282	F	29	Very low	35.4	Very low	179 Å²	179	144.2 Å²	144.2	79%	0.785	75%	0.748	S	S	*	*			trans	75.9	91.5	164.4	-89.4	-92.6	0	0	0	122.5
283	V	32.3	Very low	35.3	Very low	109 Å²	109	145.9 Å²	145.9	66%	0.661	74%	0.742	S	S	*	*				76.4	134.9	109.9	167	0	0	0	0	123.3
284	D	33.6	Very low	35.2	Very low	135 Å²	135	148 Å²	148	72%	0.722	74%	0.743	S	S	*	*			trans	72.6	130	156.2	-72.5	-14.7	0	0	0	125.1
285	T	34.3	Very low	35.2	Very low	118 Å²	118	150.5 Å²	150.5	72%	0.724	74%	0.74	S	S	*	*			trans	64.6	139.3	147.5	44.8	0	0	0	0	119.9
286	E	34	Very low	35.6	Very low	166 Å²	166	151.1 Å²	151.1	78%	0.776	74%	0.742	S	S	*	*			cis	-161.5	-179.5	4.1	48.6	-155.3	147.5	0	0	113.7
287	E	35.6	Very low	35.3	Very low	180 Å²	180	151.9 Å²	151.9	84%	0.841	75%	0.747	S	S	*	*			trans	70.8	89	164.6	-62.6	-165.1	127.4	0	0	122.3
288	D	37	Very low	35.1	Very low	114 Å²	114	147 Å²	147	61%	0.61	74%	0.741	S	S	*	*				49.2	111.5	118.7	-161.8	46.3	0	0	0	122.3
289	M	39.5	Very low	35	Very low	161 Å²	161	145.1 Å²	145.1	79%	0.793	75%	0.747	S	S	*	*				-166.2	145.9	115.9	-160.1	55.6	51.6	0	0	110.2
290	K	36.3	Very low	35	Very low	167 Å²	167	142.7 Å²	142.7	73%	0.726	75%	0.754	S	S	*	*			trans	-91.4	132.3	-160.5	-68.7	161	-175.9	152.3	0	117.1
291	D	34.8	Very low	33.9	Very low	139 Å²	139	142 Å²	142	74%	0.743	75%	0.751	S	S	*	*				34.9	128.8	128.2	-48.4	-23.2	0	0	0	119.9
292	E	36.8	Very low	34	Very low	170 Å²	170	142.3 Å²	142.3	79%	0.794	75%	0.746	S	S	*	*				70	154.7	56.3	-68.6	-139.9	166.3	0	0	115.6
293	I	33.7	Very low	34.1	Very low	127 Å²	127	142.5 Å²	142.5	65%	0.651	75%	0.748	S	S	*	*			cis	-165.8	135	-49.4	-114.2	167.5	0	0	0	108.5
294	I	35.8	Very low	34	Very low	160 Å²	160	141.6 Å²	141.6	82%	0.821	75%	0.746	S	S	*	*			trans	67.9	163.6	159	-67.8	173.3	0	0	0	120.3
295	R	34	Very low	33.8	Very low	228 Å²	228	143.2 Å²	143.2	86%	0.86	75%	0.753	S	S	*	*			trans	-64	177.7	-179.4	-51.6	172.6	174.4	143.7	-4.5	113.8
296	P	44.7	Very low	33.5	Very low	112 Å²	112	142 Å²	142	73%	0.727	76%	0.755	S	S	*	*			cis	-151.3	-174.5	19	42.8	-19.9	0	0	0	120.3
297	N	29.3	Very low	33.2	Very low	138 Å²	138	138.3 Å²	138.3	74%	0.738	75%	0.753	S	S	*	*			trans	82.5	123.4	143	-99.2	28	0	0	0	125.5
298	T	28.4	Very low	34.3	Very low	115 Å²	115	135.4 Å²	135.4	71%	0.706	75%	0.75	S	S	*	*			trans	71.4	130.3	135.1	51.6	0	0	0	0	125
299	S	32.5	Very low	35.4	Very low	114 Å²	114	135.6 Å²	135.6	80%	0.797	76%	0.757	S	S	*	*			trans	90.8	116.3	141.9	-61	0	0	0	0	122.8
300	A	30.8	Very low	35	Very low	105 Å²	105	132.5 Å²	132.5	87%	0.868	76%	0.757	S	S	*	*			trans	60.5	157.9	144.4	0	0	0	0	0	120.6
301	S	30.5	Very low	34.7	Very low	89 Å²	89	134.9 Å²	134.9	62%	0.622	76%	0.763	S	S	*	*			cis	-168.1	164.1	-30.7	-169.8	0	0	0	0	109.9
302	F	30.9	Very low	34.6	Very low	162 Å²	162	132.2 Å²	132.2	71%	0.711	76%	0.755	S	S	*	*			trans	73.5	131.1	158.7	-70.2	-63.6	0	0	0	123.1
303	F	30.3	Very low	35.4	Very low	184 Å²	184	129.6 Å²	129.6	81%	0.807	75%	0.753	S	S	*	*			trans	62.9	156.1	149.5	-56.8	-43.7	0	0	0	120.4
304	S	30.1	Very low	35.5	Very low	89 Å²	89	129.4 Å²	129.4	62%	0.622	76%	0.757	S	S	*	*			cis	-177.2	147.5	-36.1	-103.3	0	0	0	0	110.6
305	I	29.7	Very low	35.5	Very low	169 Å²	169	125.7 Å²	125.7	87%	0.867	75%	0.75	S	S	*	*			trans	69.6	148.4	157.2	-63.9	159.5	0	0	0	114.5
306	A	29	Very low	35.5	Very low	93 Å²	93	121.5 Å²	121.5	77%	0.769	75%	0.745	S	S	*	*			cis	-140.6	-170.2	6.7	0	0	0	0	0	113.1
307	A	28.2	Very low	34.7	Very low	89 Å²	89	125.1 Å²	125.1	74%	0.736	75%	0.75	S	S	*	*			trans	-134.3	-153.9	170.2	0	0	0	0	0	109.1
308	P	56.8	Low	34.8	Very low	119 Å²	119	127.1 Å²	127.1	77%	0.773	75%	0.752	S	S	*	*			cis	-121.7	-127.9	-39.3	34.8	-12.6	0	0	0	108.7
309	P	60.8	Low	35.3	Very low	117 Å²	117	126.8 Å²	126.8	76%	0.76	75%	0.752	S	S	*	*			cis	-135.5	168.3	-33.4	37.3	-19.3	0	0	0	117.2
310	A	30.7	Very low	35	Very low	96 Å²	96	130.2 Å²	130.2	79%	0.793	76%	0.758	S	S	*	*			trans	-179.1	115.5	141.9	0	0	0	0	0	109.7
311	Y	31.1	Very low	35.1	Very low	218 Å²	218	134.2 Å²	134.2	86%	0.855	76%	0.758	S	S	*	*				67.9	104.4	76.2	-131.4	-93.7	0	0	0	114.2
312	S	32.4	Very low	35.2	Very low	83 Å²	83	135.2 Å²	135.2	58%	0.58	77%	0.765	S	S	*	*				85.8	126.5	52.5	-168.8	0	0	0	0	113.4
313	P	53.9	Low	35.4	Very low	115 Å²	115	133 Å²	133	75%	0.747	77%	0.768	S	S	*	*				-145	-166.2	99.1	40.9	-24.3	0	0	0	112.5
314	V	35.7	Very low	35.6	Very low	122 Å²	122	130.3 Å²	130.3	74%	0.739	77%	0.768	S	S	*	*			cis	177.8	148.9	-36	158.3	0	0	0	0	103.5
315	A	35.4	Very low	35.7	Very low	82 Å²	82	130.5 Å²	130.5	68%	0.678	78%	0.775	S	S	*	*			cis	-154.1	-166	17.1	0	0	0	0	0	109.4
316	D	34.4	Very low	36	Very low	140 Å²	140	129.1 Å²	129.1	75%	0.749	77%	0.774	S	S	*	*			cis	169.7	122.1	-49.8	-81.5	-39.4	0	0	0	109.2
317	F	27.3	Very low	35.9	Very low	188 Å²	188	131.5 Å²	131.5	83%	0.825	77%	0.774	S	S	*	*			trans	-154.4	93.5	163.6	-145.6	-94.9	0	0	0	115.3
318	F	32.7	Very low	36.2	Very low	180 Å²	180	132.8 Å²	132.8	79%	0.789	78%	0.775	S	S	*	*			trans	59.1	157.8	153.2	-69.8	-81.4	0	0	0	120.9
319	P	37.6	Very low	35	Very low	109 Å²	109	137.5 Å²	137.5	71%	0.708	78%	0.779	S	S	*	*			trans	-123.8	159.6	-140.9	42.3	-31.3	0	0	0	116.2
320	M	27.2	Very low	33.8	Very low	186 Å²	186	137.7 Å²	137.7	92%	0.916	78%	0.778	S	S	*	*			trans	-131.3	154.5	158.4	-78.7	-67.9	-79	0	0	109.8
321	Q	32.6	Very low	33.6	Very low	189 Å²	189	138 Å²	138	88%	0.883	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-69.9	146.8	-169.3	-67.6	169.2	-42	0	0	113.2
322	S	32.3	Very low	33.6	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-75.2	135.4	176.8	39.6	0	0	0	0	112.4
323	P	35.2	Very low	33.6	Very low	116 Å²	116	140.5 Å²	140.5	75%	0.753	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-74.2	139.6	164.1	31.1	-32.4	0	0	0	110
324	P	35.2	Very low	32.5	Very low	126 Å²	126	141.8 Å²	141.8	82%	0.818	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-71.6	165.4	173.1	30.9	-34.8	0	0	0	112
325	A	31.4	Very low	32.3	Very low	93 Å²	93	140.1 Å²	140.1	77%	0.769	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-78.1	132.9	-171.4	0	0	0	0	0	114
326	V	36.8	Very low	32.2	Very low	141 Å²	141	140.6 Å²	140.6	86%	0.855	77%	0.767	S	S	*	*			trans	26.1	94.5	142.9	-165	0	0	0	0	116.9
327	D	26.8	Very low	32.2	Very low	142 Å²	142	139.6 Å²	139.6	76%	0.759	76%	0.761	S	S	*	*			trans	-101.8	130.1	164.6	-122.1	-33.8	0	0	0	110.2	Y329	D327-Y329 VanDerWaalsContact C-N 3.29Å; D327-Y329 PolarHBondContact O-N 3.14Å
328	P	33.6	Very low	32.8	Very low	117 Å²	117	134.8 Å²	134.8	76%	0.76	74%	0.744	S	S	*	*			trans	-84.7	57.7	-170.5	35.1	-37.1	0	0	0	113.2
329	Y	32.8	Very low	33.4	Very low	217 Å²	217	132.3 Å²	132.3	85%	0.851	74%	0.739	S	S	*	*			trans	-121	44.1	-172.1	-130.8	-83	0	0	0	116	D327	D327-Y329 VanDerWaalsContact C-N 3.29Å; D327-Y329 PolarHBondContact O-N 3.14Å
330	T	33.9	Very low	34.4	Very low	121 Å²	121	128.1 Å²	128.1	74%	0.742	71%	0.71	S	S	*	*			trans	-136.2	31.3	174.6	-17.6	0	0	0	0	114.9	Y332	T330-Y332 HydrophobicContact CG2-CE2 4.37Å; T330-Y332 PolarHBondContact O-N 2.7Å
331	S	27.6	Very low	36.1	Very low	104 Å²	104	122 Å²	122	73%	0.727	68%	0.681	S	S	*	*			trans	-84.7	102.9	162.9	-171.6	0	0	0	0	109.6	H333	S331-H333 PolarHBondContact O-N 2.85Å
332	Y	31.8	Very low	37.4	Very low	210 Å²	210	113 Å²	113	82%	0.824	64%	0.639	S	S	*	*			trans	-69.6	99.1	172.7	-90.4	-88.3	0	0	0	109.6	T330 M334	T330-Y332 HydrophobicContact CG2-CE2 4.37Å; T330-Y332 PolarHBondContact O-N 2.7Å; Y332-M334 PolarHBondContact O-N 2.75Å
333	H	32.4	Very low	38.9	Very low	143 Å²	143	109.6 Å²	109.6	66%	0.662	61%	0.61	S	S	*	*			trans	-73.3	91.5	-166.8	-151.6	-85.2	0	0	0	111.9	S331 S335	S331-H333 PolarHBondContact O-N 2.85Å; H333-S335 PolarHBondContact CE1-OG 3.01Å; H333-S335 VanDerWaalsContact CE1-OG 3.27Å; H333-S335 PolarHBondContact ND1-OG 3.11Å; H333-S335 PolarHBondContact O-N 3.29Å
334	M	30.4	Very low	39.7	Very low	142 Å²	142	108 Å²	108	70%	0.7	60%	0.598	S	S	*	*	G	3₁₀ helix	trans	-65	-3.2	-175.8	-76.8	-106.8	60.2	0	0	115.5	Y332 S336 L337	Y332-M334 PolarHBondContact O-N 2.75Å; M334-S336 PolarHBondContact O-N 2.97Å; M334-S336 VanDerWaalsContact O-N 3.11Å; M334-L337 HydrophobicContact CE-CD1 3.59Å; M334-L337 HydrophobicContact CE-CG 4.45Å
335	S	31.6	Very low	40.2	Very low	86 Å²	86	107.3 Å²	107.3	60%	0.601	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-74.6	12	-179.2	-42.3	0	0	0	0	115.6	H333	H333-S335 PolarHBondContact CE1-OG 3.01Å; H333-S335 VanDerWaalsContact CE1-OG 3.27Å; H333-S335 PolarHBondContact ND1-OG 3.11Å; H333-S335 PolarHBondContact O-N 3.29Å
336	S	33.4	Very low	40.7	Very low	92 Å²	92	115.2 Å²	115.2	64%	0.643	59%	0.594	S	S	*	*	G	3₁₀ helix	trans	-98.5	14.3	-178.1	-170.6	0	0	0	0	113.6	M334	M334-S336 PolarHBondContact O-N 2.97Å; M334-S336 VanDerWaalsContact O-N 3.11Å
337	L	33.9	Very low	40.6	Very low	119 Å²	119	111.5 Å²	111.5	62%	0.623	58%	0.584	S	S	*	*	S	Bend	trans	-113.1	7.4	-175.6	-70.8	179.1	0	0	0	114.5	M334	M334-L337 HydrophobicContact CE-CD1 3.59Å; M334-L337 HydrophobicContact CE-CG 4.45Å
338	D	40.1	Very low	40.8	Very low	88 Å²	88	108.4 Å²	108.4	47%	0.471	59%	0.586	S	S	.	*			trans	-97.1	-3.8	177.5	-76.4	-65.3	0	0	0	114.3	R90 I340	R90-D338 IonicContact CZ-OD1 3.83Å; R90-D338 IonicContact NH1-OD1 3.53Å; R90-D338 PolarHBondContact NH1-OD1 3.36Å; R90-D338 IonicContact NH2-OD1 2.71Å; R90-D338 PolarHBondContact NH2-OD1 3.15Å; D338-I340 VanDerWaalsContact C-N 3.32Å; D338-I340 PolarHBondContact O-N 3.26Å
339	D	45.3	Very low	40.8	Very low	128 Å²	128	110 Å²	110	68%	0.684	59%	0.594	S	S	*	*	S	Bend	trans	-67.4	92.3	156.2	-78.5	-47.7	0	0	0	109	D341	D339-D341 PolarHBondContact O-N 3.14Å
340	I	57.4	Low	40.8	Very low	21 Å²	21	102.8 Å²	102.8	11%	0.108	59%	0.585	C	S	.	*			trans	-73.2	75.9	179.8	-65.6	173.3	0	0	0	109.4	T94 P120 D338 L342	T94-I340 HydrophobicContact CG2-CG2 4.09Å; P120-I340 HydrophobicContact CB-CG2 3.86Å; P120-I340 HydrophobicContact CG-CG2 4.23Å; D338-I340 VanDerWaalsContact C-N 3.32Å; D338-I340 PolarHBondContact O-N 3.26Å; I340-L342 HydrophobicContact CG2-CD1 4.06Å; I340-L342 HydrophobicContact CG2-CG 4.07Å; I340-L342 PolarHBondContact O-N 3.47Å
341	D	62.7	Low	40.8	Very low	57 Å²	57	104.1 Å²	104.1	31%	0.305	59%	0.593	S	S	.	*			trans	-77.9	84.2	179.5	-168.2	0.7	0	0	0	112	P120 D339 Y343 T344	P120-D341 WeakPolarHBondContact CD-O 3.48Å; P120-D341 WeakPolarHBondContact CG-O 3.26Å; D339-D341 PolarHBondContact O-N 3.14Å; D341-Y343 PolarHBondContact OD1-N 2.81Å; D341-T344 PolarHBondContact OD1-N 2.97Å; D341-T344 PolarHBondContact OD1-OG1 2.85Å; D341-T344 VanDerWaalsContact OD1-OG1 3.05Å; D341-T344 WeakPolarHBondContact OD2-CB 3.44Å; D341-T344 PolarHBondContact OD2-OG1 2.85Å
342	L	61.5	Low	40.9	Very low	1 Å²	1	103 Å²	103	1%	0.005	60%	0.598	C	S	.	*	S	Bend	trans	-79.3	0.2	169.6	-72.9	159	0	0	0	113.2	T94 I98 T118 P120 I340	T94-L342 HydrophobicContact CG2-CD1 3.88Å; T94-L342 HydrophobicContact CG2-CD2 4.11Å; T94-L342 HydrophobicContact CG2-CG 4.36Å; I98-L342 HydrophobicContact CD1-CD1 3.8Å; I98-L342 HydrophobicContact CG1-CD1 3.54Å; T118-L342 WeakPolarHBondContact CG2-O 3.4Å; T118-L342 PolarHBondContact OG1-O 2.89Å; P120-L342 HydrophobicContact CB-CD2 3.8Å; P120-L342 HydrophobicContact CB-CG 4.03Å; I340-L342 HydrophobicContact CG2-CD1 4.06Å; I340-L342 HydrophobicContact CG2-CG 4.07Å; I340-L342 PolarHBondContact O-N 3.47Å
343	Y	63.1	Low	40.8	Very low	37 Å²	37	96.9 Å²	96.9	15%	0.145	60%	0.599	C	S	.	*	S	Bend	trans	-130.6	-36.7	-147.8	-63.1	-61.3	0	0	0	114.6	N101 E110 F111 I114 D341	N101-Y343 WeakPolarHBondContact ND2-CE2 3.48Å; E110-Y343 HydrophobicContact CB-CD1 4.2Å; E110-Y343 HydrophobicContact CB-CG 4.42Å; E110-Y343 WeakPolarHBondContact O-CD1 3.47Å; F111-Y343 AromaticContact CD1-CD1 3.75Å; F111-Y343 HydrophobicContact CD1-CD1 3.75Å; F111-Y343 HydrophobicContact CD1-CD2 4.11Å; F111-Y343 AromaticContact CD1-CE1 3.46Å; F111-Y343 HydrophobicContact CD1-CE1 3.46Å; F111-Y343 VanDerWaalsContact CD1-CE1 3.46Å; F111-Y343 AromaticContact CD1-CE2 3.84Å; F111-Y343 HydrophobicContact CD1-CE2 3.84Å; F111-Y343 HydrophobicContact CD1-CG 4.06Å; F111-Y343 AromaticContact CD1-CZ 3.5Å; F111-Y343 HydrophobicContact CE1-CD1 4.05Å; F111-Y343 AromaticContact CE1-CD2 3.61Å; F111-Y343 HydrophobicContact CE1-CD2 3.61Å; F111-Y343 AromaticContact CE1-CE1 4Å; F111-Y343 HydrophobicContact CE1-CE1 4Å; F111-Y343 AromaticContact CE1-CE2 3.53Å; F111-Y343 HydrophobicContact CE1-CE2 3.53Å; F111-Y343 AromaticContact CE1-CG 3.87Å; F111-Y343 HydrophobicContact CE1-CG 3.87Å; F111-Y343 AromaticContact CE1-CZ 3.74Å; I114-Y343 HydrophobicContact CG1-CE1 4.18Å; D341-Y343 PolarHBondContact OD1-N 2.81Å
344	T	52.7	Low	40.6	Very low	83 Å²	83	102.2 Å²	102.2	51%	0.509	61%	0.613	S	S	.	*			trans	-86.8	140.6	178	-28.6	0	0	0	0	111	D341	D341-T344 PolarHBondContact OD1-N 2.97Å; D341-T344 PolarHBondContact OD1-OG1 2.85Å; D341-T344 VanDerWaalsContact OD1-OG1 3.05Å; D341-T344 WeakPolarHBondContact OD2-CB 3.44Å; D341-T344 PolarHBondContact OD2-OG1 2.85Å
345	E	45.7	Very low	40.7	Very low	112 Å²	112	103.7 Å²	103.7	52%	0.523	62%	0.618	S	S	.	*			trans	-82	150.2	159	-74.2	-172.5	176.1	0	0	110	K115 G347	K115-E345 VanDerWaalsContact NZ-CD 3.34Å; K115-E345 IonicContact NZ-OE1 2.7Å; K115-E345 PolarHBondContact NZ-OE1 3.4Å; E345-G347 PolarHBondContact O-N 2.99Å
346	R	40.9	Very low	40.3	Very low	258 Å²	258	105.8 Å²	105.8	97%	0.974	63%	0.627	S	S	*	*			trans	-74.3	63.9	172.2	-161.4	-174.3	-166.3	-160.1	4.9	111.2	G348	R346-G348 PolarHBondContact O-N 3.38Å
347	G	35.2	Very low	40.5	Very low	63 Å²	63	107.4 Å²	107.4	65%	0.649	64%	0.636	S	S	*	*			trans	-57.5	119.3	171.8	0	0	0	0	0	109.8	E345 V349	E345-G347 PolarHBondContact O-N 2.99Å; G347-V349 PolarHBondContact O-N 2.94Å
348	G	30.8	Very low	40.3	Very low	78 Å²	78	107.2 Å²	107.2	80%	0.804	65%	0.645	S	S	*	*			trans	-65	131.9	-176.8	0	0	0	0	0	111.9	R346 G350	R346-G348 PolarHBondContact O-N 3.38Å; G348-G350 PolarHBondContact O-N 2.76Å; G348-G350 VanDerWaalsContact O-N 3.15Å
349	V	34.1	Very low	39.6	Very low	151 Å²	151	114.7 Å²	114.7	92%	0.915	67%	0.666	S	S	*	*			trans	-69	111.4	176	177.9	0	0	0	0	109.9	G347	G347-V349 PolarHBondContact O-N 2.94Å
350	G	33.3	Very low	39.1	Very low	65 Å²	65	113.7 Å²	113.7	67%	0.67	67%	0.667	S	S	*	*			trans	54.4	92.7	149.6	0	0	0	0	0	118.9	G348	G348-G350 PolarHBondContact O-N 2.76Å; G348-G350 VanDerWaalsContact O-N 3.15Å
351	T	32.5	Very low	38.2	Very low	148 Å²	148	119 Å²	119	91%	0.908	70%	0.702	S	S	*	*			trans	-127.9	142.5	141.9	36.1	0	0	0	0	109.9
352	G	30.1	Very low	36.4	Very low	81 Å²	81	122.1 Å²	122.1	84%	0.835	73%	0.729	S	S	*	*			trans	-77.9	150.9	-162.7	0	0	0	0	0	115.5
353	G	29.1	Very low	35	Very low	81 Å²	81	133.2 Å²	133.2	84%	0.835	77%	0.77	S	S	*	*			trans	-65.2	167.2	-168.9	0	0	0	0	0	118.8
354	R	29.7	Very low	33.6	Very low	255 Å²	255	139.2 Å²	139.2	96%	0.962	80%	0.8	S	S	*	*			trans	-141.6	161.4	153.6	-101.9	166.5	-172.8	-96.5	-2.7	108.9
355	Q	30.8	Very low	32.9	Very low	174 Å²	174	141.4 Å²	141.4	81%	0.813	82%	0.816	S	S	*	*			trans	-106.8	143.7	-158.7	-62.7	174.8	-3.6	0	0	113.7
356	T	24.6	Very low	32.5	Very low	129 Å²	129	146 Å²	146	79%	0.791	83%	0.828	S	S	*	*			trans	64.4	169.7	146.6	55.1	0	0	0	0	118.3
357	P	38.1	Very low	32	Very low	127 Å²	127	140.8 Å²	140.8	83%	0.825	82%	0.82	S	S	*	*			cis	-121.1	-176.4	-0.6	34.9	-16	0	0	0	115.5
358	S	29.6	Very low	31.6	Very low	115 Å²	115	142.8 Å²	142.8	80%	0.804	83%	0.83	S	S	*	*			trans	-106.3	162.3	-168.3	51.1	0	0	0	0	114.9
359	R	25.4	Very low	31.9	Very low	245 Å²	245	149.8 Å²	149.8	93%	0.925	83%	0.832	S	S	*	*			trans	-150.9	165.2	158.4	-107.2	-152	146.8	171.8	-6.2	110.7
360	P	34.4	Very low	31.7	Very low	107 Å²	107	149.4 Å²	149.4	70%	0.695	83%	0.825	S	S	*	*			trans	-108.7	170.2	-140.4	6.8	17.4	0	0	0	115
361	P	37.2	Very low	31.7	Very low	131 Å²	131	149.5 Å²	149.5	85%	0.851	83%	0.826	S	S	*	*			trans	-75.1	154.3	178.6	32.3	-36.4	0	0	0	113.1
362	S	26.5	Very low	31.5	Very low	124 Å²	124	153.7 Å²	153.7	87%	0.867	83%	0.825	S	S	*	*			trans	-124.5	139.9	170.5	-173.1	0	0	0	0	111.3
363	R	30.8	Very low	32	Very low	233 Å²	233	158 Å²	158	88%	0.879	83%	0.828	S	S	*	*			trans	-62.3	154.8	-173.5	-60.1	167.1	160.5	144.4	-8.4	114.2
364	E	35	Very low	32.3	Very low	164 Å²	164	161.5 Å²	161.5	77%	0.766	83%	0.827	S	S	*	*			trans	-62.3	164.3	149.3	-57.6	-172.6	142.2	0	0	110.7
365	P	38.1	Very low	32.3	Very low	129 Å²	129	158.9 Å²	158.9	84%	0.838	82%	0.823	S	S	*	*				-136.4	175.4	97.8	38.2	-27.6	0	0	0	114.3
366	R	36.6	Very low	32.3	Very low	207 Å²	207	154.5 Å²	154.5	78%	0.781	82%	0.817	S	S	*	*			trans	-82.4	174.2	-177	-164.7	174.1	-71.3	-139.4	-5.7	112.4
367	D	30.4	Very low	32.9	Very low	149 Å²	149	157.4 Å²	157.4	80%	0.797	82%	0.821	S	S	*	*			trans	84	96.1	163.1	-59.4	-47.2	0	0	0	118.3
368	A	26.8	Very low	33.1	Very low	105 Å²	105	154 Å²	154	87%	0.868	81%	0.809	S	S	*	*			trans	-146.8	112.5	143.1	0	0	0	0	0	108.6
369	R	36.5	Very low	34.6	Very low	225 Å²	225	153.2 Å²	153.2	85%	0.849	80%	0.804	S	S	*	*			trans	-90.5	158.6	168.6	-157.2	-167.5	-72.4	-113.6	-1.2	108.8
370	D	30.2	Very low	36.8	Very low	144 Å²	144	145.4 Å²	145.4	77%	0.77	78%	0.783	S	S	*	*			trans	88.7	141.5	164.7	-51.1	-31.4	0	0	0	118.7
371	G	33.9	Very low	39.1	Very low	67 Å²	67	146.5 Å²	146.5	69%	0.691	78%	0.777	S	S	*	*				101.1	37.4	130	0	0	0	0	0	120.8
372	W	28.2	Very low	41.3	Very low	235 Å²	235	140.4 Å²	140.4	89%	0.89	74%	0.737	S	S	*	*			trans	-121.3	97.6	165.7	-75.5	88.3	0	0	0	113.8	L374	W372-L374 PolarHBondContact O-N 3.31Å; W372-L374 VanDerWaalsContact O-N 3.13Å
373	L	40.4	Very low	43.9	Very low	171 Å²	171	140.2 Å²	140.2	90%	0.895	72%	0.722	S	S	*	*			trans	-65.6	104.4	162.8	-86.2	74.9	0	0	0	108.9	K375	L373-K375 PolarHBondContact O-N 2.9Å
374	L	34.5	Very low	46.3	Very low	156 Å²	156	130.9 Å²	130.9	82%	0.817	70%	0.699	S	S	*	*			trans	-79.2	118.1	174.8	-135.2	74.3	0	0	0	110.8	W372 A376	W372-L374 PolarHBondContact O-N 3.31Å; W372-L374 VanDerWaalsContact O-N 3.13Å; L374-A376 PolarHBondContact O-N 3.4Å
375	K	31	Very low	48.6	Very low	199 Å²	199	125.9 Å²	125.9	87%	0.865	68%	0.681	S	S	*	*			trans	-68.5	94	-173.8	-163.8	171.1	-174.7	174.3	0	110.9	L373 H377	L373-K375 PolarHBondContact O-N 2.9Å; K375-H377 PolarHBondContact O-N 3.47Å
376	A	31.1	Very low	50.4	Low	83 Å²	83	121.9 Å²	121.9	69%	0.686	66%	0.664	S	S	*	*			trans	-77.1	107.6	-164.8	0	0	0	0	0	114.6	L374	L374-A376 PolarHBondContact O-N 3.4Å
377	H	37	Very low	52.5	Low	189 Å²	189	117.4 Å²	117.4	88%	0.875	66%	0.655	S	S	*	*			trans	-134.5	43.4	160.5	-73.6	-56.8	0	0	0	112.6	K375	K375-H377 PolarHBondContact O-N 3.47Å
378	G	42.2	Very low	54.7	Low	57 Å²	57	112.7 Å²	112.7	59%	0.588	64%	0.642	S	S	*	*	S	Bend	trans	-110.4	128.2	157.4	0	0	0	0	0	108.8	V380	G378-V380 PolarHBondContact O-N 3.09Å
379	S	59.9	Low	57.1	Low	98 Å²	98	109.6 Å²	109.6	69%	0.685	61%	0.613	S	S	*	*			trans	-72.8	92.7	175.9	-178.6	0	0	0	0	109.4	K381	S379-K381 PolarHBondContact O-N 3.37Å
380	V	71.4	Confident	58.7	Low	81 Å²	81	105.1 Å²	105.1	49%	0.491	62%	0.616	S	S	.	*			trans	-63.2	128.5	171.1	-177.5	0	0	0	0	107.9	G378 I401	G378-V380 PolarHBondContact O-N 3.09Å; V380-I401 HydrophobicContact CG1-CD1 4.09Å; V380-I401 HydrophobicContact CG1-CG2 3.91Å
381	K	83.9	Confident	60.7	Low	130 Å²	130	101.9 Å²	101.9	57%	0.565	60%	0.602	S	S	*	*			trans	-106	144.1	-179.2	-67.6	174.2	173.6	-169.9	0	109.6	S379 Q383 G386 L387	S379-K381 PolarHBondContact O-N 3.37Å; K381-Q383 PolarHBondContact O-N 2.92Å; K381-G386 WeakPolarHBondContact CD-O 3.41Å; K381-L387 CarbonylContact C-O 3.59Å; K381-L387 WeakPolarHBondContact CA-O 3.34Å
382	C	82.4	Confident	63	Low	2 Å²	2	101.3 Å²	101.3	1%	0.014	58%	0.582	C	S	.	*			trans	-56.4	123.7	171.1	-177	0	0	0	0	110	G384 C385 G386 L387 M392 C403 C406	C382-G384 PolarHBondContact O-N 3.21Å; C382-G384 PolarHBondContact SG-N 3.04Å; C382-G384 VanDerWaalsContact SG-N 3.4Å; C382-C385 WeakPolarHBondContact CB-SG 3.44Å; C382-C385 VanDerWaalsContact SG-SG 3.63Å; C382-G386 VanDerWaalsContact O-CA 3.27Å; C382-G386 WeakPolarHBondContact O-CA 3.4Å; C382-G386 PolarHBondContact O-N 3.36Å; C382-L387 PolarHBondContact N-O 3.27Å; C382-M392 HydrophobicContact CB-CE 3.77Å; C382-C403 HydrophobicContact CB-CB 4.49Å; C382-C403 PolarHBondContact SG-N 3.42Å; C382-C403 VanDerWaalsContact SG-N 3.36Å; C382-C403 VanDerWaalsContact SG-SG 3.62Å; C382-C406 VanDerWaalsContact SG-SG 3.65Å
383	Q	82.5	Confident	65.4	Low	120 Å²	120	93.6 Å²	93.6	56%	0.561	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-9.6	177.8	-68.8	175	-30	0	0	112.8	K381 M400 I401 L402	K381-Q383 PolarHBondContact O-N 2.92Å; Q383-M400 HydrophobicContact CB-CE 4.48Å; Q383-M400 HydrophobicContact CB-CG 4.04Å; Q383-I401 PolarHBondContact N-O 3.41Å; Q383-L402 HydrophobicContact CB-CD2 4.4Å
384	G	79.6	Confident	67.3	Low	38 Å²	38	88 Å²	88	39%	0.392	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-41.6	174.6	0	0	0	0	0	114.5	C382	C382-G384 PolarHBondContact O-N 3.21Å; C382-G384 PolarHBondContact SG-N 3.04Å; C382-G384 VanDerWaalsContact SG-N 3.4Å
385	C	83.6	Confident	69.4	Low	58 Å²	58	80.9 Å²	80.9	39%	0.392	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-3	-177	68.7	0	0	0	0	115.3	C382 L387	C382-C385 WeakPolarHBondContact CB-SG 3.44Å; C382-C385 VanDerWaalsContact SG-SG 3.63Å; C385-L387 PolarHBondContact O-N 3.13Å; C385-L387 VanDerWaalsContact O-N 3.11Å
386	G	76.3	Confident	71.5	Confident	45 Å²	45	79.3 Å²	79.3	46%	0.464	50%	0.495	S	S	.	.			trans	71.9	-3.5	178	0	0	0	0	0	115.9	K381 C382	K381-G386 WeakPolarHBondContact CD-O 3.41Å; C382-G386 VanDerWaalsContact O-CA 3.27Å; C382-G386 WeakPolarHBondContact O-CA 3.4Å; C382-G386 PolarHBondContact O-N 3.36Å
387	L	80.8	Confident	73.5	Confident	113 Å²	113	84.6 Å²	84.6	59%	0.592	50%	0.497	S	S	*	.	S	Bend	trans	-87.5	152.4	179.6	-57.6	-179.4	0	0	0	111.8	K381 C382 C385 C389	K381-L387 CarbonylContact C-O 3.59Å; K381-L387 WeakPolarHBondContact CA-O 3.34Å; C382-L387 PolarHBondContact N-O 3.27Å; C385-L387 PolarHBondContact O-N 3.13Å; C385-L387 VanDerWaalsContact O-N 3.11Å; L387-C389 PolarHBondContact O-N 2.95Å
388	G	76.1	Confident	75.4	Confident	51 Å²	51	78.4 Å²	78.4	53%	0.526	47%	0.474	S	S	.	.			trans	-78.4	114.8	165.6	0	0	0	0	0	109.4
389	C	77.3	Confident	77.2	Confident	39 Å²	39	81.3 Å²	81.3	26%	0.264	48%	0.476	S	S	.	.			trans	-107.4	151.4	-178.6	-61.9	0	0	0	0	110.9	L387 M392 C403	L387-C389 PolarHBondContact O-N 2.95Å; C389-M392 HydrophobicContact CB-CE 4.06Å; C389-M392 HydrophobicContact CB-SD 4.14Å; C389-M392 WeakPolarHBondContact O-CG 3.47Å; C389-C403 HydrophobicContact CB-CB 3.6Å
390	S	70.9	Confident	78.1	Confident	131 Å²	131	79 Å²	79	92%	0.916	46%	0.455	S	S	*	.	S	Bend	trans	-70.9	-30.6	179	46	0	0	0	0	113.4
391	T	72.1	Confident	78.7	Confident	77 Å²	77	77.6 Å²	77.6	47%	0.472	45%	0.445	S	S	.	.	S	Bend	trans	-111.6	124	171.1	54	0	0	0	0	109.9	C403 S404	T391-C403 WeakPolarHBondContact O-CA 3.39Å; T391-C403 WeakPolarHBondContact O-CB 3.22Å; T391-S404 PolarHBondContact OG1-OG 3.08Å
392	M	81.4	Confident	78.8	Confident	54 Å²	54	71.4 Å²	71.4	27%	0.266	42%	0.418	S	S	.	.			trans	-135.8	129.5	-178.3	-58.8	-95.4	52.9	0	0	108.4	C382 C389 I401 L402 C403	C382-M392 HydrophobicContact CB-CE 3.77Å; C389-M392 HydrophobicContact CB-CE 4.06Å; C389-M392 HydrophobicContact CB-SD 4.14Å; C389-M392 WeakPolarHBondContact O-CG 3.47Å; M392-I401 HydrophobicContact CB-CG2 4.14Å; M392-I401 HydrophobicContact CE-CG2 4.4Å; M392-L402 WeakPolarHBondContact CA-O 3.25Å; M392-L402 VanDerWaalsContact CE-O 3.31Å; M392-L402 WeakPolarHBondContact CE-O 3.34Å; M392-C403 HydrophobicContact CE-CB 3.66Å
393	T	78.6	Confident	79	Confident	74 Å²	74	71.8 Å²	71.8	45%	0.454	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	140.5	179.6	45.4	0	0	0	0	110.5	I401 L402	T393-I401 WeakPolarHBondContact O-CA 3.16Å; T393-L402 PolarHBondContact N-O 2.95Å; T393-L402 PolarHBondContact O-N 2.78Å
394	S	80.4	Confident	78.9	Confident	52 Å²	52	68.2 Å²	68.2	36%	0.364	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	127.6	169.7	49.1	0	0	0	0	110.1	Q396	S394-Q396 PolarHBondContact O-N 3.31Å; S394-Q396 PolarHBondContact O-NE2 2.88Å
395	C	79.1	Confident	79	Confident	8 Å²	8	70 Å²	70	5%	0.054	42%	0.419	C	S	.	.			trans	-68	116.5	175.7	-173.9	0	0	0	0	110	R397 C398 D399 M400 C414	C395-R397 PolarHBondContact O-N 3.18Å; C395-C398 PolarHBondContact O-N 2.93Å; C395-D399 WeakPolarHBondContact O-CA 3.45Å; C395-D399 PolarHBondContact O-N 3.49Å; C395-M400 PolarHBondContact N-O 3.36Å; C395-C414 HydrophobicContact CB-CB 4.02Å
396	Q	75.1	Confident	78.8	Confident	166 Å²	166	67.9 Å²	67.9	78%	0.776	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	5.6	-173.7	-56	-63.4	-70.5	0	0	115.1	S394	S394-Q396 PolarHBondContact O-N 3.31Å; S394-Q396 PolarHBondContact O-NE2 2.88Å
397	R	72.6	Confident	79	Confident	194 Å²	194	69 Å²	69	73%	0.732	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	-17	176.3	-70.2	179.9	172.9	179.5	-3.3	114	C395	C395-R397 PolarHBondContact O-N 3.18Å
398	C	78	Confident	78.7	Confident	58 Å²	58	69.2 Å²	69.2	39%	0.392	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-157.7	10.3	-172.6	62.3	0	0	0	0	114.6	C395 M400 C414	C395-C398 PolarHBondContact O-N 2.93Å; C398-M400 PolarHBondContact O-N 2.87Å; C398-C414 PolarHBondContact SG-O 2.94Å
399	D	78.9	Confident	78.7	Confident	119 Å²	119	71.3 Å²	71.3	64%	0.636	40%	0.398	S	S	*	.			trans	54.6	7.2	-179.7	-63.5	-49.9	0	0	0	117	C395 I401	C395-D399 WeakPolarHBondContact O-CA 3.45Å; C395-D399 PolarHBondContact O-N 3.49Å; D399-I401 PolarHBondContact O-N 3.02Å
400	M	79.3	Confident	78	Confident	48 Å²	48	76.5 Å²	76.5	24%	0.236	42%	0.423	C	S	.	.			trans	-66.3	125.9	-179.3	-152.4	168.4	108.2	0	0	110.6	Q383 C395 C398 L402 P413 C414	Q383-M400 HydrophobicContact CB-CE 4.48Å; Q383-M400 HydrophobicContact CB-CG 4.04Å; C395-M400 PolarHBondContact N-O 3.36Å; C398-M400 PolarHBondContact O-N 2.87Å; M400-L402 HydrophobicContact CE-CD1 4.33Å; M400-L402 HydrophobicContact CE-CD2 3.74Å; M400-L402 HydrophobicContact CE-CG 4.24Å; M400-L402 PolarHBondContact O-N 3.23Å; M400-P413 HydrophobicContact CE-CB 4.1Å; M400-P413 WeakPolarHBondContact CE-O 3.2Å; M400-C414 HydrophobicContact CB-CB 3.94Å; M400-C414 HydrophobicContact CE-CB 3.98Å; M400-C414 HydrophobicContact SD-CB 4.21Å
401	I	84.8	Confident	77.5	Confident	53 Å²	53	73.9 Å²	73.9	27%	0.272	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	104.1	-174.5	-54.1	176.6	0	0	0	109.3	V380 Q383 M392 T393 D399	V380-I401 HydrophobicContact CG1-CD1 4.09Å; V380-I401 HydrophobicContact CG1-CG2 3.91Å; Q383-I401 PolarHBondContact N-O 3.41Å; M392-I401 HydrophobicContact CB-CG2 4.14Å; M392-I401 HydrophobicContact CE-CG2 4.4Å; T393-I401 WeakPolarHBondContact O-CA 3.16Å; D399-I401 PolarHBondContact O-N 3.02Å
402	L	84.6	Confident	77.3	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	157.5	178.4	-67	-170.5	0	0	0	111.4	Q383 M392 T393 M400 C406 H407 C414	Q383-L402 HydrophobicContact CB-CD2 4.4Å; M392-L402 WeakPolarHBondContact CA-O 3.25Å; M392-L402 VanDerWaalsContact CE-O 3.31Å; M392-L402 WeakPolarHBondContact CE-O 3.34Å; T393-L402 PolarHBondContact N-O 2.95Å; T393-L402 PolarHBondContact O-N 2.78Å; M400-L402 HydrophobicContact CE-CD1 4.33Å; M400-L402 HydrophobicContact CE-CD2 3.74Å; M400-L402 HydrophobicContact CE-CG 4.24Å; M400-L402 PolarHBondContact O-N 3.23Å; L402-C406 HydrophobicContact CB-CB 4.28Å; L402-C406 HydrophobicContact CD1-CB 4.3Å; L402-C406 HydrophobicContact CD2-CB 4.18Å; L402-H407 HydrophobicContact CB-CB 4.15Å; L402-H407 HydrophobicContact CD1-CB 4.26Å; L402-C414 HydrophobicContact CD1-CB 3.73Å; L402-C414 WeakPolarHBondContact CD1-SG 3.33Å; L402-C414 HydrophobicContact CG-CB 4.39Å
403	C	86.7	Confident	76.6	Confident	10 Å²	10	72 Å²	72	7%	0.068	40%	0.397	C	S	.	.			trans	-81.7	158.1	160.8	63.3	0	0	0	0	109.2	C382 C389 T391 M392 A405 C406 H407	C382-C403 HydrophobicContact CB-CB 4.49Å; C382-C403 PolarHBondContact SG-N 3.42Å; C382-C403 VanDerWaalsContact SG-N 3.36Å; C382-C403 VanDerWaalsContact SG-SG 3.62Å; C389-C403 HydrophobicContact CB-CB 3.6Å; T391-C403 WeakPolarHBondContact O-CA 3.39Å; T391-C403 WeakPolarHBondContact O-CB 3.22Å; M392-C403 HydrophobicContact CE-CB 3.66Å; C403-A405 VanDerWaalsContact C-N 3.28Å; C403-A405 PolarHBondContact O-N 2.97Å; C403-C406 PolarHBondContact O-N 3.01Å; C403-H407 PolarHBondContact O-N 3.33Å
404	S	81.2	Confident	76.3	Confident	45 Å²	45	69.2 Å²	69.2	32%	0.315	38%	0.38	S	S	.	.	H	α-helix	trans	-48.3	-51.7	178	-42.9	0	0	0	0	111	T391 C406 H407 D408	T391-S404 PolarHBondContact OG1-OG 3.08Å; S404-C406 PolarHBondContact O-N 2.93Å; S404-H407 PolarHBondContact O-N 2.94Å; S404-D408 VanDerWaalsContact C-OD2 3.3Å; S404-D408 WeakPolarHBondContact O-CB 3.29Å; S404-D408 PolarHBondContact O-N 3.43Å
405	A	80.5	Confident	75.9	Confident	75 Å²	75	68.4 Å²	68.4	62%	0.62	37%	0.374	S	S	*	.	H	α-helix	trans	-62.2	-14.9	178.6	0	0	0	0	0	116	C403 I409	C403-A405 VanDerWaalsContact C-N 3.28Å; C403-A405 PolarHBondContact O-N 2.97Å; A405-I409 VanDerWaalsContact O-CD1 3.31Å; A405-I409 WeakPolarHBondContact O-CD1 3.45Å; A405-I409 WeakPolarHBondContact O-CG1 3.34Å
406	C	80.7	Confident	74.6	Confident	14 Å²	14	70.8 Å²	70.8	10%	0.095	40%	0.4	C	S	.	.	H	α-helix	trans	-97.7	-27	168.9	-74.9	0	0	0	0	112.8	C382 L402 C403 S404 P413	C382-C406 VanDerWaalsContact SG-SG 3.65Å; L402-C406 HydrophobicContact CB-CB 4.28Å; L402-C406 HydrophobicContact CD1-CB 4.3Å; L402-C406 HydrophobicContact CD2-CB 4.18Å; C403-C406 PolarHBondContact O-N 3.01Å; S404-C406 PolarHBondContact O-N 2.93Å; C406-P413 WeakPolarHBondContact O-CD 3.42Å
407	H	79.4	Confident	73	Confident	68 Å²	68	69.3 Å²	69.3	32%	0.315	40%	0.397	S	S	.	.	H	α-helix	trans	-77.2	-34.3	177.6	-176.5	-86.6	0	0	0	112	L402 C403 S404 I409	L402-H407 HydrophobicContact CB-CB 4.15Å; L402-H407 HydrophobicContact CD1-CB 4.26Å; C403-H407 PolarHBondContact O-N 3.33Å; S404-H407 PolarHBondContact O-N 2.94Å; H407-I409 VanDerWaalsContact C-N 3.31Å; H407-I409 PolarHBondContact O-N 3.49Å
408	D	74.3	Confident	71.4	Confident	117 Å²	117	68.2 Å²	68.2	63%	0.626	40%	0.4	S	S	*	.	S	Bend	trans	-89.2	6.5	-174	-51.9	-29.4	0	0	0	113	S404	S404-D408 VanDerWaalsContact C-OD2 3.3Å; S404-D408 WeakPolarHBondContact O-CB 3.29Å; S404-D408 PolarHBondContact O-N 3.43Å
409	I	76.1	Confident	69.4	Low	95 Å²	95	72 Å²	72	49%	0.487	42%	0.416	S	S	.	.	S	Bend	trans	-80.6	134.1	165.9	-68.2	169.9	0	0	0	108.1	A405 H407 P411 S412	A405-I409 VanDerWaalsContact O-CD1 3.31Å; A405-I409 WeakPolarHBondContact O-CD1 3.45Å; A405-I409 WeakPolarHBondContact O-CG1 3.34Å; H407-I409 VanDerWaalsContact C-N 3.31Å; H407-I409 PolarHBondContact O-N 3.49Å; I409-P411 CarbonylContact O-C 3.53Å; I409-P411 VanDerWaalsContact O-C 3.27Å; I409-S412 WeakPolarHBondContact O-CA 3.35Å; I409-S412 WeakPolarHBondContact O-CB 3.32Å; I409-S412 PolarHBondContact O-N 3.45Å
410	D	63.3	Low	67.3	Low	149 Å²	149	76.8 Å²	76.8	80%	0.797	43%	0.427	S	S	*	.	S	Bend	trans	-108.9	124.7	173.4	-170.6	24.2	0	0	0	110.2
411	P	61.5	Low	64.9	Low	76 Å²	76	82.4 Å²	82.4	49%	0.494	45%	0.452	S	S	.	.	S	Bend	cis	-73.3	138	-5.8	31.2	-34.9	0	0	0	112.9	I409 L417	I409-P411 CarbonylContact O-C 3.53Å; I409-P411 VanDerWaalsContact O-C 3.27Å; P411-L417 HydrophobicContact CB-CD1 4.11Å
412	S	66.3	Low	62.6	Low	20 Å²	20	84.7 Å²	84.7	14%	0.14	47%	0.473	C	S	.	.	B	Isolated β-bridge	trans	-67.7	140	-176.7	73.3	0	0	0	0	112	I409 C414 C415	I409-S412 WeakPolarHBondContact O-CA 3.35Å; I409-S412 WeakPolarHBondContact O-CB 3.32Å; I409-S412 PolarHBondContact O-N 3.45Å; S412-C414 PolarHBondContact O-N 3.33Å; S412-C414 VanDerWaalsContact O-N 3.09Å; S412-C414 PolarHBondContact OG-SG 2.86Å; S412-C414 VanDerWaalsContact OG-SG 3.35Å; S412-C415 CarbonylContact O-C 3.57Å; S412-C415 PolarHBondContact O-N 3.49Å; S412-C415 VanDerWaalsContact O-N 3.11Å; S412-C415 WeakPolarHBondContact OG-CA 3.29Å; S412-C415 WeakPolarHBondContact OG-CB 3.28Å; S412-C415 PolarHBondContact OG-N 2.98Å; S412-C415 PolarHBondContact OG-O 2.85Å
413	P	67.6	Low	59.8	Low	71 Å²	71	93.2 Å²	93.2	46%	0.461	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-21.6	178.6	-23.5	34.7	0	0	0	114	M400 C406	M400-P413 HydrophobicContact CE-CB 4.1Å; M400-P413 WeakPolarHBondContact CE-O 3.2Å; C406-P413 WeakPolarHBondContact O-CD 3.42Å
414	C	71.5	Confident	57.2	Low	16 Å²	16	97.8 Å²	97.8	11%	0.108	54%	0.542	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-26.4	177.5	53	0	0	0	0	114	C395 C398 M400 L402 S412	C395-C414 HydrophobicContact CB-CB 4.02Å; C398-C414 PolarHBondContact SG-O 2.94Å; M400-C414 HydrophobicContact CB-CB 3.94Å; M400-C414 HydrophobicContact CE-CB 3.98Å; M400-C414 HydrophobicContact SD-CB 4.21Å; L402-C414 HydrophobicContact CD1-CB 3.73Å; L402-C414 WeakPolarHBondContact CD1-SG 3.33Å; L402-C414 HydrophobicContact CG-CB 4.39Å; S412-C414 PolarHBondContact O-N 3.33Å; S412-C414 VanDerWaalsContact O-N 3.09Å; S412-C414 PolarHBondContact OG-SG 2.86Å; S412-C414 VanDerWaalsContact OG-SG 3.35Å
415	C	72.8	Confident	55	Low	35 Å²	35	101.4 Å²	101.4	24%	0.236	57%	0.565	C	S	.	*	B	Isolated β-bridge	trans	-142.1	93.7	-178	-75.8	0	0	0	0	108.7	S412	S412-C415 CarbonylContact O-C 3.57Å; S412-C415 PolarHBondContact O-N 3.49Å; S412-C415 VanDerWaalsContact O-N 3.11Å; S412-C415 WeakPolarHBondContact OG-CA 3.29Å; S412-C415 WeakPolarHBondContact OG-CB 3.28Å; S412-C415 PolarHBondContact OG-N 2.98Å; S412-C415 PolarHBondContact OG-O 2.85Å
416	G	52.2	Low	52.7	Low	58 Å²	58	109 Å²	109	60%	0.598	58%	0.577	S	S	*	*			trans	-64.7	168	167.9	0	0	0	0	0	112	Q418	G416-Q418 PolarHBondContact O-N 3.35Å
417	L	41	Very low	50.4	Low	135 Å²	135	114 Å²	114	71%	0.707	61%	0.61	S	S	*	*			trans	-41.2	124.9	-173.6	-120.5	72.8	0	0	0	113.6	P411	P411-L417 HydrophobicContact CB-CD1 4.11Å
418	Q	39.3	Very low	48.1	Very low	170 Å²	170	118 Å²	118	79%	0.794	63%	0.632	S	S	*	*			trans	-107.2	120	157.4	-178.8	165.6	70.9	0	0	106.8	G416	G416-Q418 PolarHBondContact O-N 3.35Å
419	D	35.6	Very low	46	Very low	138 Å²	138	120 Å²	120	74%	0.738	64%	0.643	S	S	*	*			trans	-58.8	156.2	-173.5	-89.2	-64.8	0	0	0	114	H421	D419-H421 PolarHBondContact O-N 3.27Å
420	Y	34.8	Very low	43.8	Very low	219 Å²	219	118.9 Å²	118.9	86%	0.859	66%	0.655	S	S	*	*			trans	-66.3	79.7	-167	-142.5	-90.6	0	0	0	113.2	S422	Y420-S422 PolarHBondContact O-N 2.91Å; Y420-S422 VanDerWaalsContact O-N 3.15Å
421	H	28.5	Very low	42.2	Very low	167 Å²	167	122 Å²	122	77%	0.773	66%	0.657	S	S	*	*			trans	-86.2	91.1	-176.8	-135.8	-37.7	0	0	0	112.6	D419 K423	D419-H421 PolarHBondContact O-N 3.27Å; H421-K423 PolarHBondContact O-N 2.71Å
422	S	36.1	Very low	40.8	Very low	100 Å²	100	124.6 Å²	124.6	70%	0.699	67%	0.666	S	S	*	*			trans	-62.5	83	-176.4	-56.5	0	0	0	0	114.8	Y420	Y420-S422 PolarHBondContact O-N 2.91Å; Y420-S422 VanDerWaalsContact O-N 3.15Å
423	K	27.2	Very low	39.9	Very low	180 Å²	180	129 Å²	129	78%	0.783	69%	0.694	S	S	*	*			trans	-137.1	80.2	168.7	-71.1	-168.8	178.4	179.1	0	112.4	H421	H421-K423 PolarHBondContact O-N 2.71Å
424	S	31.3	Very low	38.1	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-67.9	135.4	157.5	176.1	0	0	0	0	109.6	R426	S424-R426 PolarHBondContact O-N 2.89Å
425	P	34.7	Very low	36.2	Very low	121 Å²	121	139 Å²	139	79%	0.786	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-72.2	120	172	29.9	-32.4	0	0	0	110.2
426	R	33.1	Very low	34.1	Very low	234 Å²	234	142.7 Å²	142.7	88%	0.883	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-97.9	135.7	162.3	-71.1	-170.2	179.3	-163.3	1.1	109.6	S424	S424-R426 PolarHBondContact O-N 2.89Å
427	P	31.4	Very low	33.1	Very low	120 Å²	120	148 Å²	148	78%	0.779	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-71.7	170.5	157.7	32.7	-33.1	0	0	0	111.1
428	L	31	Very low	32.5	Very low	151 Å²	151	148.6 Å²	148.6	79%	0.791	76%	0.762	S	S	*	*			trans	-44.9	154.8	169.9	-84.7	56.8	0	0	0	112.6
429	D	31.6	Very low	31.9	Very low	159 Å²	159	145.3 Å²	145.3	85%	0.85	76%	0.758	S	S	*	*			cis	-156	-174.3	33.5	-111.8	-42.7	0	0	0	112.3
430	G	29.6	Very low	31.5	Very low	72 Å²	72	144.4 Å²	144.4	74%	0.742	76%	0.758	S	S	*	*			trans	118.2	54.4	146.5	0	0	0	0	0	121.8
431	Y	28.5	Very low	31.3	Very low	215 Å²	215	144.4 Å²	144.4	84%	0.843	76%	0.757	S	S	*	*			trans	14.5	97.1	146.6	-138.9	-104.3	0	0	0	123.3
432	I	32.2	Very low	31.3	Very low	130 Å²	130	140.5 Å²	140.5	67%	0.667	75%	0.749	S	S	*	*			trans	53	179.9	141.2	1.5	177.7	0	0	0	120.5
433	P	47.2	Very low	30.9	Very low	112 Å²	112	143 Å²	143	73%	0.727	76%	0.755	S	S	*	*			trans	-129.1	-170.5	-130.8	44.5	-24.8	0	0	0	115.9
434	V	30.9	Very low	30.9	Very low	132 Å²	132	138.7 Å²	138.7	80%	0.8	75%	0.752	S	S	*	*			trans	-173.6	143.9	134.5	137.2	0	0	0	0	114.4
435	K	30.6	Very low	30.9	Very low	165 Å²	165	142 Å²	142	72%	0.717	76%	0.756	S	S	*	*			trans	26.9	131.7	159	-73.1	-169.7	162.2	-135	0	125.4
436	E	30.3	Very low	30.6	Very low	113 Å²	113	141.8 Å²	141.8	53%	0.528	76%	0.758	S	S	.	*				53	122.9	121.6	-59.6	-172.8	90.8	0	0	123.9
437	K	30.9	Very low	30.5	Very low	168 Å²	168	139.3 Å²	139.3	73%	0.73	76%	0.756	S	S	*	*				90.4	138.2	123	-83.1	173.1	178.8	155.1	0	122.4
438	L	28.7	Very low	31.3	Very low	148 Å²	148	138.6 Å²	138.6	78%	0.775	75%	0.751	S	S	*	*			trans	88.3	126.1	140.1	-78.8	163.4	0	0	0	121.9
439	S	26.3	Very low	31.4	Very low	101 Å²	101	139.8 Å²	139.8	71%	0.706	75%	0.752	S	S	*	*			trans	58.7	130.8	149.7	45.1	0	0	0	0	120.6
440	V	27.9	Very low	31.2	Very low	120 Å²	120	140.4 Å²	140.4	73%	0.727	76%	0.755	S	S	*	*			cis	95.8	123.5	28.6	172.3	0	0	0	0	113.9
441	Y	29.2	Very low	31.5	Very low	218 Å²	218	145 Å²	145	86%	0.855	76%	0.756	S	S	*	*			trans	63	147.9	177.7	-71	-57.9	0	0	0	116.7
442	S	28.5	Very low	32.1	Very low	85 Å²	85	140.7 Å²	140.7	59%	0.594	76%	0.755	S	S	*	*			cis	-170.1	164.2	-26.2	-145.3	0	0	0	0	111.7
443	N	27.9	Very low	32.3	Very low	154 Å²	154	142.5 Å²	142.5	82%	0.824	76%	0.76	S	S	*	*			trans	66.2	165.3	159.6	-57.2	-1.1	0	0	0	116
444	A	28.4	Very low	32.4	Very low	88 Å²	88	142.6 Å²	142.6	73%	0.727	76%	0.761	S	S	*	*			cis	-136.6	176.2	4	0	0	0	0	0	112.2
445	Q	31.1	Very low	32.6	Very low	175 Å²	175	144 Å²	144	82%	0.818	76%	0.762	S	S	*	*			trans	-79.8	152.6	-179.3	-48.6	99.2	-58.8	0	0	114.4
446	S	28.3	Very low	32.6	Very low	118 Å²	118	142.8 Å²	142.8	83%	0.825	77%	0.769	S	S	*	*			trans	-158.9	117.9	142.2	56.2	0	0	0	0	113.1
447	H	30.9	Very low	32.7	Very low	182 Å²	182	144.4 Å²	144.4	84%	0.843	78%	0.781	S	S	*	*			trans	-85.8	-176.2	153.6	-69.8	-78.5	0	0	0	108.7
448	P	48.5	Very low	32.7	Very low	104 Å²	104	142.2 Å²	142.2	68%	0.675	78%	0.782	S	S	*	*			cis	-135.1	177.9	-1	16.1	11.7	0	0	0	117
449	H	32.1	Very low	32.9	Very low	176 Å²	176	142.8 Å²	142.8	82%	0.815	78%	0.78	S	S	*	*			trans	22.1	136.4	149.7	-50.4	-58.5	0	0	0	123.1
450	L	27	Very low	33.2	Very low	173 Å²	173	142.1 Å²	142.1	91%	0.906	78%	0.775	S	S	*	*				-174.2	161.5	101.8	-98.2	166.3	0	0	0	114
451	H	36.3	Very low	33.4	Very low	167 Å²	167	144.9 Å²	144.9	77%	0.773	78%	0.78	S	S	*	*			trans	-85.5	166.2	172	-80.5	-91.3	0	0	0	111.9
452	P	41.3	Very low	33.4	Very low	125 Å²	125	139.7 Å²	139.7	81%	0.812	78%	0.775	S	S	*	*				-145.6	157.9	100	37.2	-21.8	0	0	0	116.6
453	H	35.7	Very low	33.8	Very low	169 Å²	169	144.1 Å²	144.1	78%	0.782	79%	0.786	S	S	*	*			trans	-94.5	159.6	156.3	-84.8	-69.1	0	0	0	109.5
454	P	49.2	Very low	34.7	Very low	114 Å²	114	142.7 Å²	142.7	74%	0.74	79%	0.786	S	S	*	*				-152.8	145.7	98.5	36.8	-17.8	0	0	0	118.4
455	L	34.5	Very low	34.9	Very low	160 Å²	160	146.9 Å²	146.9	84%	0.838	79%	0.79	S	S	*	*			trans	44.8	133.5	134.7	-56.6	173.1	0	0	0	123.8
456	T	31.2	Very low	35.9	Very low	141 Å²	141	144 Å²	144	87%	0.865	79%	0.786	S	S	*	*				-158.8	165.8	122.4	13.2	0	0	0	0	111
457	L	32.9	Very low	36.2	Very low	147 Å²	147	146.4 Å²	146.4	77%	0.77	78%	0.784	S	S	*	*			trans	-83.9	174.4	-171.8	-67.1	104.2	0	0	0	112.7
458	T	31.3	Very low	36.9	Very low	121 Å²	121	143.4 Å²	143.4	74%	0.742	78%	0.781	S	S	*	*			cis	-161.2	152	44.4	52.8	0	0	0	0	116.4
459	H	33.3	Very low	36.2	Very low	160 Å²	160	146.7 Å²	146.7	74%	0.741	79%	0.787	S	S	*	*			trans	20.1	148.8	137.2	-66.3	-78.8	0	0	0	122
460	S	30.8	Very low	36.1	Very low	87 Å²	87	145.8 Å²	145.8	61%	0.608	79%	0.785	S	S	*	*			cis	-178.5	154.5	3.5	45.6	0	0	0	0	115.2
461	H	33.4	Very low	36.2	Very low	178 Å²	178	144.2 Å²	144.2	82%	0.824	78%	0.777	S	S	*	*			trans	62.2	155.6	151.5	-63.8	-45.3	0	0	0	120
462	S	28.8	Very low	35.6	Very low	109 Å²	109	144.6 Å²	144.6	76%	0.762	78%	0.779	S	S	*	*			cis	-163.9	158.4	-6	40.1	0	0	0	0	113
463	H	36.5	Very low	35	Very low	178 Å²	178	148 Å²	148	82%	0.824	78%	0.781	S	S	*	*			trans	-106.5	160.6	164.6	-82.6	-67.4	0	0	0	110.9
464	P	46.4	Very low	35.8	Very low	125 Å²	125	145.2 Å²	145.2	81%	0.812	78%	0.778	S	S	*	*				-153.5	-166.7	92.7	40.9	-20	0	0	0	116.9
465	H	32.4	Very low	34.8	Very low	176 Å²	176	147.9 Å²	147.9	82%	0.815	79%	0.785	S	S	*	*			trans	-102.1	-145.7	-171.1	-67.7	-81	0	0	0	113.7
466	P	53.1	Low	34.7	Very low	114 Å²	114	148.2 Å²	148.2	74%	0.74	78%	0.784	S	S	*	*				-128.4	-173.1	-80.3	37.8	-21	0	0	0	115.6
467	H	34.5	Very low	35.1	Very low	168 Å²	168	146.2 Å²	146.2	78%	0.778	77%	0.774	S	S	*	*			trans	36.1	148	147.2	-106.8	-63.5	0	0	0	123.5
468	P	45.5	Very low	34.9	Very low	119 Å²	119	145 Å²	145	77%	0.773	77%	0.773	S	S	*	*				-136.9	-171.8	125.1	38.4	-26.8	0	0	0	114.5
469	Q	33.9	Very low	34.7	Very low	174 Å²	174	148 Å²	148	81%	0.813	78%	0.776	S	S	*	*			trans	-136	158.7	178.1	-63.8	177.3	-35.3	0	0	110.7
470	M	29.5	Very low	34.3	Very low	156 Å²	156	147.8 Å²	147.8	77%	0.768	78%	0.779	S	S	*	*				152.3	138.8	122.1	-80.2	-155.9	70.2	0	0	116.4
471	L	28.9	Very low	34.4	Very low	140 Å²	140	152.9 Å²	152.9	73%	0.733	79%	0.791	S	S	*	*			trans	51.1	118.7	141	-144	78.5	0	0	0	122.7
472	E	25.1	Very low	34.7	Very low	176 Å²	176	149.9 Å²	149.9	82%	0.822	79%	0.787	S	S	*	*				173.5	179.4	106.9	-91.2	-153.1	137.3	0	0	114
473	K	27.9	Very low	34.7	Very low	196 Å²	196	149.6 Å²	149.6	85%	0.852	79%	0.785	S	S	*	*			trans	-147.8	174.9	-175.8	-85.2	-177.4	178.7	176	0	108.2
474	P	52.6	Low	34.5	Very low	111 Å²	111	150.5 Å²	150.5	72%	0.721	79%	0.787	S	S	*	*			cis	-126.1	-175.2	-38.6	39.3	-25.2	0	0	0	111
475	L	27.7	Very low	33.6	Very low	170 Å²	170	149.2 Å²	149.2	89%	0.89	78%	0.78	S	S	*	*			trans	-173.7	168.5	139.5	-104	158.2	0	0	0	113.6
476	M	32.1	Very low	33.3	Very low	166 Å²	166	147.5 Å²	147.5	82%	0.818	78%	0.782	S	S	*	*			trans	-120.3	-179.6	-178.7	-85.7	-74.1	151.5	0	0	107.9
477	P	40.5	Very low	32.2	Very low	99 Å²	99	146.1 Å²	146.1	64%	0.643	78%	0.78	S	S	*	*			cis	-158.9	171.9	32.3	43	-19.8	0	0	0	121.6
478	T	28.8	Very low	31.9	Very low	123 Å²	123	146 Å²	146	76%	0.755	78%	0.782	S	S	*	*			trans	64	158.5	146.3	50.1	0	0	0	0	120.3
479	K	26.6	Very low	31	Very low	183 Å²	183	147 Å²	147	80%	0.796	79%	0.786	S	S	*	*			cis	-127.1	177.1	-0.3	-63.8	-176.3	-179.2	179.4	0	108.5
480	L	26.3	Very low	30.9	Very low	156 Å²	156	144.4 Å²	144.4	82%	0.817	78%	0.782	S	S	*	*			cis	-151.9	154.1	28.5	-75.5	162.5	0	0	0	112.7
481	F	32.8	Very low	31.2	Very low	194 Å²	194	142.4 Å²	142.4	85%	0.851	78%	0.781	S	S	*	*			trans	-151.5	147.7	157	-96.6	-66.5	0	0	0	107.3
482	P	38.9	Very low	31.1	Very low	114 Å²	114	145.7 Å²	145.7	74%	0.74	79%	0.789	S	S	*	*				-137.8	160.5	87.8	23.5	-0.7	0	0	0	113.1
483	S	29.6	Very low	31.7	Very low	103 Å²	103	142.3 Å²	142.3	72%	0.72	79%	0.792	S	S	*	*				63.4	134.6	58.8	-33	0	0	0	0	112.6
484	K	30.8	Very low	31.6	Very low	198 Å²	198	136.9 Å²	136.9	86%	0.861	79%	0.791	S	S	*	*			cis	-157.8	-176.1	24.5	-91.5	-178.2	175.5	173	0	109.3
485	S	27.3	Very low	30.3	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	79%	0.787	S	S	*	*				178	122.6	-51.6	60.1	0	0	0	0	111.1
486	V	26.8	Very low	30.9	Very low	141 Å²	141	134.9 Å²	134.9	86%	0.855	79%	0.788	S	S	*	*			trans	-139.9	104.9	174.7	-174.7	0	0	0	0	109.1
487	A	29.3	Very low	30.8	Very low	85 Å²	85	134.2 Å²	134.2	70%	0.702	78%	0.783	S	S	*	*				57.4	97.8	94.8	0	0	0	0	0	114
488	M	28.8	Very low	30.9	Very low	165 Å²	165	141.2 Å²	141.2	81%	0.813	80%	0.797	S	S	*	*				89.4	111.4	77.3	-86.2	-151.2	79.3	0	0	115
489	T	26	Very low	31.1	Very low	140 Å²	140	142 Å²	142	86%	0.859	80%	0.795	S	S	*	*			trans	-147.8	136.8	135.7	31.7	0	0	0	0	110
490	T	31.5	Very low	32.1	Very low	119 Å²	119	138.9 Å²	138.9	73%	0.73	80%	0.796	S	S	*	*			trans	-130.7	156.7	156.6	57	0	0	0	0	106.9
491	P	36.3	Very low	32.8	Very low	115 Å²	115	137.7 Å²	137.7	75%	0.747	79%	0.789	S	S	*	*				-149.4	156.8	112.1	37.2	-22.1	0	0	0	116.1
492	K	27.7	Very low	33.5	Very low	208 Å²	208	132.4 Å²	132.4	90%	0.904	79%	0.79	S	S	*	*			trans	62.8	136.8	152.3	-77.1	-177.7	172.3	-179.9	0	120.3
493	A	36.4	Very low	34.4	Very low	106 Å²	106	128.5 Å²	128.5	88%	0.876	77%	0.77	S	S	*	*			trans	-83.9	157.4	162.9	0	0	0	0	0	111.3
494	G	26.4	Very low	36.7	Very low	82 Å²	82	126.1 Å²	126.1	85%	0.845	75%	0.753	S	S	*	*			trans	141.7	85.4	164.2	0	0	0	0	0	115.3
495	S	26.1	Very low	39.4	Very low	90 Å²	90	123.9 Å²	123.9	63%	0.629	74%	0.739	S	S	*	*			trans	-172.1	138.2	139.7	-169.6	0	0	0	0	110.3	E497	S495-E497 PolarHBondContact O-N 3.47Å
496	T	41	Very low	42.5	Very low	148 Å²	148	119.3 Å²	119.3	91%	0.908	71%	0.707	S	S	*	*			trans	-96.2	77.6	169.2	-57.7	0	0	0	0	108.5
497	E	28.7	Very low	45.3	Very low	153 Å²	153	114.6 Å²	114.6	72%	0.715	69%	0.687	S	S	*	*			trans	-104.5	125.5	178.8	-91.7	174	-170.3	0	0	112.8	S495 I499	S495-E497 PolarHBondContact O-N 3.47Å; E497-I499 VanDerWaalsContact C-N 3.32Å; E497-I499 PolarHBondContact O-N 2.88Å
498	R	41.8	Very low	48.1	Very low	246 Å²	246	112.8 Å²	112.8	93%	0.928	66%	0.663	S	S	*	*			trans	-75.3	82	173	-68	176.1	175	169.5	-3	109.3	S500	R498-S500 PolarHBondContact O-N 3.42Å
499	I	33.5	Very low	51.1	Low	139 Å²	139	107.4 Å²	107.4	71%	0.713	64%	0.641	S	S	*	*			trans	-62.5	113	172.3	-57.5	-179	0	0	0	108.4	E497 I501	E497-I499 VanDerWaalsContact C-N 3.32Å; E497-I499 PolarHBondContact O-N 2.88Å; I499-I501 VanDerWaalsContact C-N 3.34Å; I499-I501 HydrophobicContact CB-CG1 4.42Å; I499-I501 HydrophobicContact CG2-CG1 3.81Å; I499-I501 PolarHBondContact O-N 3.24Å
500	S	47.2	Very low	54	Low	118 Å²	118	105.4 Å²	105.4	83%	0.825	63%	0.625	S	S	*	*			trans	-74.2	86.3	176.6	-170.6	0	0	0	0	109.7	R498 G502	R498-S500 PolarHBondContact O-N 3.42Å; S500-G502 VanDerWaalsContact C-N 3.3Å; S500-G502 PolarHBondContact O-N 2.98Å
501	I	41.9	Very low	56.7	Low	130 Å²	130	106.5 Å²	106.5	67%	0.667	62%	0.62	S	S	*	*			trans	-77.4	84.2	179.8	-58.5	179.5	0	0	0	109.2	I499 G503	I499-I501 VanDerWaalsContact C-N 3.34Å; I499-I501 HydrophobicContact CB-CG1 4.42Å; I499-I501 HydrophobicContact CG2-CG1 3.81Å; I499-I501 PolarHBondContact O-N 3.24Å; I501-G503 PolarHBondContact O-N 2.91Å
502	G	46.7	Very low	59	Low	84 Å²	84	105.4 Å²	105.4	87%	0.866	61%	0.613	S	S	*	*			trans	-68.4	39.3	162.3	0	0	0	0	0	112.9	S500	S500-G502 VanDerWaalsContact C-N 3.3Å; S500-G502 PolarHBondContact O-N 2.98Å
503	G	59.2	Low	61.8	Low	31 Å²	31	97.3 Å²	97.3	32%	0.32	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-81.7	133.5	-176.1	0	0	0	0	0	111.6	I501	I501-G503 PolarHBondContact O-N 2.91Å
504	S	77.3	Confident	64.3	Low	53 Å²	53	92.8 Å²	92.8	37%	0.371	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-55.2	147	178	67.2	0	0	0	0	112.4	G513 A514	S504-G513 PolarHBondContact O-N 3.24Å; S504-A514 WeakPolarHBondContact O-CB 3.41Å; S504-A514 PolarHBondContact O-N 2.92Å; S504-A514 WeakPolarHBondContact OG-CB 3.47Å; S504-A514 PolarHBondContact OG-O 3.4Å
505	R	88.6	Confident	67.3	Low	152 Å²	152	90.7 Å²	90.7	57%	0.574	52%	0.523	S	S	*	.	B	Isolated β-bridge	trans	-86.9	139.2	-179.9	-61.3	178.1	71.5	133.7	3.9	110.2	G507 N510 K511 V524	R505-G507 PolarHBondContact O-N 2.91Å; R505-N510 PolarHBondContact NE-O 3.43Å; R505-N510 VanDerWaalsContact NE-O 3.11Å; R505-N510 PolarHBondContact NE-OD1 3.38Å; R505-N510 PolarHBondContact NH2-O 3.33Å; R505-N510 PolarHBondContact NH2-OD1 2.96Å; R505-K511 WeakPolarHBondContact CA-O 3.46Å; R505-V524 WeakPolarHBondContact O-CG2 3.46Å
506	C	91.3	Very high	70.3	Confident	1 Å²	1	87.6 Å²	87.6	1%	0.007	50%	0.499	C	S	.	.	P	Polyproline II helix	trans	-64.6	124.1	-180	171.9	0	0	0	0	111.4	F508 C509 N510 K511 A514 C526	C506-F508 PolarHBondContact O-N 3.06Å; C506-F508 PolarHBondContact SG-N 3.24Å; C506-F508 VanDerWaalsContact SG-N 3.4Å; C506-C509 VanDerWaalsContact SG-SG 3.61Å; C506-N510 WeakPolarHBondContact O-CA 3.47Å; C506-N510 PolarHBondContact O-N 3.16Å; C506-K511 PolarHBondContact N-O 3.3Å; C506-A514 HydrophobicContact CB-CB 4.31Å; C506-C526 HydrophobicContact CB-CB 4.24Å
507	G	86.2	Confident	72.7	Confident	41 Å²	41	81.7 Å²	81.7	42%	0.423	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	6.4	179	0	0	0	0	0	115.3	R505 K523 V524	R505-G507 PolarHBondContact O-N 2.91Å; G507-K523 VanDerWaalsContact C-CE 3.42Å; G507-K523 WeakPolarHBondContact O-CE 3.37Å; G507-K523 PolarHBondContact O-NZ 3.46Å; G507-V524 PolarHBondContact N-O 2.94Å
508	F	87.8	Confident	75.6	Confident	48 Å²	48	74.4 Å²	74.4	21%	0.211	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-51.1	177.6	-63.9	-98.8	0	0	0	111.7	C506 K523 C529 Y533 F547	C506-F508 PolarHBondContact O-N 3.06Å; C506-F508 PolarHBondContact SG-N 3.24Å; C506-F508 VanDerWaalsContact SG-N 3.4Å; F508-K523 VanDerWaalsContact CD1-NZ 3.31Å; F508-K523 HydrophobicContact CD2-CD 4.26Å; F508-K523 HydrophobicContact CE1-CD 4.23Å; F508-K523 HydrophobicContact CE2-CD 3.57Å; F508-K523 VanDerWaalsContact CE2-CE 3.49Å; F508-K523 HydrophobicContact CE2-CG 3.82Å; F508-K523 HydrophobicContact CZ-CD 3.56Å; F508-K523 HydrophobicContact CZ-CG 4.26Å; F508-C529 HydrophobicContact CB-CB 4.17Å; F508-Y533 HydrophobicContact CB-CD2 3.89Å; F508-Y533 HydrophobicContact CB-CE2 3.7Å; F508-Y533 HydrophobicContact CD1-CD1 4.01Å; F508-Y533 AromaticContact CD1-CD2 3.38Å; F508-Y533 HydrophobicContact CD1-CD2 3.38Å; F508-Y533 HydrophobicContact CD1-CE1 4.32Å; F508-Y533 AromaticContact CD1-CE2 3.75Å; F508-Y533 HydrophobicContact CD1-CE2 3.75Å; F508-Y533 AromaticContact CD1-CG 3.53Å; F508-Y533 HydrophobicContact CD1-CG 3.53Å; F508-Y533 HydrophobicContact CE1-CD1 4.17Å; F508-Y533 AromaticContact CE1-CD2 3.97Å; F508-Y533 HydrophobicContact CE1-CD2 3.97Å; F508-Y533 AromaticContact CE1-CG 3.69Å; F508-Y533 HydrophobicContact CE1-CG 3.69Å; F508-Y533 AromaticContact CG-CD2 3.71Å; F508-Y533 HydrophobicContact CG-CD2 3.71Å; F508-Y533 HydrophobicContact CG-CE2 4.01Å; F508-Y533 HydrophobicContact CG-CG 4.3Å; F508-F547 HydrophobicContact CE2-CE1 4.09Å; F508-F547 AromaticContact CE2-CZ 3.79Å; F508-F547 HydrophobicContact CE2-CZ 3.79Å; F508-F547 HydrophobicContact CZ-CE1 4.48Å; F508-F547 AromaticContact CZ-CZ 3.84Å; F508-F547 HydrophobicContact CZ-CZ 3.84Å
509	C	91.1	Very high	77.8	Confident	51 Å²	51	65.9 Å²	65.9	35%	0.345	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-1.5	180	68.1	0	0	0	0	115	C506 K511	C506-C509 VanDerWaalsContact SG-SG 3.61Å; C509-K511 PolarHBondContact O-N 3.49Å
510	N	87.1	Confident	80.3	Confident	98 Å²	98	62.6 Å²	62.6	52%	0.524	39%	0.388	S	S	.	.			trans	53.9	16.7	-176.9	-157.3	5.2	0	0	0	115.8	R505 C506	R505-N510 PolarHBondContact NE-O 3.43Å; R505-N510 VanDerWaalsContact NE-O 3.11Å; R505-N510 PolarHBondContact NE-OD1 3.38Å; R505-N510 PolarHBondContact NH2-O 3.33Å; R505-N510 PolarHBondContact NH2-OD1 2.96Å; C506-N510 WeakPolarHBondContact O-CA 3.47Å; C506-N510 PolarHBondContact O-N 3.16Å
511	K	87.7	Confident	82.2	Confident	143 Å²	143	58.9 Å²	58.9	62%	0.622	36%	0.361	S	S	*	.			trans	-81.9	149.8	171.1	-63.6	-176.3	179.4	-178.3	0	110.5	R505 C506 C509	R505-K511 WeakPolarHBondContact CA-O 3.46Å; C506-K511 PolarHBondContact N-O 3.3Å; C509-K511 PolarHBondContact O-N 3.49Å
512	P	86.3	Confident	84.3	Confident	92 Å²	92	57.3 Å²	57.3	60%	0.597	36%	0.361	S	S	*	.	B	Isolated β-bridge	trans	-64.7	164.2	172	30	-36.2	0	0	0	111.2
513	G	85.1	Confident	86.3	Confident	38 Å²	38	56.7 Å²	56.7	39%	0.392	34%	0.335	S	S	.	.			trans	89.1	38	178.8	0	0	0	0	0	113.9	S504 C526	S504-G513 PolarHBondContact O-N 3.24Å; G513-C526 WeakPolarHBondContact O-CB 3.48Å
514	A	89.3	Confident	87.9	Confident	11 Å²	11	57.1 Å²	57.1	9%	0.091	33%	0.331	C	S	.	.			trans	-74.4	124.4	165.2	0	0	0	0	0	110.7	S504 C506 V524 S525 N550	S504-A514 WeakPolarHBondContact O-CB 3.41Å; S504-A514 PolarHBondContact O-N 2.92Å; S504-A514 WeakPolarHBondContact OG-CB 3.47Å; S504-A514 PolarHBondContact OG-O 3.4Å; C506-A514 HydrophobicContact CB-CB 4.31Å; A514-V524 HydrophobicContact CB-CB 4.01Å; A514-V524 HydrophobicContact CB-CG2 4.16Å; A514-S525 CarbonylContact C-O 3.52Å; A514-S525 VanDerWaalsContact CA-O 3.26Å; A514-S525 WeakPolarHBondContact CA-O 3.37Å; A514-S525 WeakPolarHBondContact CB-O 3.39Å; A514-N550 PolarHBondContact O-ND2 3.47Å
515	S	89.1	Confident	88.6	Confident	37 Å²	37	54.6 Å²	54.6	26%	0.259	31%	0.314	S	S	.	.			trans	-120.1	-18.3	-164.5	45.9	0	0	0	0	112.3	S525 D527 N550	S515-S525 PolarHBondContact N-O 3.4Å; S515-D527 WeakPolarHBondContact CB-OD1 3.16Å; S515-D527 PolarHBondContact OG-OD1 2.89Å; S515-N550 VanDerWaalsContact C-CG 3.49Å; S515-N550 WeakPolarHBondContact O-CB 3.24Å; S515-N550 VanDerWaalsContact O-CG 3.24Å; S515-N550 PolarHBondContact O-N 2.98Å
516	H	89.4	Confident	88.8	Confident	26 Å²	26	48.2 Å²	48.2	12%	0.12	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	153.9	-176.9	-62.5	76.6	0	0	0	110.6	V524 S525 D527 M530 F547 V548 N550	H516-V524 CarbonylContact O-C 3.58Å; H516-V524 WeakPolarHBondContact O-CA 3.43Å; H516-S525 PolarHBondContact N-O 3.31Å; H516-S525 PolarHBondContact O-N 3.24Å; H516-D527 IonicContact CE1-OD1 3.19Å; H516-D527 PolarHBondContact CE1-OD1 3.33Å; H516-D527 IonicContact ND1-OD1 2.75Å; H516-D527 PolarHBondContact ND1-OD1 2.99Å; H516-M530 HydrophobicContact CB-SD 4.44Å; H516-M530 PolarHBondContact CD2-SD 3.27Å; H516-F547 HydrophobicContact CB-CB 4.31Å; H516-F547 HydrophobicContact CB-CD1 4.49Å; H516-V548 CarbonylContact C-O 3.54Å; H516-V548 WeakPolarHBondContact CA-O 3.32Å; H516-N550 WeakPolarHBondContact CA-OD1 3.26Å
517	T	91.2	Very high	88.7	Confident	23 Å²	23	53 Å²	53	14%	0.141	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	136.1	173.4	-56.8	0	0	0	0	110.2	V519 V524 V548 N550 L553	T517-V519 PolarHBondContact O-N 3.47Å; T517-V524 HydrophobicContact CG2-CG1 4.35Å; T517-V548 PolarHBondContact N-O 3.45Å; T517-V548 PolarHBondContact O-N 3.07Å; T517-N550 PolarHBondContact N-OD1 3.5Å; T517-N550 VanDerWaalsContact N-OD1 3.15Å; T517-N550 PolarHBondContact OG1-OD1 3.25Å; T517-L553 HydrophobicContact CG2-CD1 4.44Å
518	C	89.9	Confident	88.9	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	112.4	174.7	177.2	0	0	0	0	110.5	N520 C521 S522 K523 H545 N546 F547	C518-N520 PolarHBondContact O-N 3.13Å; C518-N520 VanDerWaalsContact O-N 3.15Å; C518-C521 PolarHBondContact O-N 3.08Å; C518-S522 VanDerWaalsContact O-CA 3.32Å; C518-S522 WeakPolarHBondContact O-CA 3.28Å; C518-S522 PolarHBondContact O-N 3.32Å; C518-K523 PolarHBondContact N-O 2.87Å; C518-H545 PolarHBondContact SG-ND1 3Å; C518-N546 CarbonylContact C-O 3.57Å; C518-N546 VanDerWaalsContact CA-O 3.25Å; C518-N546 WeakPolarHBondContact CA-O 3.23Å; C518-F547 HydrophobicContact CB-CD1 3.72Å; C518-F547 HydrophobicContact CB-CE1 3.62Å; C518-F547 HydrophobicContact CB-CG 4.46Å; C518-F547 HydrophobicContact CB-CZ 4.3Å
519	V	87.8	Confident	89	Confident	68 Å²	68	53.3 Å²	53.3	41%	0.412	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.2	-179	-62	0	0	0	0	113.1	T517 N546 V548 L553	T517-V519 PolarHBondContact O-N 3.47Å; V519-N546 HydrophobicContact CG2-CB 3.96Å; V519-N546 PolarHBondContact N-O 2.74Å; V519-V548 HydrophobicContact CG1-CB 4.17Å; V519-V548 HydrophobicContact CG1-CG2 3.73Å; V519-L553 HydrophobicContact CG1-CD2 3.89Å
520	N	85.8	Confident	88.9	Confident	70 Å²	70	53.5 Å²	53.5	37%	0.374	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-12	-179.9	-64.3	-15.5	0	0	0	114.2	C518 C538 Q544	C518-N520 PolarHBondContact O-N 3.13Å; C518-N520 VanDerWaalsContact O-N 3.15Å; N520-C538 HydrophobicContact CB-CB 4.34Å; N520-C538 WeakPolarHBondContact CB-SG 3.41Å; N520-Q544 PolarHBondContact ND2-O 3.33Å
521	C	87.2	Confident	88.8	Confident	40 Å²	40	51.9 Å²	51.9	27%	0.27	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-155.5	12.3	-179.2	66.8	0	0	0	0	115.5	C518 K523 C538 H545	C518-C521 PolarHBondContact O-N 3.08Å; C521-K523 PolarHBondContact O-N 3.05Å; C521-K523 VanDerWaalsContact SG-CB 3.56Å; C521-C538 VanDerWaalsContact CB-SG 3.56Å; C521-H545 VanDerWaalsContact SG-CE1 3.58Å
522	S	87.5	Confident	88.8	Confident	96 Å²	96	50.6 Å²	50.6	67%	0.671	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	18	-178	-52.8	0	0	0	0	115.8	C518	C518-S522 VanDerWaalsContact O-CA 3.32Å; C518-S522 WeakPolarHBondContact O-CA 3.28Å; C518-S522 PolarHBondContact O-N 3.32Å
523	K	88.2	Confident	88.7	Confident	72 Å²	72	50.1 Å²	50.1	31%	0.313	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	123	-176.5	-168.5	176.3	178.2	-166.9	0	111.4	G507 F508 C518 C521	G507-K523 VanDerWaalsContact C-CE 3.42Å; G507-K523 WeakPolarHBondContact O-CE 3.37Å; G507-K523 PolarHBondContact O-NZ 3.46Å; F508-K523 VanDerWaalsContact CD1-NZ 3.31Å; F508-K523 HydrophobicContact CD2-CD 4.26Å; F508-K523 HydrophobicContact CE1-CD 4.23Å; F508-K523 HydrophobicContact CE2-CD 3.57Å; F508-K523 VanDerWaalsContact CE2-CE 3.49Å; F508-K523 HydrophobicContact CE2-CG 3.82Å; F508-K523 HydrophobicContact CZ-CD 3.56Å; F508-K523 HydrophobicContact CZ-CG 4.26Å; C518-K523 PolarHBondContact N-O 2.87Å; C521-K523 PolarHBondContact O-N 3.05Å; C521-K523 VanDerWaalsContact SG-CB 3.56Å
524	V	92.1	Very high	88.5	Confident	40 Å²	40	49.9 Å²	49.9	24%	0.242	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	140.9	-179.3	-60.2	0	0	0	0	112.8	R505 G507 A514 H516 T517	R505-V524 WeakPolarHBondContact O-CG2 3.46Å; G507-V524 PolarHBondContact N-O 2.94Å; A514-V524 HydrophobicContact CB-CB 4.01Å; A514-V524 HydrophobicContact CB-CG2 4.16Å; H516-V524 CarbonylContact O-C 3.58Å; H516-V524 WeakPolarHBondContact O-CA 3.43Å; T517-V524 HydrophobicContact CG2-CG1 4.35Å
525	S	91.3	Very high	88	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	154.4	178.8	63.9	0	0	0	0	112.6	A514 S515 H516 F547	A514-S525 CarbonylContact C-O 3.52Å; A514-S525 VanDerWaalsContact CA-O 3.26Å; A514-S525 WeakPolarHBondContact CA-O 3.37Å; A514-S525 WeakPolarHBondContact CB-O 3.39Å; S515-S525 PolarHBondContact N-O 3.4Å; H516-S525 PolarHBondContact N-O 3.31Å; H516-S525 PolarHBondContact O-N 3.24Å; S525-F547 WeakPolarHBondContact OG-CD1 3.3Å; S525-F547 WeakPolarHBondContact OG-CE1 3.47Å
526	C	93.3	Very high	87.9	Confident	18 Å²	18	59.1 Å²	59.1	12%	0.122	34%	0.34	C	S	.	.			trans	-94	160.9	164.6	62.2	0	0	0	0	109.8	C506 G513 S528 C529 M530	C506-C526 HydrophobicContact CB-CB 4.24Å; G513-C526 WeakPolarHBondContact O-CB 3.48Å; C526-S528 VanDerWaalsContact C-N 3.29Å; C526-S528 PolarHBondContact O-N 3.16Å; C526-S528 VanDerWaalsContact O-N 3.16Å; C526-C529 CarbonylContact O-C 3.56Å; C526-C529 WeakPolarHBondContact O-CA 3.33Å; C526-C529 PolarHBondContact O-N 3.19Å; C526-M530 PolarHBondContact O-N 3.11Å
527	D	89.8	Confident	87.6	Confident	101 Å²	101	62.7 Å²	62.7	54%	0.54	36%	0.363	S	S	.	.	H	α-helix	trans	-52.6	-43.3	-170.5	-45	-25.3	0	0	0	113.2	S515 H516 C529 M530 G531	S515-D527 WeakPolarHBondContact CB-OD1 3.16Å; S515-D527 PolarHBondContact OG-OD1 2.89Å; H516-D527 IonicContact CE1-OD1 3.19Å; H516-D527 PolarHBondContact CE1-OD1 3.33Å; H516-D527 IonicContact ND1-OD1 2.75Å; H516-D527 PolarHBondContact ND1-OD1 2.99Å; D527-C529 PolarHBondContact O-N 3.01Å; D527-M530 WeakPolarHBondContact O-CB 3.36Å; D527-M530 PolarHBondContact O-N 3.22Å; D527-G531 PolarHBondContact O-N 3.35Å; D527-G531 VanDerWaalsContact O-N 3.17Å
528	S	89.8	Confident	87.3	Confident	88 Å²	88	61.6 Å²	61.6	62%	0.615	36%	0.356	S	S	*	.	H	α-helix	trans	-63	-39	177	171.9	0	0	0	0	112.8	C526 L532	C526-S528 VanDerWaalsContact C-N 3.29Å; C526-S528 PolarHBondContact O-N 3.16Å; C526-S528 VanDerWaalsContact O-N 3.16Å; S528-L532 WeakPolarHBondContact O-CG 3.19Å
529	C	91.1	Very high	86.4	Confident	7 Å²	7	66 Å²	66	5%	0.047	38%	0.383	C	S	.	.	H	α-helix	trans	-76.9	-31.5	175.2	-73	0	0	0	0	112.4	F508 C526 D527 L532 Y533	F508-C529 HydrophobicContact CB-CB 4.17Å; C526-C529 CarbonylContact O-C 3.56Å; C526-C529 WeakPolarHBondContact O-CA 3.33Å; C526-C529 PolarHBondContact O-N 3.19Å; D527-C529 PolarHBondContact O-N 3.01Å; C529-L532 PolarHBondContact O-N 2.96Å; C529-Y533 HydrophobicContact CB-CD2 3.95Å; C529-Y533 HydrophobicContact CB-CE2 4.23Å; C529-Y533 WeakPolarHBondContact O-CB 3.42Å; C529-Y533 VanDerWaalsContact O-CD2 3.22Å; C529-Y533 WeakPolarHBondContact O-CD2 3.4Å; C529-Y533 PolarHBondContact O-N 3.22Å
530	M	88.3	Confident	85	Confident	56 Å²	56	74.9 Å²	74.9	28%	0.276	41%	0.409	S	S	.	.	H	α-helix	trans	-57.1	-51.7	173.9	179.5	-171.8	70.9	0	0	110.6	H516 C526 D527 L532 Y533 A534 F547	H516-M530 HydrophobicContact CB-SD 4.44Å; H516-M530 PolarHBondContact CD2-SD 3.27Å; C526-M530 PolarHBondContact O-N 3.11Å; D527-M530 WeakPolarHBondContact O-CB 3.36Å; D527-M530 PolarHBondContact O-N 3.22Å; M530-L532 VanDerWaalsContact C-N 3.27Å; M530-L532 PolarHBondContact O-N 3Å; M530-Y533 PolarHBondContact O-N 3.45Å; M530-A534 WeakPolarHBondContact O-CB 3.17Å; M530-A534 PolarHBondContact O-N 2.79Å; M530-F547 HydrophobicContact CB-CD2 4.37Å; M530-F547 HydrophobicContact CG-CB 3.75Å; M530-F547 HydrophobicContact CG-CD2 3.7Å; M530-F547 HydrophobicContact CG-CE2 4.47Å; M530-F547 HydrophobicContact CG-CG 3.85Å; M530-F547 HydrophobicContact SD-CB 3.95Å
531	G	84.8	Confident	83.7	Confident	63 Å²	63	80.6 Å²	80.6	65%	0.649	43%	0.431	S	S	*	.	H	α-helix	trans	-62	-32	-178.7	0	0	0	0	0	114.3	D527	D527-G531 PolarHBondContact O-N 3.35Å; D527-G531 VanDerWaalsContact O-N 3.17Å
532	L	87.4	Confident	82.4	Confident	117 Å²	117	85.1 Å²	85.1	61%	0.613	45%	0.452	S	S	*	.	H	α-helix	trans	-78.4	-47.1	177.9	-66.7	170.9	0	0	0	112.4	S528 C529 M530	S528-L532 WeakPolarHBondContact O-CG 3.19Å; C529-L532 PolarHBondContact O-N 2.96Å; M530-L532 VanDerWaalsContact C-N 3.27Å; M530-L532 PolarHBondContact O-N 3Å
533	Y	84.9	Confident	81.8	Confident	82 Å²	82	82.9 Å²	82.9	32%	0.322	44%	0.436	S	S	.	.	H	α-helix	trans	-97.7	0.8	-170.5	-61.4	-68.1	0	0	0	114.5	F508 C529 M530 K535 D536 H545	F508-Y533 HydrophobicContact CB-CD2 3.89Å; F508-Y533 HydrophobicContact CB-CE2 3.7Å; F508-Y533 HydrophobicContact CD1-CD1 4.01Å; F508-Y533 AromaticContact CD1-CD2 3.38Å; F508-Y533 HydrophobicContact CD1-CD2 3.38Å; F508-Y533 HydrophobicContact CD1-CE1 4.32Å; F508-Y533 AromaticContact CD1-CE2 3.75Å; F508-Y533 HydrophobicContact CD1-CE2 3.75Å; F508-Y533 AromaticContact CD1-CG 3.53Å; F508-Y533 HydrophobicContact CD1-CG 3.53Å; F508-Y533 HydrophobicContact CE1-CD1 4.17Å; F508-Y533 AromaticContact CE1-CD2 3.97Å; F508-Y533 HydrophobicContact CE1-CD2 3.97Å; F508-Y533 AromaticContact CE1-CG 3.69Å; F508-Y533 HydrophobicContact CE1-CG 3.69Å; F508-Y533 AromaticContact CG-CD2 3.71Å; F508-Y533 HydrophobicContact CG-CD2 3.71Å; F508-Y533 HydrophobicContact CG-CE2 4.01Å; F508-Y533 HydrophobicContact CG-CG 4.3Å; C529-Y533 HydrophobicContact CB-CD2 3.95Å; C529-Y533 HydrophobicContact CB-CE2 4.23Å; C529-Y533 WeakPolarHBondContact O-CB 3.42Å; C529-Y533 VanDerWaalsContact O-CD2 3.22Å; C529-Y533 WeakPolarHBondContact O-CD2 3.4Å; C529-Y533 PolarHBondContact O-N 3.22Å; M530-Y533 PolarHBondContact O-N 3.45Å; Y533-K535 PolarHBondContact O-N 3.49Å; Y533-D536 WeakPolarHBondContact CD1-OD2 3.21Å; Y533-D536 PolarHBondContact O-N 3.1Å; Y533-H545 PolarHBondContact O-CD2 3.46Å
534	A	80.3	Confident	81.6	Confident	33 Å²	33	85.1 Å²	85.1	27%	0.273	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-31.8	177	0	0	0	0	0	113.4	M530 H545 F547	M530-A534 WeakPolarHBondContact O-CB 3.17Å; M530-A534 PolarHBondContact O-N 2.79Å; A534-H545 PolarHBondContact O-N 2.78Å; A534-F547 HydrophobicContact CB-CD2 4.4Å
535	K	79.4	Confident	81.4	Confident	164 Å²	164	84.2 Å²	84.2	71%	0.713	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-7.6	-179	-65.5	-178.3	-179.1	178.1	0	114	Y533 Q544	Y533-K535 PolarHBondContact O-N 3.49Å; K535-Q544 PolarHBondContact O-NE2 3.44Å
536	D	85.6	Confident	81.3	Confident	78 Å²	78	88.4 Å²	88.4	42%	0.417	46%	0.462	S	S	.	.	S	Bend	trans	-73.7	156.5	-179.8	-82.2	25.8	0	0	0	111.8	Y533 C538 Q544 H545	Y533-D536 WeakPolarHBondContact CD1-OD2 3.21Å; Y533-D536 PolarHBondContact O-N 3.1Å; D536-C538 PolarHBondContact O-N 2.75Å; D536-Q544 WeakPolarHBondContact O-CA 3.35Å; D536-H545 PolarHBondContact O-N 2.87Å
537	V	84.2	Confident	81.2	Confident	100 Å²	100	88.5 Å²	88.5	61%	0.606	46%	0.461	S	S	*	.	B	Isolated β-bridge	trans	-73	109.8	-176.5	-178.4	0	0	0	0	110.5	N542	V537-N542 WeakPolarHBondContact CG1-OD1 3.38Å
538	C	83.7	Confident	81.1	Confident	1 Å²	1	85.2 Å²	85.2	1%	0.007	45%	0.445	C	S	.	.			trans	-77.3	152	170.5	-171.6	0	0	0	0	110.8	N520 C521 D536 P543	N520-C538 HydrophobicContact CB-CB 4.34Å; N520-C538 WeakPolarHBondContact CB-SG 3.41Å; C521-C538 VanDerWaalsContact CB-SG 3.56Å; D536-C538 PolarHBondContact O-N 2.75Å; C538-P543 WeakPolarHBondContact CA-O 3.39Å; C538-P543 HydrophobicContact CB-CG 4.23Å; C538-P543 VanDerWaalsContact CB-O 3.28Å; C538-P543 WeakPolarHBondContact CB-O 3.43Å; C538-P543 PolarHBondContact N-O 2.91Å
539	T	72.2	Confident	81.1	Confident	92 Å²	92	82.3 Å²	82.3	56%	0.564	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	148.1	-157.2	46	0	0	0	0	116.9	K541	T539-K541 VanDerWaalsContact C-N 3.26Å; T539-K541 PolarHBondContact O-N 2.71Å
540	R	57.3	Low	80.7	Confident	255 Å²	255	84.6 Å²	84.6	96%	0.962	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.8	-13.5	164.3	-72.9	-168.6	174.8	-159.8	-1.5	119.6
541	K	59.1	Low	80.2	Confident	190 Å²	190	89.4 Å²	89.4	83%	0.826	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-135.9	11.6	179.8	-70.9	-168	175.3	-174.4	0	115.6	T539 P543	T539-K541 VanDerWaalsContact C-N 3.26Å; T539-K541 PolarHBondContact O-N 2.71Å; K541-P543 VanDerWaalsContact O-CD 3.32Å; K541-P543 WeakPolarHBondContact O-CD 3.32Å
542	N	59.8	Low	79.6	Confident	135 Å²	135	92.3 Å²	92.3	72%	0.722	45%	0.453	S	S	*	.			trans	57.1	20.3	-171.5	-72.3	-6.3	0	0	0	118.9	V537	V537-N542 WeakPolarHBondContact CG1-OD1 3.38Å
543	P	74.9	Confident	79	Confident	49 Å²	49	88.5 Å²	88.5	32%	0.318	43%	0.433	S	S	.	.			trans	-69.1	155.9	166.9	33.7	-36	0	0	0	110.3	C538 K541	C538-P543 WeakPolarHBondContact CA-O 3.39Å; C538-P543 HydrophobicContact CB-CG 4.23Å; C538-P543 VanDerWaalsContact CB-O 3.28Å; C538-P543 WeakPolarHBondContact CB-O 3.43Å; C538-P543 PolarHBondContact N-O 2.91Å; K541-P543 VanDerWaalsContact O-CD 3.32Å; K541-P543 WeakPolarHBondContact O-CD 3.32Å
544	Q	84.6	Confident	77.7	Confident	118 Å²	118	92.1 Å²	92.1	55%	0.551	46%	0.458	S	S	*	.	B	Isolated β-bridge	trans	-73.6	167.4	165.8	-76.1	-176.2	-27.9	0	0	111.5	N520 K535 D536 N546	N520-Q544 PolarHBondContact ND2-O 3.33Å; K535-Q544 PolarHBondContact O-NE2 3.44Å; D536-Q544 WeakPolarHBondContact O-CA 3.35Å; Q544-N546 PolarHBondContact O-N 3.39Å
545	H	87.9	Confident	76.4	Confident	22 Å²	22	98.2 Å²	98.2	10%	0.102	48%	0.479	C	S	.	.			trans	-73.6	104.1	175.9	-81.5	-71.9	0	0	0	111.8	C518 C521 Y533 A534 D536 F547	C518-H545 PolarHBondContact SG-ND1 3Å; C521-H545 VanDerWaalsContact SG-CE1 3.58Å; Y533-H545 PolarHBondContact O-CD2 3.46Å; A534-H545 PolarHBondContact O-N 2.78Å; D536-H545 PolarHBondContact O-N 2.87Å; H545-F547 HydrophobicContact CB-CD2 3.97Å; H545-F547 HydrophobicContact CB-CE2 3.46Å; H545-F547 VanDerWaalsContact CB-CE2 3.46Å; H545-F547 HydrophobicContact CB-CZ 3.92Å; H545-F547 PolarHBondContact O-N 3.41Å
546	N	89.1	Confident	74.8	Confident	87 Å²	87	100.2 Å²	100.2	47%	0.465	49%	0.488	S	S	.	.			trans	-85.3	98.6	172	-175.4	11	0	0	0	110.5	C518 V519 Q544	C518-N546 CarbonylContact C-O 3.57Å; C518-N546 VanDerWaalsContact CA-O 3.25Å; C518-N546 WeakPolarHBondContact CA-O 3.23Å; V519-N546 HydrophobicContact CG2-CB 3.96Å; V519-N546 PolarHBondContact N-O 2.74Å; Q544-N546 PolarHBondContact O-N 3.39Å
547	F	90.8	Very high	72.8	Confident	21 Å²	21	101.7 Å²	101.7	9%	0.092	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	130.1	179.6	-70.4	-74.8	0	0	0	112.1	F508 H516 C518 S525 M530 A534 H545	F508-F547 HydrophobicContact CE2-CE1 4.09Å; F508-F547 AromaticContact CE2-CZ 3.79Å; F508-F547 HydrophobicContact CE2-CZ 3.79Å; F508-F547 HydrophobicContact CZ-CE1 4.48Å; F508-F547 AromaticContact CZ-CZ 3.84Å; F508-F547 HydrophobicContact CZ-CZ 3.84Å; H516-F547 HydrophobicContact CB-CB 4.31Å; H516-F547 HydrophobicContact CB-CD1 4.49Å; C518-F547 HydrophobicContact CB-CD1 3.72Å; C518-F547 HydrophobicContact CB-CE1 3.62Å; C518-F547 HydrophobicContact CB-CG 4.46Å; C518-F547 HydrophobicContact CB-CZ 4.3Å; S525-F547 WeakPolarHBondContact OG-CD1 3.3Å; S525-F547 WeakPolarHBondContact OG-CE1 3.47Å; M530-F547 HydrophobicContact CB-CD2 4.37Å; M530-F547 HydrophobicContact CG-CB 3.75Å; M530-F547 HydrophobicContact CG-CD2 3.7Å; M530-F547 HydrophobicContact CG-CE2 4.47Å; M530-F547 HydrophobicContact CG-CG 3.85Å; M530-F547 HydrophobicContact SD-CB 3.95Å; A534-F547 HydrophobicContact CB-CD2 4.4Å; H545-F547 HydrophobicContact CB-CD2 3.97Å; H545-F547 HydrophobicContact CB-CE2 3.46Å; H545-F547 VanDerWaalsContact CB-CE2 3.46Å; H545-F547 HydrophobicContact CB-CZ 3.92Å; H545-F547 PolarHBondContact O-N 3.41Å
548	V	88.6	Confident	70.5	Confident	32 Å²	32	100.1 Å²	100.1	19%	0.194	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	139.7	176.2	178.2	0	0	0	0	109.3	H516 T517 V519 Q552 L553	H516-V548 CarbonylContact C-O 3.54Å; H516-V548 WeakPolarHBondContact CA-O 3.32Å; T517-V548 PolarHBondContact N-O 3.45Å; T517-V548 PolarHBondContact O-N 3.07Å; V519-V548 HydrophobicContact CG1-CB 4.17Å; V519-V548 HydrophobicContact CG1-CG2 3.73Å; V548-Q552 HydrophobicContact CG1-CB 4.03Å; V548-L553 HydrophobicContact CB-CD1 4.48Å; V548-L553 HydrophobicContact CB-CD2 3.93Å; V548-L553 HydrophobicContact CB-CG 4.25Å; V548-L553 HydrophobicContact CG1-CD2 3.73Å; V548-L553 HydrophobicContact CG1-CG 3.95Å
549	P	89	Confident	68.3	Low	26 Å²	26	106.6 Å²	106.6	17%	0.169	55%	0.548	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	138.4	176.8	-21.8	32.2	0	0	0	112.2	H551 Q552	P549-H551 VanDerWaalsContact CB-CE1 3.4Å; P549-H551 WeakPolarHBondContact CB-CE1 3.42Å; P549-H551 PolarHBondContact O-N 2.74Å; P549-H551 VanDerWaalsContact O-N 3.08Å; P549-Q552 HydrophobicContact CB-CG 4.28Å; P549-Q552 PolarHBondContact O-N 3.31Å
550	N	83.4	Confident	66.6	Low	55 Å²	55	109.8 Å²	109.8	29%	0.294	56%	0.559	S	S	.	*	G	3₁₀ helix	trans	-60.2	-27.2	-173.4	-68.5	-12.6	0	0	0	113.5	A514 S515 H516 T517 Q552 L553	A514-N550 PolarHBondContact O-ND2 3.47Å; S515-N550 VanDerWaalsContact C-CG 3.49Å; S515-N550 WeakPolarHBondContact O-CB 3.24Å; S515-N550 VanDerWaalsContact O-CG 3.24Å; S515-N550 PolarHBondContact O-N 2.98Å; H516-N550 WeakPolarHBondContact CA-OD1 3.26Å; T517-N550 PolarHBondContact N-OD1 3.5Å; T517-N550 VanDerWaalsContact N-OD1 3.15Å; T517-N550 PolarHBondContact OG1-OD1 3.25Å; N550-Q552 VanDerWaalsContact C-N 3.26Å; N550-Q552 PolarHBondContact O-N 2.69Å; N550-L553 PolarHBondContact O-N 2.94Å
551	H	77.7	Confident	65.5	Low	158 Å²	158	102.3 Å²	102.3	73%	0.731	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-73.9	-11.1	176.6	68.3	-97.7	0	0	0	114.3	P549	P549-H551 VanDerWaalsContact CB-CE1 3.4Å; P549-H551 WeakPolarHBondContact CB-CE1 3.42Å; P549-H551 PolarHBondContact O-N 2.74Å; P549-H551 VanDerWaalsContact O-N 3.08Å
552	Q	72.4	Confident	64.6	Low	123 Å²	123	102 Å²	102	58%	0.575	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-101.9	-9.5	177.7	-53.9	-177.3	4.5	0	0	112	V548 P549 N550 N554	V548-Q552 HydrophobicContact CG1-CB 4.03Å; P549-Q552 HydrophobicContact CB-CG 4.28Å; P549-Q552 PolarHBondContact O-N 3.31Å; N550-Q552 VanDerWaalsContact C-N 3.26Å; N550-Q552 PolarHBondContact O-N 2.69Å; Q552-N554 PolarHBondContact O-N 3.04Å
553	L	73.1	Confident	63.2	Low	38 Å²	38	102.2 Å²	102.2	20%	0.199	55%	0.548	C	S	.	.	S	Bend	trans	-87.8	101.4	178.6	-66	174.8	0	0	0	109.2	T517 V519 V548 N550 F555	T517-L553 HydrophobicContact CG2-CD1 4.44Å; V519-L553 HydrophobicContact CG1-CD2 3.89Å; V548-L553 HydrophobicContact CB-CD1 4.48Å; V548-L553 HydrophobicContact CB-CD2 3.93Å; V548-L553 HydrophobicContact CB-CG 4.25Å; V548-L553 HydrophobicContact CG1-CD2 3.73Å; V548-L553 HydrophobicContact CG1-CG 3.95Å; N550-L553 PolarHBondContact O-N 2.94Å; L553-F555 HydrophobicContact CB-CD2 3.97Å; L553-F555 HydrophobicContact CB-CE2 4.25Å; L553-F555 PolarHBondContact O-N 2.61Å
554	N	57.4	Low	61.3	Low	158 Å²	158	105.6 Å²	105.6	85%	0.845	57%	0.568	S	S	*	*			trans	-74.7	57.7	-174.3	-164	-2	0	0	0	113.1	Q552	Q552-N554 PolarHBondContact O-N 3.04Å
555	F	54.7	Low	58.7	Low	161 Å²	161	110 Å²	110	71%	0.706	58%	0.58	S	S	*	*			trans	-86.1	120.8	168.5	-74.3	-80.6	0	0	0	109.6	L553 S557	L553-F555 HydrophobicContact CB-CD2 3.97Å; L553-F555 HydrophobicContact CB-CE2 4.25Å; L553-F555 PolarHBondContact O-N 2.61Å; F555-S557 PolarHBondContact O-N 3.15Å
556	K	44.4	Very low	56.5	Low	205 Å²	205	123.6 Å²	123.6	89%	0.891	63%	0.631	S	S	*	*			trans	-67.9	102.4	164.6	-69.9	-176.8	177.7	-179	0	108.4	G558	K556-G558 PolarHBondContact O-N 3.12Å
557	S	44	Very low	54.8	Low	110 Å²	110	125.5 Å²	125.5	77%	0.769	64%	0.639	S	S	*	*			trans	-62.5	97.1	-178.9	-61.1	0	0	0	0	112.1	F555 T559	F555-S557 PolarHBondContact O-N 3.15Å; S557-T559 PolarHBondContact O-N 2.66Å
558	G	36.3	Very low	52.9	Low	66 Å²	66	130.9 Å²	130.9	68%	0.68	67%	0.668	S	S	*	*			trans	-67.4	116.5	166.3	0	0	0	0	0	110	K556 I560	K556-G558 PolarHBondContact O-N 3.12Å; G558-I560 PolarHBondContact O-N 3.45Å
559	T	38.5	Very low	51	Low	137 Å²	137	136.4 Å²	136.4	84%	0.84	69%	0.694	S	S	*	*			trans	-72.7	89.9	178.1	48.8	0	0	0	0	110.7	S557 S561	S557-T559 PolarHBondContact O-N 2.66Å; T559-S561 PolarHBondContact O-N 3.38Å
560	I	35.1	Very low	48.7	Very low	159 Å²	159	142.9 Å²	142.9	82%	0.815	73%	0.725	S	S	*	*			trans	-74.9	107.3	167.7	-61.8	177.2	0	0	0	107.8	G558	G558-I560 PolarHBondContact O-N 3.45Å
561	S	33.6	Very low	46.6	Very low	98 Å²	98	148.4 Å²	148.4	69%	0.685	75%	0.752	S	S	*	*			trans	-71.9	134.1	172.7	42.1	0	0	0	0	110.6	T559 L563	T559-S561 PolarHBondContact O-N 3.38Å; S561-L563 PolarHBondContact O-N 3.26Å
562	H	40.3	Very low	44.5	Very low	185 Å²	185	147.8 Å²	147.8	86%	0.856	75%	0.754	S	S	*	*			trans	-72.9	88	171.7	-81.2	-92.2	0	0	0	110.3	V564	H562-V564 PolarHBondContact O-N 2.96Å
563	L	31.7	Very low	42.5	Very low	138 Å²	138	149.6 Å²	149.6	72%	0.723	77%	0.766	S	S	*	*			trans	-88	99.3	166.3	-150.4	80.4	0	0	0	109.4	S561 Y565	S561-L563 PolarHBondContact O-N 3.26Å; L563-Y565 HydrophobicContact CD2-CD2 4.31Å; L563-Y565 HydrophobicContact CD2-CE2 3.98Å
564	V	35.7	Very low	40.1	Very low	121 Å²	121	158.2 Å²	158.2	73%	0.733	81%	0.81	S	S	*	*			trans	-85.3	110.2	170.8	178	0	0	0	0	107.9	H562	H562-V564 PolarHBondContact O-N 2.96Å
565	Y	28.4	Very low	38.7	Very low	209 Å²	209	158.2 Å²	158.2	82%	0.82	81%	0.807	S	S	*	*			trans	-71.4	141.1	161.5	-101.3	-93.2	0	0	0	109.7	L563	L563-Y565 HydrophobicContact CD2-CD2 4.31Å; L563-Y565 HydrophobicContact CD2-CE2 3.98Å
566	R	41.5	Very low	37.2	Very low	309 Å²	309	157.9 Å²	157.9	100%	1.166	82%	0.816	S	S	*	*			trans	-104.7	0	168.9	-79	-179.2	168.2	168.4	-4.6	109.2

Retrieved 566 of 566 residues in 194.7 ms (Link to these results)

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