A0A077Z1L6_TRITR Loading...

Patatin domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z1L6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 288 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	42	Very low	47	Very low	249 Å²	249	144.2 Å²	144.2	100%	1.227	78%	0.784	S	S	*	*				0	140	0	-81.4	172.6	157.2	0	0	109
2	S	44.3	Very low	47.8	Very low	113 Å²	113	143.8 Å²	143.8	79%	0.79	77%	0.772	S	S	*	*			trans	-49.6	132.6	-156.4	54.3	0	0	0	0	118.6
3	R	42.4	Very low	48.6	Very low	256 Å²	256	137.2 Å²	137.2	97%	0.966	75%	0.745	S	S	*	*			trans	-137.4	106	142.7	-74.7	-170.7	177	-174.6	-1	109
4	S	45	Very low	49.5	Very low	104 Å²	104	132.1 Å²	132.1	73%	0.727	72%	0.724	S	S	*	*			trans	-135.7	144.5	162.1	67	0	0	0	0	109.1
5	R	46.6	Very low	50.5	Low	240 Å²	240	133 Å²	133	91%	0.906	72%	0.718	S	S	*	*			trans	96.9	94.8	170.1	-56.4	-178.4	174.9	-165.5	-2.4	117.3
6	S	48.2	Very low	52.1	Low	110 Å²	110	127.9 Å²	127.9	77%	0.769	69%	0.69	S	S	*	*			trans	-147.4	24.5	154.1	72.7	0	0	0	0	114
7	S	48.3	Very low	53.3	Low	109 Å²	109	127.7 Å²	127.7	76%	0.762	68%	0.681	S	S	*	*			trans	-102.9	-2.2	-170.7	58.9	0	0	0	0	116.8
8	S	51.2	Low	54.3	Low	96 Å²	96	123.5 Å²	123.5	67%	0.671	66%	0.662	S	S	*	*	S	Bend	trans	-94.3	-19.2	-173.9	56.3	0	0	0	0	116.1
9	S	50.6	Low	55.6	Low	85 Å²	85	120.6 Å²	120.6	59%	0.594	66%	0.664	S	S	*	*	H	α-helix	trans	-82.6	-22.9	-174.2	57.3	0	0	0	0	114.5
10	Q	42.6	Very low	57	Low	155 Å²	155	115.5 Å²	115.5	72%	0.724	64%	0.637	S	S	*	*	H	α-helix	trans	-74.4	-33.3	-176.5	-74.1	-175.3	-12.3	0	0	112.9	S13	Q10-S13 PolarHBondContact O-OG 2.98Å
11	S	55.8	Low	58.6	Low	69 Å²	69	113.1 Å²	113.1	48%	0.483	63%	0.629	S	S	.	*	H	α-helix	trans	-75.8	-28.5	-176.4	61.1	0	0	0	0	114.5	S14	S11-S14 PolarHBondContact O-OG 2.92Å
12	E	56.4	Low	61	Low	139 Å²	139	101.3 Å²	101.3	65%	0.65	57%	0.571	S	S	*	*	H	α-helix	trans	-74.7	-39.1	174.1	-76.5	-176.7	160.4	0	0	110.8	S14 K15	E12-S14 PolarHBondContact O-N 2.71Å; E12-K15 PolarHBondContact O-N 2.83Å
13	S	58.4	Low	63.2	Low	59 Å²	59	97.8 Å²	97.8	41%	0.413	55%	0.549	S	S	.	.	H	α-helix	trans	-61.1	-29.9	179.9	84.1	0	0	0	0	113.6	Q10	Q10-S13 PolarHBondContact O-OG 2.98Å
14	S	61.5	Low	65.4	Low	65 Å²	65	88.4 Å²	88.4	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-75.5	-25.9	178.3	57.1	0	0	0	0	112.8	S11 E12 L16	S11-S14 PolarHBondContact O-OG 2.92Å; E12-S14 PolarHBondContact O-N 2.71Å; S14-L16 VanDerWaalsContact C-N 3.26Å; S14-L16 PolarHBondContact O-N 3.45Å
15	K	63.7	Low	67.5	Low	146 Å²	146	88.9 Å²	88.9	64%	0.635	54%	0.535	S	S	*	.	H	α-helix	trans	-75.1	-14.8	178.2	-68.4	-176.3	179.3	-177.1	0	113.1	E12 S20	E12-K15 PolarHBondContact O-N 2.83Å; K15-S20 WeakPolarHBondContact O-CB 3.49Å; K15-S20 PolarHBondContact O-OG 3.29Å
16	L	76.8	Confident	69.6	Low	51 Å²	51	81 Å²	81	27%	0.267	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102	-1.8	-174.6	-59.6	173.9	0	0	0	113.8	S14 R200 R203	S14-L16 VanDerWaalsContact C-N 3.26Å; S14-L16 PolarHBondContact O-N 3.45Å; L16-R200 VanDerWaalsContact CD1-O 3.22Å; L16-R200 WeakPolarHBondContact CD1-O 3.4Å; L16-R203 HydrophobicContact CD2-CB 4.42Å
17	K	73.1	Confident	71.9	Confident	125 Å²	125	79.5 Å²	79.5	54%	0.543	49%	0.492	S	S	.	.	S	Bend	trans	-82.9	151.6	-178.4	-66.6	-179.9	-177	179.8	0	112.1	G19 S20 R203	K17-G19 PolarHBondContact O-N 3.06Å; K17-S20 WeakPolarHBondContact O-CB 2.93Å; K17-S20 PolarHBondContact O-N 3.19Å; K17-S20 PolarHBondContact O-OG 3.16Å; K17-S20 VanDerWaalsContact O-OG 3.09Å; K17-R203 PolarHBondContact O-NE 2.84Å; K17-R203 VanDerWaalsContact O-NE 3.16Å
18	P	71.3	Confident	74.3	Confident	52 Å²	52	74.3 Å²	74.3	34%	0.338	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.4	138.3	161.1	-27.3	35.8	0	0	0	111.4
19	G	77.4	Confident	76.5	Confident	68 Å²	68	69.7 Å²	69.7	70%	0.701	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.9	-11.3	-173.3	0	0	0	0	0	116.3	K17 R203 D216	K17-G19 PolarHBondContact O-N 3.06Å; G19-R203 VanDerWaalsContact N-NH2 3.15Å; G19-D216 PolarHBondContact N-OD1 3Å
20	S	84.9	Confident	78.8	Confident	18 Å²	18	65.7 Å²	65.7	13%	0.126	40%	0.395	C	S	.	.	S	Bend	trans	-72.8	152	170.7	78.1	0	0	0	0	111	K15 K17 R203	K15-S20 WeakPolarHBondContact O-CB 3.49Å; K15-S20 PolarHBondContact O-OG 3.29Å; K17-S20 WeakPolarHBondContact O-CB 2.93Å; K17-S20 PolarHBondContact O-N 3.19Å; K17-S20 PolarHBondContact O-OG 3.16Å; K17-S20 VanDerWaalsContact O-OG 3.09Å; S20-R203 PolarHBondContact O-NE 2.87Å; S20-R203 VanDerWaalsContact O-NE 3.13Å; S20-R203 PolarHBondContact O-NH2 2.82Å; S20-R203 WeakPolarHBondContact OG-CD 3.4Å; S20-R203 PolarHBondContact OG-NE 3.2Å
21	S	89.3	Confident	81.4	Confident	67 Å²	67	58.3 Å²	58.3	47%	0.469	36%	0.361	S	S	.	.			trans	-62.2	140.7	-179.5	179.6	0	0	0	0	111.9	A23 N277	S21-A23 WeakPolarHBondContact OG-CB 3.32Å; S21-A23 PolarHBondContact OG-N 3.11Å; S21-A23 VanDerWaalsContact OG-N 3.15Å; S21-N277 WeakPolarHBondContact CA-OD1 3.22Å
22	I	94.1	Very high	83.5	Confident	0 Å²	0	55 Å²	55	0%	0	34%	0.338	C	S	.	.			trans	-98.7	2.9	172.6	61.8	164.4	0	0	0	113.3	L28 V56 R59 R203 I205 F273 N277 V279	I22-L28 HydrophobicContact CB-CD1 4.32Å; I22-L28 HydrophobicContact CB-CD2 4.27Å; I22-L28 HydrophobicContact CG2-CD2 4.21Å; I22-V56 HydrophobicContact CD1-CG1 4.03Å; I22-V56 HydrophobicContact CD1-CG2 4.43Å; I22-R59 PolarHBondContact O-NH1 3.12Å; I22-R59 PolarHBondContact O-NH2 2.68Å; I22-R203 HydrophobicContact CG2-CG 3.99Å; I22-I205 HydrophobicContact CD1-CD1 3.87Å; I22-I205 HydrophobicContact CD1-CG1 4.36Å; I22-I205 HydrophobicContact CG2-CD1 4.36Å; I22-I205 HydrophobicContact CG2-CG1 3.9Å; I22-F273 HydrophobicContact CD1-CD1 4.49Å; I22-F273 HydrophobicContact CD1-CE1 3.5Å; I22-F273 HydrophobicContact CD1-CZ 3.79Å; I22-F273 HydrophobicContact CG1-CE1 4.4Å; I22-F273 HydrophobicContact CG1-CZ 4.23Å; I22-F273 HydrophobicContact CG2-CZ 4.2Å; I22-N277 HydrophobicContact CD1-CB 4.22Å; I22-N277 HydrophobicContact CG1-CB 3.6Å; I22-N277 PolarHBondContact N-OD1 3.36Å; I22-V279 HydrophobicContact CD1-CG2 3.71Å; I22-V279 HydrophobicContact CG1-CG2 4.06Å
23	A	90.1	Very high	85.4	Confident	39 Å²	39	48.4 Å²	48.4	32%	0.322	31%	0.307	S	S	.	.			trans	-64.1	156.3	178.2	0	0	0	0	0	112.3	S21 H26 V279	S21-A23 WeakPolarHBondContact OG-CB 3.32Å; S21-A23 PolarHBondContact OG-N 3.11Å; S21-A23 VanDerWaalsContact OG-N 3.15Å; A23-H26 PolarHBondContact O-CE1 2.95Å; A23-H26 PolarHBondContact O-ND1 2.76Å; A23-V279 HydrophobicContact CB-CG1 4.48Å
24	G	88.2	Confident	87.3	Confident	60 Å²	60	45.9 Å²	45.9	62%	0.619	29%	0.291	S	S	*	.	S	Bend	trans	97.7	-154.9	180	0	0	0	0	0	113.7	R59	G24-R59 PolarHBondContact O-NE 3.25Å; G24-R59 PolarHBondContact O-NH1 3.27Å
25	S	88.2	Confident	89	Confident	113 Å²	113	43 Å²	43	79%	0.79	27%	0.27	S	S	*	.	S	Bend	trans	-117.6	8.3	-170.9	58	0	0	0	0	114.7
26	H	92	Very high	90.5	Very high	75 Å²	75	37.2 Å²	37.2	35%	0.347	25%	0.252	S	S	.	.			trans	-72.5	152.3	-178.2	61.3	-88.4	0	0	0	111.9	A23 L28 R59	A23-H26 PolarHBondContact O-CE1 2.95Å; A23-H26 PolarHBondContact O-ND1 2.76Å; H26-L28 WeakPolarHBondContact NE2-CD2 3.07Å; H26-R59 PolarHBondContact CE1-NH2 2.96Å; H26-R59 PolarHBondContact ND1-NH2 3.04Å; H26-R59 VanDerWaalsContact O-CZ 3.27Å; H26-R59 PolarHBondContact O-NE 3.1Å; H26-R59 PolarHBondContact O-NH2 3.3Å
27	D	96.2	Very high	91.4	Very high	78 Å²	78	35.3 Å²	35.3	42%	0.417	24%	0.241	S	C	.	.			trans	-64.6	142.7	176.1	-75.2	-15	0	0	0	111.4	K61 L202	D27-K61 HydrophobicContact CB-CG 3.81Å; D27-K61 WeakPolarHBondContact OD1-CE 3.47Å; D27-K61 IonicContact OD1-NZ 3.44Å; D27-K61 WeakPolarHBondContact OD2-CE 3.37Å; D27-L202 HydrophobicContact CB-CD2 3.69Å
28	L	97.7	Very high	92.6	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	167.5	-176.7	-64.9	175.5	0	0	0	111.1	I22 H26 V56 R59 C60 K61 R203 I205	I22-L28 HydrophobicContact CB-CD1 4.32Å; I22-L28 HydrophobicContact CB-CD2 4.27Å; I22-L28 HydrophobicContact CG2-CD2 4.21Å; H26-L28 WeakPolarHBondContact NE2-CD2 3.07Å; L28-V56 HydrophobicContact CD1-CG1 3.62Å; L28-R59 HydrophobicContact CD1-CB 4.21Å; L28-R59 HydrophobicContact CG-CB 4.32Å; L28-R59 PolarHBondContact N-O 2.76Å; L28-C60 CarbonylContact O-C 3.07Å; L28-C60 VanDerWaalsContact O-CA 3.32Å; L28-C60 WeakPolarHBondContact O-CA 3.38Å; L28-K61 PolarHBondContact O-N 3.13Å; L28-R203 HydrophobicContact CD2-CB 3.92Å; L28-R203 HydrophobicContact CD2-CG 4.09Å; L28-I205 HydrophobicContact CD1-CD1 4.25Å
29	A	98.1	Very high	93.8	Very high	0 Å²	0	27 Å²	27	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	160.6	160.5	0	0	0	0	0	109.7	R62 F199 L202 R203 T204 I205	A29-R62 CarbonylContact C-O 3.51Å; A29-R62 WeakPolarHBondContact CA-O 3.21Å; A29-R62 HydrophobicContact CB-CB 3.95Å; A29-R62 WeakPolarHBondContact CB-O 3.45Å; A29-F199 HydrophobicContact CB-CD2 3.44Å; A29-F199 VanDerWaalsContact CB-CD2 3.44Å; A29-F199 HydrophobicContact CB-CE2 3.83Å; A29-F199 HydrophobicContact CB-CG 4.44Å; A29-L202 HydrophobicContact CB-CB 4.16Å; A29-L202 HydrophobicContact CB-CD1 4.26Å; A29-R203 PolarHBondContact N-O 2.83Å; A29-T204 HydrophobicContact CB-CG2 4.05Å; A29-T204 CarbonylContact O-C 3.59Å; A29-T204 VanDerWaalsContact O-CA 3.29Å; A29-T204 WeakPolarHBondContact O-CA 3.48Å; A29-I205 PolarHBondContact O-N 2.92Å
30	I	98.5	Very high	94.8	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	140.6	173.2	-170.2	168.4	0	0	0	109.7	F32 M49 R62 F63 A64 L76 I205 I207	I30-F32 HydrophobicContact CD1-CE1 4.5Å; I30-F32 HydrophobicContact CD1-CE2 3.95Å; I30-F32 HydrophobicContact CD1-CZ 3.6Å; I30-F32 HydrophobicContact CG1-CE2 3.79Å; I30-F32 HydrophobicContact CG1-CZ 3.9Å; I30-F32 HydrophobicContact CG2-CE2 4.25Å; I30-M49 HydrophobicContact CD1-CE 4.25Å; I30-M49 HydrophobicContact CD1-CG 4.36Å; I30-R62 PolarHBondContact N-O 2.87Å; I30-F63 HydrophobicContact CG2-CB 4.3Å; I30-F63 HydrophobicContact CG2-CD1 3.22Å; I30-F63 HydrophobicContact CG2-CD2 4.4Å; I30-F63 HydrophobicContact CG2-CE1 3.44Å; I30-F63 VanDerWaalsContact CG2-CE1 3.44Å; I30-F63 HydrophobicContact CG2-CG 3.74Å; I30-F63 HydrophobicContact CG2-CZ 4.13Å; I30-F63 CarbonylContact O-C 3.26Å; I30-F63 WeakPolarHBondContact O-CA 3.48Å; I30-A64 PolarHBondContact O-N 3.2Å; I30-L76 HydrophobicContact CD1-CD2 4.26Å; I30-I205 CarbonylContact C-O 3.57Å; I30-I205 WeakPolarHBondContact CA-O 3.4Å; I30-I205 HydrophobicContact CG1-CB 4.26Å; I30-I205 HydrophobicContact CG1-CG2 4.47Å; I30-I207 HydrophobicContact CD1-CD1 3.85Å; I30-I207 HydrophobicContact CG1-CD1 3.46Å; I30-I207 VanDerWaalsContact CG1-CD1 3.46Å
31	S	98.5	Very high	95.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	133.3	-174.5	-173	0	0	0	0	112.7	A64 P197 I205 I207	S31-A64 VanDerWaalsContact CA-O 3.29Å; S31-A64 WeakPolarHBondContact CA-O 3.39Å; S31-P197 WeakPolarHBondContact CB-O 3.26Å; S31-P197 WeakPolarHBondContact OG-CD 3.33Å; S31-P197 PolarHBondContact OG-O 2.84Å; S31-I205 PolarHBondContact N-O 3.37Å; S31-I207 WeakPolarHBondContact O-CD1 3.38Å; S31-I207 PolarHBondContact O-N 3.39Å
32	F	98.6	Very high	95.9	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	127.6	-177.5	-58.1	-94.1	0	0	0	110.1	I30 H42 A64 G65 A66 G69 V72 A73 L76 I207	I30-F32 HydrophobicContact CD1-CE1 4.5Å; I30-F32 HydrophobicContact CD1-CE2 3.95Å; I30-F32 HydrophobicContact CD1-CZ 3.6Å; I30-F32 HydrophobicContact CG1-CE2 3.79Å; I30-F32 HydrophobicContact CG1-CZ 3.9Å; I30-F32 HydrophobicContact CG2-CE2 4.25Å; F32-H42 HydrophobicContact CD1-CB 3.9Å; F32-H42 AromaticContact CD1-CG 3.82Å; F32-H42 AromaticContact CD1-ND1 3.63Å; F32-H42 HydrophobicContact CE1-CB 4.47Å; F32-A64 PolarHBondContact N-O 3.21Å; F32-G65 WeakPolarHBondContact O-CA 3.34Å; F32-A66 PolarHBondContact O-N 3.08Å; F32-G69 VanDerWaalsContact CB-CA 3.48Å; F32-V72 HydrophobicContact CE1-CG1 4.31Å; F32-V72 HydrophobicContact CZ-CG1 4.44Å; F32-A73 HydrophobicContact CD2-CB 3.95Å; F32-A73 HydrophobicContact CE2-CB 4.34Å; F32-L76 HydrophobicContact CE2-CD2 4.08Å; F32-L76 HydrophobicContact CZ-CD2 3.74Å; F32-I207 HydrophobicContact CD1-CB 3.77Å; F32-I207 HydrophobicContact CD1-CD1 4Å; F32-I207 HydrophobicContact CD1-CG1 4.09Å; F32-I207 HydrophobicContact CD1-CG2 4.09Å; F32-I207 HydrophobicContact CE1-CB 4.16Å; F32-I207 HydrophobicContact CE1-CD1 3.8Å; F32-I207 HydrophobicContact CE1-CG1 3.97Å; F32-I207 HydrophobicContact CE1-CG2 4.41Å; F32-I207 HydrophobicContact CG-CD1 4.47Å; F32-I207 HydrophobicContact CZ-CD1 4.09Å
33	C	97.8	Very high	96.1	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	14%	0.14	C	C	.	.			trans	-74.1	161.3	-178.1	83.8	0	0	0	0	113.8	H42 N195 L196 I207 P209	C33-H42 PolarHBondContact O-NE2 2.87Å; C33-N195 CarbonylContact C-O 3.53Å; C33-N195 WeakPolarHBondContact CA-O 3.36Å; C33-N195 WeakPolarHBondContact CB-O 3.15Å; C33-L196 HydrophobicContact CB-CB 3.92Å; C33-L196 HydrophobicContact CB-CD1 3.96Å; C33-L196 HydrophobicContact CB-CG 4.44Å; C33-I207 PolarHBondContact N-O 2.96Å; C33-P209 VanDerWaalsContact SG-CD 3.56Å
34	G	97.4	Very high	96.5	Very high	7 Å²	7	18 Å²	18	7%	0.072	13%	0.125	C	C	.	.			trans	-68.8	135.1	167.8	0	0	0	0	0	111.9	A66 N195	G34-A66 WeakPolarHBondContact CA-O 3.26Å; G34-A66 PolarHBondContact N-O 3.37Å; G34-N195 WeakPolarHBondContact CA-OD1 3.43Å; G34-N195 PolarHBondContact N-O 3.05Å; G34-N195 VanDerWaalsContact N-O 3.16Å; G34-N195 PolarHBondContact N-OD1 3.41Å; G34-N195 PolarHBondContact O-ND2 2.69Å; G34-N195 VanDerWaalsContact O-ND2 3.16Å; G34-N195 PolarHBondContact O-OD1 2.91Å
35	C	96.6	Very high	97	Very high	5 Å²	5	15.2 Å²	15.2	3%	0.034	10%	0.096	C	C	.	.			trans	-161.9	13.8	-173.5	65.3	0	0	0	0	115.8	F37 L38 G39 H42 P209 F210 A250	C35-F37 PolarHBondContact O-N 3.23Å; C35-L38 HydrophobicContact CB-CB 4.04Å; C35-L38 WeakPolarHBondContact O-CB 2.88Å; C35-L38 PolarHBondContact O-N 2.89Å; C35-L38 VanDerWaalsContact SG-C 3.52Å; C35-G39 PolarHBondContact SG-N 2.82Å; C35-G39 VanDerWaalsContact SG-N 3.41Å; C35-H42 PolarHBondContact SG-CD2 2.71Å; C35-H42 PolarHBondContact SG-NE2 3.4Å; C35-P209 HydrophobicContact CB-CG 3.43Å; C35-P209 VanDerWaalsContact CB-CG 3.43Å; C35-F210 HydrophobicContact CB-CE2 3.76Å; C35-F210 HydrophobicContact CB-CZ 4.08Å; C35-A250 WeakPolarHBondContact O-CA 3.02Å; C35-A250 WeakPolarHBondContact O-CB 3.34Å
36	G	95.7	Very high	97.5	Very high	23 Å²	23	9.8 Å²	9.8	24%	0.237	6%	0.058	C	C	.	.	G	3₁₀ helix	trans	50.1	-126.2	177.3	0	0	0	0	0	113.8	L38 G39 A68 A250	G36-L38 PolarHBondContact O-N 3.07Å; G36-L38 VanDerWaalsContact O-N 3.14Å; G36-G39 PolarHBondContact O-N 3.16Å; G36-A68 WeakPolarHBondContact O-CB 3.41Å; G36-A250 WeakPolarHBondContact CA-O 3.44Å
37	F	96.8	Very high	97.8	Very high	11 Å²	11	11.7 Å²	11.7	5%	0.048	6%	0.062	C	C	.	.	G	3₁₀ helix	trans	-63	-18	-179.3	-72.5	-73.5	0	0	0	114.6	C35 G39 V90 L93 A94 V97 L104 A250 P253 L259	C35-F37 PolarHBondContact O-N 3.23Å; F37-G39 PolarHBondContact O-N 3.45Å; F37-G39 VanDerWaalsContact O-N 3.17Å; F37-V90 HydrophobicContact CD1-CG1 4.28Å; F37-L93 HydrophobicContact CE1-CB 4.41Å; F37-L93 HydrophobicContact CE1-CD2 4.17Å; F37-L93 HydrophobicContact CE1-CG 4.04Å; F37-L93 HydrophobicContact CZ-CG 4.46Å; F37-A94 HydrophobicContact CD1-CB 3.89Å; F37-A94 HydrophobicContact CE1-CB 3.92Å; F37-V97 HydrophobicContact CZ-CB 4.21Å; F37-V97 HydrophobicContact CZ-CG1 4.31Å; F37-V97 HydrophobicContact CZ-CG2 4.02Å; F37-L104 HydrophobicContact CE2-CD1 4.1Å; F37-L104 HydrophobicContact CE2-CD2 4.25Å; F37-L104 HydrophobicContact CE2-CG 4.39Å; F37-L104 HydrophobicContact CZ-CD2 4.25Å; F37-A250 PolarHBondContact N-O 2.86Å; F37-P253 HydrophobicContact CB-CB 4.36Å; F37-P253 HydrophobicContact CD1-CB 3.99Å; F37-P253 HydrophobicContact CD2-CB 3.82Å; F37-P253 HydrophobicContact CD2-CG 4.02Å; F37-P253 HydrophobicContact CE1-CB 4.23Å; F37-P253 HydrophobicContact CE1-CG 4.34Å; F37-P253 HydrophobicContact CE2-CB 4.05Å; F37-P253 HydrophobicContact CE2-CG 3.77Å; F37-P253 HydrophobicContact CG-CB 3.79Å; F37-P253 HydrophobicContact CG-CG 4.42Å; F37-P253 HydrophobicContact CZ-CB 4.26Å; F37-P253 HydrophobicContact CZ-CG 3.95Å; F37-L259 HydrophobicContact CB-CD2 4.44Å
38	L	97.5	Very high	97.9	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.042	C	C	.	.	G	3₁₀ helix	trans	-74.2	3.9	171.6	-54.3	-169.8	0	0	0	112.8	C35 G36 L40 Y41 P209 F210 R246 Q249 A250 Y262	C35-L38 HydrophobicContact CB-CB 4.04Å; C35-L38 WeakPolarHBondContact O-CB 2.88Å; C35-L38 PolarHBondContact O-N 2.89Å; C35-L38 VanDerWaalsContact SG-C 3.52Å; G36-L38 PolarHBondContact O-N 3.07Å; G36-L38 VanDerWaalsContact O-N 3.14Å; L38-L40 PolarHBondContact O-N 3.07Å; L38-Y41 VanDerWaalsContact O-CB 3.26Å; L38-Y41 WeakPolarHBondContact O-CB 3.49Å; L38-Y41 PolarHBondContact O-N 3.15Å; L38-P209 HydrophobicContact CB-CB 4.03Å; L38-P209 HydrophobicContact CB-CG 3.91Å; L38-P209 HydrophobicContact CD1-CB 4.21Å; L38-P209 HydrophobicContact CD1-CG 4.29Å; L38-F210 HydrophobicContact CD1-CE1 4.23Å; L38-F210 HydrophobicContact CD1-CZ 4.43Å; L38-R246 HydrophobicContact CD1-CB 3.7Å; L38-R246 HydrophobicContact CD1-CG 4.09Å; L38-R246 WeakPolarHBondContact CD1-O 3.5Å; L38-Q249 HydrophobicContact CD2-CB 3.96Å; L38-A250 HydrophobicContact CD1-CB 4.45Å; L38-A250 HydrophobicContact CG-CB 4.26Å; L38-Y262 HydrophobicContact CD1-CE1 4.37Å; L38-Y262 HydrophobicContact CD2-CD1 4.32Å; L38-Y262 HydrophobicContact CD2-CD2 3.6Å; L38-Y262 HydrophobicContact CD2-CE1 4.16Å; L38-Y262 HydrophobicContact CD2-CE2 3.4Å; L38-Y262 VanDerWaalsContact CD2-CE2 3.4Å; L38-Y262 HydrophobicContact CD2-CG 4.07Å
39	G	97.5	Very high	97.9	Very high	3 Å²	3	8 Å²	8	3%	0.031	4%	0.042	C	C	.	.	H	α-helix	trans	-55.8	-18	169.8	0	0	0	0	0	113.8	C35 G36 F37 Y41 H42 C43	C35-G39 PolarHBondContact SG-N 2.82Å; C35-G39 VanDerWaalsContact SG-N 3.41Å; G36-G39 PolarHBondContact O-N 3.16Å; F37-G39 PolarHBondContact O-N 3.45Å; F37-G39 VanDerWaalsContact O-N 3.17Å; G39-Y41 VanDerWaalsContact C-N 3.27Å; G39-Y41 PolarHBondContact O-N 3.05Å; G39-H42 WeakPolarHBondContact O-CA 2.88Å; G39-H42 WeakPolarHBondContact O-CB 3.35Å; G39-H42 PolarHBondContact O-N 3.09Å; G39-H42 VanDerWaalsContact O-N 3.07Å; G39-C43 PolarHBondContact O-N 3.04Å; G39-C43 PolarHBondContact O-SG 3.06Å; G39-C43 VanDerWaalsContact O-SG 3.33Å
40	L	98	Very high	97.8	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60.3	-34.9	169.2	-83.2	167.2	0	0	0	113.1	L38 H42 C43 G44 A87 V90 L91 L259 L263	L38-L40 PolarHBondContact O-N 3.07Å; L40-H42 VanDerWaalsContact C-N 3.27Å; L40-H42 PolarHBondContact O-N 2.63Å; L40-C43 WeakPolarHBondContact O-CB 3.5Å; L40-C43 PolarHBondContact O-N 2.74Å; L40-G44 PolarHBondContact O-N 2.72Å; L40-A87 HydrophobicContact CD2-CB 3.59Å; L40-A87 WeakPolarHBondContact CD2-O 3.48Å; L40-V90 HydrophobicContact CD1-CB 4.45Å; L40-V90 HydrophobicContact CD1-CG1 3.96Å; L40-V90 HydrophobicContact CD2-CB 4.37Å; L40-V90 HydrophobicContact CG-CB 4.09Å; L40-V90 HydrophobicContact CG-CG1 3.8Å; L40-L91 HydrophobicContact CD1-CD2 3.77Å; L40-L91 HydrophobicContact CD1-CG 3.9Å; L40-L91 HydrophobicContact CD2-CG 4.43Å; L40-L259 HydrophobicContact CD1-CB 3.59Å; L40-L259 HydrophobicContact CD1-CD1 4.38Å; L40-L259 HydrophobicContact CD1-CD2 4.1Å; L40-L259 HydrophobicContact CD1-CG 4.23Å; L40-L263 HydrophobicContact CB-CB 4.27Å; L40-L263 HydrophobicContact CD2-CB 4.32Å; L40-L263 HydrophobicContact CD2-CD1 4.14Å; L40-L263 HydrophobicContact CD2-CD2 4.42Å; L40-L263 WeakPolarHBondContact O-CA 3.13Å; L40-L263 VanDerWaalsContact O-CD1 3.31Å; L40-L263 WeakPolarHBondContact O-CD1 3.35Å
41	Y	98.7	Very high	97.7	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-58.9	-42.4	171.4	-174.6	-86	0	0	0	111.4	L38 G39 G44 A45 I207 P209 V217 S218 Y262 R265 G266 D269	L38-Y41 VanDerWaalsContact O-CB 3.26Å; L38-Y41 WeakPolarHBondContact O-CB 3.49Å; L38-Y41 PolarHBondContact O-N 3.15Å; G39-Y41 VanDerWaalsContact C-N 3.27Å; G39-Y41 PolarHBondContact O-N 3.05Å; Y41-G44 PolarHBondContact O-N 3.17Å; Y41-A45 PolarHBondContact O-N 3.46Å; Y41-I207 HydrophobicContact CD1-CG2 4.09Å; Y41-I207 HydrophobicContact CE1-CG2 3.79Å; Y41-P209 HydrophobicContact CD1-CB 3.98Å; Y41-P209 HydrophobicContact CD2-CB 4.21Å; Y41-P209 HydrophobicContact CG-CB 3.73Å; Y41-V217 HydrophobicContact CE1-CG1 4.43Å; Y41-S218 WeakPolarHBondContact OH-CA 3.44Å; Y41-Y262 WeakPolarHBondContact CA-O 3.5Å; Y41-Y262 HydrophobicContact CD2-CD1 4.45Å; Y41-R265 HydrophobicContact CD2-CB 4.4Å; Y41-R265 HydrophobicContact CD2-CG 4.42Å; Y41-R265 HydrophobicContact CE2-CB 4.3Å; Y41-R265 HydrophobicContact CE2-CG 3.9Å; Y41-G266 WeakPolarHBondContact O-CA 3.49Å; Y41-D269 WeakPolarHBondContact CE2-OD2 3.42Å; Y41-D269 VanDerWaalsContact OH-CB 3.24Å; Y41-D269 WeakPolarHBondContact OH-CB 3.11Å; Y41-D269 PolarHBondContact OH-OD2 2.85Å
42	H	98.5	Very high	97.6	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.6	-37.7	176.3	-63.2	-35.2	0	0	0	112	F32 C33 C35 G39 L40 G44 A45 A46 V72 I207	F32-H42 HydrophobicContact CD1-CB 3.9Å; F32-H42 AromaticContact CD1-CG 3.82Å; F32-H42 AromaticContact CD1-ND1 3.63Å; F32-H42 HydrophobicContact CE1-CB 4.47Å; C33-H42 PolarHBondContact O-NE2 2.87Å; C35-H42 PolarHBondContact SG-CD2 2.71Å; C35-H42 PolarHBondContact SG-NE2 3.4Å; G39-H42 WeakPolarHBondContact O-CA 2.88Å; G39-H42 WeakPolarHBondContact O-CB 3.35Å; G39-H42 PolarHBondContact O-N 3.09Å; G39-H42 VanDerWaalsContact O-N 3.07Å; L40-H42 VanDerWaalsContact C-N 3.27Å; L40-H42 PolarHBondContact O-N 2.63Å; H42-G44 VanDerWaalsContact C-N 3.3Å; H42-G44 PolarHBondContact O-N 3.21Å; H42-A45 PolarHBondContact O-N 2.86Å; H42-A46 VanDerWaalsContact O-CB 3.23Å; H42-A46 WeakPolarHBondContact O-CB 3.48Å; H42-A46 PolarHBondContact O-N 3.17Å; H42-V72 HydrophobicContact CB-CB 4.11Å; H42-V72 HydrophobicContact CB-CG1 4.03Å; H42-V72 HydrophobicContact CB-CG2 3.88Å; H42-I207 PolarHBondContact CE1-O 2.81Å
43	C	98.6	Very high	97.6	Very high	3 Å²	3	14 Å²	14	2%	0.02	8%	0.077	C	C	.	.	H	α-helix	trans	-60.4	-41.7	173.5	-62	0	0	0	0	111.2	G39 L40 A46 R47 I83 A87 L263	G39-C43 PolarHBondContact O-N 3.04Å; G39-C43 PolarHBondContact O-SG 3.06Å; G39-C43 VanDerWaalsContact O-SG 3.33Å; L40-C43 WeakPolarHBondContact O-CB 3.5Å; L40-C43 PolarHBondContact O-N 2.74Å; C43-A46 PolarHBondContact O-N 3.05Å; C43-R47 WeakPolarHBondContact O-CB 3.36Å; C43-R47 PolarHBondContact O-N 2.78Å; C43-I83 HydrophobicContact CB-CG2 4.13Å; C43-I83 WeakPolarHBondContact O-CG2 3.37Å; C43-A87 HydrophobicContact CB-CB 4.06Å; C43-L263 HydrophobicContact CB-CD1 3.78Å
44	G	98.6	Very high	97.4	Very high	1 Å²	1	17 Å²	17	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-63.1	-47.3	176.2	0	0	0	0	0	112.4	L40 Y41 H42 R47 C48 L263 F267	L40-G44 PolarHBondContact O-N 2.72Å; Y41-G44 PolarHBondContact O-N 3.17Å; H42-G44 VanDerWaalsContact C-N 3.3Å; H42-G44 PolarHBondContact O-N 3.21Å; G44-R47 PolarHBondContact O-N 3.2Å; G44-C48 PolarHBondContact O-N 2.8Å; G44-L263 VanDerWaalsContact CA-O 3.3Å; G44-L263 WeakPolarHBondContact CA-O 3.36Å; G44-F267 WeakPolarHBondContact O-CA 3.25Å
45	A	98.6	Very high	97.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62	-44	176.1	0	0	0	0	0	111.9	Y41 H42 C48 M49 I207 G266 M270	Y41-A45 PolarHBondContact O-N 3.46Å; H42-A45 PolarHBondContact O-N 2.86Å; A45-C48 PolarHBondContact O-N 2.92Å; A45-M49 WeakPolarHBondContact O-CG 3.46Å; A45-M49 PolarHBondContact O-N 3.1Å; A45-I207 HydrophobicContact CB-CG2 3.96Å; A45-G266 WeakPolarHBondContact CA-O 3.27Å; A45-G266 PolarHBondContact N-O 3.07Å; A45-M270 HydrophobicContact CB-CB 4.14Å; A45-M270 HydrophobicContact CB-CE 3.95Å
46	A	98.5	Very high	97.3	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.5	-44.9	176.7	0	0	0	0	0	111.6	H42 C43 C48 M49 T50 V72 L76 I83	H42-A46 VanDerWaalsContact O-CB 3.23Å; H42-A46 WeakPolarHBondContact O-CB 3.48Å; H42-A46 PolarHBondContact O-N 3.17Å; C43-A46 PolarHBondContact O-N 3.05Å; A46-C48 VanDerWaalsContact C-N 3.32Å; A46-C48 PolarHBondContact O-N 3.33Å; A46-M49 WeakPolarHBondContact O-CB 2.93Å; A46-M49 PolarHBondContact O-N 2.71Å; A46-T50 PolarHBondContact O-N 2.78Å; A46-T50 PolarHBondContact O-OG1 3.26Å; A46-T50 VanDerWaalsContact O-OG1 3.11Å; A46-V72 HydrophobicContact CB-CG1 3.74Å; A46-L76 HydrophobicContact CB-CD1 4.24Å; A46-L76 HydrophobicContact CB-CD2 4.24Å; A46-I83 HydrophobicContact CB-CD1 4Å; A46-I83 HydrophobicContact CB-CG1 4.32Å; A46-I83 HydrophobicContact CB-CG2 4.22Å
47	R	97.7	Very high	97.4	Very high	114 Å²	114	19.4 Å²	19.4	43%	0.43	11%	0.108	S	C	.	.	H	α-helix	trans	-58.6	-44.1	174.5	-179.2	178.7	171.5	178	-7.9	111.6	C43 G44 M49 T50 V51 I83 D84 F267	C43-R47 WeakPolarHBondContact O-CB 3.36Å; C43-R47 PolarHBondContact O-N 2.78Å; G44-R47 PolarHBondContact O-N 3.2Å; R47-M49 VanDerWaalsContact C-N 3.34Å; R47-M49 PolarHBondContact O-N 3.19Å; R47-T50 PolarHBondContact O-N 2.78Å; R47-V51 VanDerWaalsContact O-CG2 3.29Å; R47-V51 WeakPolarHBondContact O-CG2 3.31Å; R47-V51 PolarHBondContact O-N 3Å; R47-V51 VanDerWaalsContact O-N 3.11Å; R47-I83 HydrophobicContact CB-CG2 4.35Å; R47-D84 WeakPolarHBondContact CD-OD1 3.4Å; R47-D84 IonicContact CZ-OD1 3.4Å; R47-D84 IonicContact NE-OD1 3.1Å; R47-D84 IonicContact NH1-OD1 2.68Å; R47-D84 PolarHBondContact NH1-OD1 2.81Å; R47-F267 HydrophobicContact CB-CD2 4.3Å; R47-F267 HydrophobicContact CG-CD2 4.14Å; R47-F267 HydrophobicContact CG-CE2 4.14Å
48	C	98.1	Very high	97.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.1	-43.3	176.2	-174	0	0	0	0	111.9	G44 A45 A46 T50 V51 H52 F267 M270 M271	G44-C48 PolarHBondContact O-N 2.8Å; A45-C48 PolarHBondContact O-N 2.92Å; A46-C48 VanDerWaalsContact C-N 3.32Å; A46-C48 PolarHBondContact O-N 3.33Å; C48-T50 PolarHBondContact O-N 2.78Å; C48-V51 PolarHBondContact O-N 3.41Å; C48-H52 WeakPolarHBondContact O-CB 3.46Å; C48-H52 PolarHBondContact O-N 2.93Å; C48-F267 HydrophobicContact CB-CD2 3.59Å; C48-F267 HydrophobicContact CB-CE2 3.82Å; C48-F267 HydrophobicContact CB-CG 3.97Å; C48-F267 HydrophobicContact CB-CZ 4.37Å; C48-M270 HydrophobicContact CB-CB 3.82Å; C48-M270 HydrophobicContact CB-CG 3.73Å; C48-M271 PolarHBondContact SG-N 2.96Å; C48-M271 VanDerWaalsContact SG-N 3.39Å
49	M	97.6	Very high	97.3	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.4	-42.7	176.3	-71.6	-68.1	-63.7	0	0	112.4	I30 A45 A46 R47 V51 G53 S54 V56 L57 M270 L274	I30-M49 HydrophobicContact CD1-CE 4.25Å; I30-M49 HydrophobicContact CD1-CG 4.36Å; A45-M49 WeakPolarHBondContact O-CG 3.46Å; A45-M49 PolarHBondContact O-N 3.1Å; A46-M49 WeakPolarHBondContact O-CB 2.93Å; A46-M49 PolarHBondContact O-N 2.71Å; R47-M49 VanDerWaalsContact C-N 3.34Å; R47-M49 PolarHBondContact O-N 3.19Å; M49-V51 VanDerWaalsContact C-N 3.29Å; M49-V51 PolarHBondContact O-N 2.66Å; M49-G53 CarbonylContact O-C 3.53Å; M49-G53 VanDerWaalsContact O-CA 3.23Å; M49-G53 WeakPolarHBondContact O-CA 3.44Å; M49-G53 PolarHBondContact O-N 2.83Å; M49-S54 PolarHBondContact O-N 3.32Å; M49-V56 HydrophobicContact CE-CB 3.91Å; M49-V56 HydrophobicContact CE-CG1 3.71Å; M49-L57 HydrophobicContact CB-CD1 3.9Å; M49-L57 HydrophobicContact CB-CD2 3.99Å; M49-L57 HydrophobicContact CB-CG 3.99Å; M49-L57 HydrophobicContact CE-CD2 3.57Å; M49-L57 HydrophobicContact CE-CG 3.76Å; M49-M270 HydrophobicContact CG-CE 3.78Å; M49-M270 HydrophobicContact CG-CG 3.94Å; M49-M270 HydrophobicContact CG-SD 3.87Å; M49-M270 HydrophobicContact SD-CE 3.96Å; M49-M270 HydrophobicContact SD-CG 4.06Å; M49-M270 HydrophobicContact SD-SD 3.46Å; M49-L274 HydrophobicContact SD-CD1 4.32Å; M49-L274 HydrophobicContact SD-CD2 3.93Å; M49-L274 HydrophobicContact SD-CG 4.46Å
50	T	96.6	Very high	97.3	Very high	51 Å²	51	24.5 Å²	24.5	31%	0.313	14%	0.144	S	C	.	.	H	α-helix	trans	-62.7	-37.1	177.8	-55.6	0	0	0	0	111.9	A46 R47 C48	A46-T50 PolarHBondContact O-N 2.78Å; A46-T50 PolarHBondContact O-OG1 3.26Å; A46-T50 VanDerWaalsContact O-OG1 3.11Å; R47-T50 PolarHBondContact O-N 2.78Å; C48-T50 PolarHBondContact O-N 2.78Å
51	V	95.8	Very high	97.3	Very high	54 Å²	54	29.2 Å²	29.2	33%	0.327	17%	0.165	S	C	.	.	H	α-helix	trans	-87.9	-39.8	-174.6	179.3	0	0	0	0	113.1	R47 C48 M49 L283	R47-V51 VanDerWaalsContact O-CG2 3.29Å; R47-V51 WeakPolarHBondContact O-CG2 3.31Å; R47-V51 PolarHBondContact O-N 3Å; R47-V51 VanDerWaalsContact O-N 3.11Å; C48-V51 PolarHBondContact O-N 3.41Å; M49-V51 VanDerWaalsContact C-N 3.29Å; M49-V51 PolarHBondContact O-N 2.66Å; V51-L283 HydrophobicContact CG1-CD2 3.66Å; V51-L283 HydrophobicContact CG1-CG 4.28Å
52	H	97.3	Very high	97.3	Very high	21 Å²	21	32 Å²	32	10%	0.097	18%	0.175	C	C	.	.	H	α-helix	trans	-124.4	-0.7	-167.7	-63.5	-62	0	0	0	114.2	C48 F267 L274 F280 E281	C48-H52 WeakPolarHBondContact O-CB 3.46Å; C48-H52 PolarHBondContact O-N 2.93Å; H52-F267 AromaticContact CD2-CZ 3.72Å; H52-F267 AromaticContact NE2-CZ 3.77Å; H52-L274 HydrophobicContact CB-CD1 4.12Å; H52-F280 HydrophobicContact CB-CD2 3.83Å; H52-F280 HydrophobicContact CB-CE2 3.55Å; H52-F280 HydrophobicContact CB-CZ 4.23Å; H52-F280 AromaticContact CD2-CE2 3.9Å; H52-F280 AromaticContact CE1-CZ 3.79Å; H52-F280 AromaticContact CG-CE2 3.42Å; H52-F280 VanDerWaalsContact CG-CE2 3.42Å; H52-F280 AromaticContact CG-CZ 3.76Å; H52-F280 AromaticContact ND1-CE2 3.64Å; H52-F280 AromaticContact ND1-CZ 3.44Å; H52-F280 WeakPolarHBondContact ND1-CZ 3.48Å; H52-E281 PolarHBondContact ND1-O 3.22Å; H52-E281 WeakPolarHBondContact O-CB 3.17Å; H52-E281 PolarHBondContact O-N 2.91Å
53	G	96.9	Very high	97.3	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.177	C	C	.	.			trans	-135.5	31.9	-176.5	0	0	0	0	0	112.4	M49 S55 V56 L57	M49-G53 CarbonylContact O-C 3.53Å; M49-G53 VanDerWaalsContact O-CA 3.23Å; M49-G53 WeakPolarHBondContact O-CA 3.44Å; M49-G53 PolarHBondContact O-N 2.83Å; G53-S55 VanDerWaalsContact C-N 3.35Å; G53-S55 PolarHBondContact O-N 2.51Å; G53-V56 WeakPolarHBondContact O-CA 3.49Å; G53-V56 WeakPolarHBondContact O-CB 3.08Å; G53-V56 PolarHBondContact O-N 3.41Å; G53-L57 PolarHBondContact O-N 3.45Å
54	S	94.8	Very high	97.3	Very high	64 Å²	64	32.3 Å²	32.3	45%	0.448	18%	0.176	S	C	.	.	H	α-helix	trans	-64.7	-37.4	-172.4	73.1	0	0	0	0	112.1	M49 V56 L57 A58 E281	M49-S54 PolarHBondContact O-N 3.32Å; S54-V56 VanDerWaalsContact C-N 3.32Å; S54-V56 PolarHBondContact O-N 2.85Å; S54-L57 PolarHBondContact O-N 2.91Å; S54-A58 PolarHBondContact O-N 3.47Å; S54-E281 WeakPolarHBondContact CB-OE2 3.41Å; S54-E281 PolarHBondContact N-OE2 2.65Å; S54-E281 PolarHBondContact OG-OE2 3.02Å
55	S	95.1	Very high	97.3	Very high	55 Å²	55	32.2 Å²	32.2	39%	0.385	18%	0.175	S	C	.	.	H	α-helix	trans	-66.7	-32.3	172.8	65.8	0	0	0	0	113	G53 R59 E281	G53-S55 VanDerWaalsContact C-N 3.35Å; G53-S55 PolarHBondContact O-N 2.51Å; S55-R59 WeakPolarHBondContact O-CG 3.36Å; S55-R59 PolarHBondContact O-N 3.06Å; S55-E281 WeakPolarHBondContact CA-OE1 3.19Å; S55-E281 WeakPolarHBondContact CB-OE1 3.41Å; S55-E281 PolarHBondContact N-OE1 3.23Å; S55-E281 PolarHBondContact OG-OE1 3.35Å
56	V	97	Very high	97.3	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-68.4	-46.1	174.4	-176.7	0	0	0	0	109.6	I22 L28 M49 G53 S54 A58 R59 C60 I205 L274 V279	I22-V56 HydrophobicContact CD1-CG1 4.03Å; I22-V56 HydrophobicContact CD1-CG2 4.43Å; L28-V56 HydrophobicContact CD1-CG1 3.62Å; M49-V56 HydrophobicContact CE-CB 3.91Å; M49-V56 HydrophobicContact CE-CG1 3.71Å; G53-V56 WeakPolarHBondContact O-CA 3.49Å; G53-V56 WeakPolarHBondContact O-CB 3.08Å; G53-V56 PolarHBondContact O-N 3.41Å; S54-V56 VanDerWaalsContact C-N 3.32Å; S54-V56 PolarHBondContact O-N 2.85Å; V56-A58 VanDerWaalsContact C-N 3.32Å; V56-A58 PolarHBondContact O-N 2.94Å; V56-R59 WeakPolarHBondContact O-CB 3.29Å; V56-R59 PolarHBondContact O-N 3.1Å; V56-R59 VanDerWaalsContact O-N 3.11Å; V56-C60 PolarHBondContact O-N 2.83Å; V56-C60 PolarHBondContact O-SG 3.29Å; V56-I205 HydrophobicContact CG1-CD1 3.51Å; V56-L274 HydrophobicContact CG2-CD2 4.2Å; V56-V279 HydrophobicContact CG2-CB 3.81Å; V56-V279 HydrophobicContact CG2-CG1 4.45Å; V56-V279 HydrophobicContact CG2-CG2 3.78Å
57	L	96.9	Very high	97.3	Very high	31 Å²	31	32.4 Å²	32.4	16%	0.162	18%	0.177	C	C	.	.	H	α-helix	trans	-59	-41.1	174.8	-72.7	-179.9	0	0	0	112.2	M49 G53 S54 R59 C60 F63 L76	M49-L57 HydrophobicContact CB-CD1 3.9Å; M49-L57 HydrophobicContact CB-CD2 3.99Å; M49-L57 HydrophobicContact CB-CG 3.99Å; M49-L57 HydrophobicContact CE-CD2 3.57Å; M49-L57 HydrophobicContact CE-CG 3.76Å; G53-L57 PolarHBondContact O-N 3.45Å; S54-L57 PolarHBondContact O-N 2.91Å; L57-R59 PolarHBondContact O-N 2.6Å; L57-C60 WeakPolarHBondContact O-CB 3.41Å; L57-C60 PolarHBondContact O-N 2.71Å; L57-F63 HydrophobicContact CD2-CE1 4.22Å; L57-F63 HydrophobicContact CD2-CZ 4.35Å; L57-L76 HydrophobicContact CD1-CD1 4.02Å; L57-L76 HydrophobicContact CD2-CD1 4.35Å; L57-L76 HydrophobicContact CD2-CD2 3.97Å; L57-L76 HydrophobicContact CD2-CG 4.25Å
58	A	96.3	Very high	97.3	Very high	76 Å²	76	27.6 Å²	27.6	63%	0.628	16%	0.161	S	C	*	.	H	α-helix	trans	-61.9	-25.5	177.7	0	0	0	0	0	113.4	S54 V56	S54-A58 PolarHBondContact O-N 3.47Å; V56-A58 VanDerWaalsContact C-N 3.32Å; V56-A58 PolarHBondContact O-N 2.94Å
59	R	96.6	Very high	97.3	Very high	32 Å²	32	27.6 Å²	27.6	12%	0.121	16%	0.161	C	C	.	.	H	α-helix	trans	-86	-15.8	175.2	-68.3	165.3	55.9	-153.2	-5.3	113.2	I22 G24 H26 L28 S55 V56 L57 K61	I22-R59 PolarHBondContact O-NH1 3.12Å; I22-R59 PolarHBondContact O-NH2 2.68Å; G24-R59 PolarHBondContact O-NE 3.25Å; G24-R59 PolarHBondContact O-NH1 3.27Å; H26-R59 PolarHBondContact CE1-NH2 2.96Å; H26-R59 PolarHBondContact ND1-NH2 3.04Å; H26-R59 VanDerWaalsContact O-CZ 3.27Å; H26-R59 PolarHBondContact O-NE 3.1Å; H26-R59 PolarHBondContact O-NH2 3.3Å; L28-R59 HydrophobicContact CD1-CB 4.21Å; L28-R59 HydrophobicContact CG-CB 4.32Å; L28-R59 PolarHBondContact N-O 2.76Å; S55-R59 WeakPolarHBondContact O-CG 3.36Å; S55-R59 PolarHBondContact O-N 3.06Å; V56-R59 WeakPolarHBondContact O-CB 3.29Å; V56-R59 PolarHBondContact O-N 3.1Å; V56-R59 VanDerWaalsContact O-N 3.11Å; L57-R59 PolarHBondContact O-N 2.6Å; R59-K61 PolarHBondContact O-N 2.97Å; R59-K61 VanDerWaalsContact O-N 3.16Å
60	C	97.7	Very high	97.3	Very high	12 Å²	12	27.6 Å²	27.6	8%	0.081	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	109.6	178.5	-72.6	0	0	0	0	110.8	L28 V56 L57 F63	L28-C60 CarbonylContact O-C 3.07Å; L28-C60 VanDerWaalsContact O-CA 3.32Å; L28-C60 WeakPolarHBondContact O-CA 3.38Å; V56-C60 PolarHBondContact O-N 2.83Å; V56-C60 PolarHBondContact O-SG 3.29Å; L57-C60 WeakPolarHBondContact O-CB 3.41Å; L57-C60 PolarHBondContact O-N 2.71Å; C60-F63 HydrophobicContact CB-CD2 4.48Å; C60-F63 HydrophobicContact CB-CE2 3.63Å; C60-F63 HydrophobicContact CB-CZ 3.7Å
61	K	97.6	Very high	97.4	Very high	100 Å²	100	26.5 Å²	26.5	44%	0.435	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	-20.7	174.4	-56.8	-54.3	178.6	-170.2	0	112.7	D27 L28 R59 L202	D27-K61 HydrophobicContact CB-CG 3.81Å; D27-K61 WeakPolarHBondContact OD1-CE 3.47Å; D27-K61 IonicContact OD1-NZ 3.44Å; D27-K61 WeakPolarHBondContact OD2-CE 3.37Å; L28-K61 PolarHBondContact O-N 3.13Å; R59-K61 PolarHBondContact O-N 2.97Å; R59-K61 VanDerWaalsContact O-N 3.16Å; K61-L202 HydrophobicContact CB-CD1 4.37Å
62	R	98.3	Very high	97.6	Very high	58 Å²	58	24.3 Å²	24.3	22%	0.219	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	137	-179.6	-56.3	-175	-170.3	140	6.5	111.8	A29 I30 K134 F136 F199 D201 L202	A29-R62 CarbonylContact C-O 3.51Å; A29-R62 WeakPolarHBondContact CA-O 3.21Å; A29-R62 HydrophobicContact CB-CB 3.95Å; A29-R62 WeakPolarHBondContact CB-O 3.45Å; I30-R62 PolarHBondContact N-O 2.87Å; R62-K134 CarbonylContact C-O 3.43Å; R62-K134 VanDerWaalsContact CA-O 3.27Å; R62-K134 WeakPolarHBondContact CA-O 3.33Å; R62-F136 HydrophobicContact CB-CD2 4.09Å; R62-F136 HydrophobicContact CB-CE2 3.88Å; R62-F136 HydrophobicContact CG-CD2 4.33Å; R62-F136 HydrophobicContact CG-CE2 3.62Å; R62-F136 HydrophobicContact CG-CZ 4.28Å; R62-F199 HydrophobicContact CB-CD2 4.25Å; R62-F199 HydrophobicContact CB-CE1 4.43Å; R62-F199 HydrophobicContact CB-CE2 3.69Å; R62-F199 HydrophobicContact CB-CZ 3.79Å; R62-F199 HydrophobicContact CG-CZ 4.42Å; R62-D201 IonicContact CZ-OD1 3.87Å; R62-D201 IonicContact CZ-OD2 2.65Å; R62-D201 IonicContact NH1-OD1 3.2Å; R62-D201 PolarHBondContact NH1-OD1 3.18Å; R62-D201 IonicContact NH1-OD2 3.74Å; R62-D201 PolarHBondContact NH1-OD2 2.87Å; R62-D201 IonicContact NH2-OD2 3.01Å; R62-D201 PolarHBondContact NH2-OD2 2.94Å; R62-L202 HydrophobicContact CB-CD1 4.45Å; R62-L202 HydrophobicContact CG-CD1 3.92Å
63	F	98.7	Very high	97.6	Very high	9 Å²	9	23.3 Å²	23.3	4%	0.039	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.2	174.8	-70.2	-107.3	0	0	0	106.7	I30 L57 C60 A73 L76 L77 K134 L135 F136	I30-F63 HydrophobicContact CG2-CB 4.3Å; I30-F63 HydrophobicContact CG2-CD1 3.22Å; I30-F63 HydrophobicContact CG2-CD2 4.4Å; I30-F63 HydrophobicContact CG2-CE1 3.44Å; I30-F63 VanDerWaalsContact CG2-CE1 3.44Å; I30-F63 HydrophobicContact CG2-CG 3.74Å; I30-F63 HydrophobicContact CG2-CZ 4.13Å; I30-F63 CarbonylContact O-C 3.26Å; I30-F63 WeakPolarHBondContact O-CA 3.48Å; L57-F63 HydrophobicContact CD2-CE1 4.22Å; L57-F63 HydrophobicContact CD2-CZ 4.35Å; C60-F63 HydrophobicContact CB-CD2 4.48Å; C60-F63 HydrophobicContact CB-CE2 3.63Å; C60-F63 HydrophobicContact CB-CZ 3.7Å; F63-A73 HydrophobicContact CB-CB 4.33Å; F63-L76 HydrophobicContact CD1-CD2 4.32Å; F63-L76 HydrophobicContact CD1-CG 4.44Å; F63-L76 HydrophobicContact CE1-CB 4.44Å; F63-L76 HydrophobicContact CE1-CD2 3.9Å; F63-L76 HydrophobicContact CE1-CG 3.88Å; F63-L77 HydrophobicContact CB-CD2 4.34Å; F63-L77 HydrophobicContact CD1-CB 4.21Å; F63-L77 HydrophobicContact CD2-CB 4.26Å; F63-L77 HydrophobicContact CD2-CD1 3.78Å; F63-L77 HydrophobicContact CD2-CD2 4.06Å; F63-L77 HydrophobicContact CD2-CG 4.25Å; F63-L77 HydrophobicContact CE2-CD1 3.69Å; F63-L77 HydrophobicContact CG-CB 4.09Å; F63-L77 HydrophobicContact CG-CD1 4.47Å; F63-L77 HydrophobicContact CG-CD2 4.29Å; F63-L77 HydrophobicContact CZ-CD1 4.3Å; F63-K134 PolarHBondContact N-O 3.42Å; F63-L135 HydrophobicContact CB-CD1 4.19Å; F63-L135 CarbonylContact O-C 3.47Å; F63-L135 VanDerWaalsContact O-CA 3.26Å; F63-L135 WeakPolarHBondContact O-CA 3.35Å; F63-F136 PolarHBondContact O-N 3.3Å
64	A	98.7	Very high	97.7	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	158.8	-178.2	0	0	0	0	0	112.2	I30 S31 F32 F136 P197 F199	I30-A64 PolarHBondContact O-N 3.2Å; S31-A64 VanDerWaalsContact CA-O 3.29Å; S31-A64 WeakPolarHBondContact CA-O 3.39Å; F32-A64 PolarHBondContact N-O 3.21Å; A64-F136 VanDerWaalsContact CA-O 3.25Å; A64-F136 WeakPolarHBondContact CA-O 3.38Å; A64-F136 HydrophobicContact CB-CB 3.87Å; A64-P197 HydrophobicContact CB-CB 3.89Å; A64-P197 HydrophobicContact CB-CG 4.28Å; A64-F199 HydrophobicContact CB-CE2 3.88Å; A64-F199 HydrophobicContact CB-CZ 3.91Å
65	G	98.5	Very high	97.9	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.9	175.8	168.4	0	0	0	0	0	113.9	F32 F136 S138	F32-G65 WeakPolarHBondContact O-CA 3.34Å; G65-F136 PolarHBondContact N-O 2.98Å; G65-F136 VanDerWaalsContact N-O 3.07Å; G65-S138 WeakPolarHBondContact O-CB 3.4Å; G65-S138 PolarHBondContact O-N 3.42Å
66	A	98.4	Very high	98	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	146.5	168.3	0	0	0	0	0	108.7	F32 G34 A68 G69 A70 N195	F32-A66 PolarHBondContact O-N 3.08Å; G34-A66 WeakPolarHBondContact CA-O 3.26Å; G34-A66 PolarHBondContact N-O 3.37Å; A66-A68 PolarHBondContact O-N 3.4Å; A66-G69 WeakPolarHBondContact O-CA 3.36Å; A66-G69 PolarHBondContact O-N 3.35Å; A66-A70 PolarHBondContact O-N 3.26Å; A66-N195 WeakPolarHBondContact CB-O 3.41Å
67	S	98	Very high	98	Very high	4 Å²	4	20 Å²	20	3%	0.028	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	-135.2	172.7	-160.7	0	0	0	0	112	G69 A70 L71 S166 D189	S67-G69 PolarHBondContact O-N 3.23Å; S67-A70 WeakPolarHBondContact O-CA 3.23Å; S67-A70 WeakPolarHBondContact O-CB 3.22Å; S67-A70 PolarHBondContact O-N 3.05Å; S67-L71 PolarHBondContact O-N 3.15Å; S67-S166 WeakPolarHBondContact CA-O 3.38Å; S67-S166 WeakPolarHBondContact CB-O 3.41Å; S67-S166 PolarHBondContact N-O 3.01Å; S67-S166 VanDerWaalsContact N-O 3.12Å; S67-S166 PolarHBondContact N-OG 2.87Å; S67-D189 WeakPolarHBondContact CB-OD2 3.36Å; S67-D189 PolarHBondContact OG-OD2 3.44Å
68	A	97.9	Very high	98	Very high	13 Å²	13	19.9 Å²	19.9	11%	0.107	11%	0.109	C	C	.	.	H	α-helix	trans	-48.5	-32.6	173.8	0	0	0	0	0	114	G36 A66 L71 V72	G36-A68 WeakPolarHBondContact O-CB 3.41Å; A66-A68 PolarHBondContact O-N 3.4Å; A68-L71 PolarHBondContact O-N 3.04Å; A68-V72 PolarHBondContact O-N 3.44Å; A68-V72 VanDerWaalsContact O-N 3.13Å
69	G	98.5	Very high	97.9	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-66.7	-36.9	174.5	0	0	0	0	0	113.5	F32 A66 S67 L71 A73	F32-G69 VanDerWaalsContact CB-CA 3.48Å; A66-G69 WeakPolarHBondContact O-CA 3.36Å; A66-G69 PolarHBondContact O-N 3.35Å; S67-G69 PolarHBondContact O-N 3.23Å; G69-L71 VanDerWaalsContact C-N 3.35Å; G69-A73 VanDerWaalsContact O-CB 3.25Å; G69-A73 WeakPolarHBondContact O-CB 3.08Å; G69-A73 PolarHBondContact O-N 3.24Å
70	A	98.6	Very high	97.8	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-66.6	-37.6	174.6	0	0	0	0	0	111.8	A66 S67 A73 A74 I137 L163	A66-A70 PolarHBondContact O-N 3.26Å; S67-A70 WeakPolarHBondContact O-CA 3.23Å; S67-A70 WeakPolarHBondContact O-CB 3.22Å; S67-A70 PolarHBondContact O-N 3.05Å; A70-A73 PolarHBondContact O-N 3.24Å; A70-A74 WeakPolarHBondContact O-CB 3.25Å; A70-A74 PolarHBondContact O-N 3.19Å; A70-I137 HydrophobicContact CB-CG2 4.12Å; A70-L163 HydrophobicContact CB-CD2 4.29Å
71	L	98.6	Very high	97.6	Very high	28 Å²	28	22.9 Å²	22.9	15%	0.147	12%	0.115	C	C	.	.	H	α-helix	trans	-61.9	-51	176	-52.4	-174.6	0	0	0	110.9	S67 A68 G69 A73 A74 L75 V115 M119 L163	S67-L71 PolarHBondContact O-N 3.15Å; A68-L71 PolarHBondContact O-N 3.04Å; G69-L71 VanDerWaalsContact C-N 3.35Å; L71-A73 PolarHBondContact O-N 3.28Å; L71-A74 WeakPolarHBondContact O-CB 3.29Å; L71-A74 PolarHBondContact O-N 3.24Å; L71-L75 WeakPolarHBondContact O-CG 3.25Å; L71-L75 PolarHBondContact O-N 3.41Å; L71-V115 HydrophobicContact CD1-CG1 3.99Å; L71-V115 HydrophobicContact CD2-CG1 4Å; L71-M119 HydrophobicContact CB-CE 4.34Å; L71-M119 HydrophobicContact CB-SD 4.09Å; L71-M119 HydrophobicContact CD2-CE 4.36Å; L71-M119 HydrophobicContact CD2-CG 3.98Å; L71-M119 HydrophobicContact CD2-SD 4.11Å; L71-M119 HydrophobicContact CG-SD 4.46Å; L71-L163 HydrophobicContact CD2-CB 3.76Å; L71-L163 HydrophobicContact CD2-CD2 3.88Å; L71-L163 HydrophobicContact CD2-CG 4.32Å
72	V	98.6	Very high	97.6	Very high	7 Å²	7	19 Å²	19	4%	0.042	10%	0.1	C	C	.	.	H	α-helix	trans	-64.8	-39.3	178.5	173.9	0	0	0	0	111.6	F32 H42 A46 A68 A74 L75 L76 I83	F32-V72 HydrophobicContact CE1-CG1 4.31Å; F32-V72 HydrophobicContact CZ-CG1 4.44Å; H42-V72 HydrophobicContact CB-CB 4.11Å; H42-V72 HydrophobicContact CB-CG1 4.03Å; H42-V72 HydrophobicContact CB-CG2 3.88Å; A46-V72 HydrophobicContact CB-CG1 3.74Å; A68-V72 PolarHBondContact O-N 3.44Å; A68-V72 VanDerWaalsContact O-N 3.13Å; V72-A74 VanDerWaalsContact C-N 3.3Å; V72-A74 PolarHBondContact O-N 2.58Å; V72-L75 PolarHBondContact O-N 2.95Å; V72-L76 VanDerWaalsContact O-CB 3.26Å; V72-L76 WeakPolarHBondContact O-CB 3.42Å; V72-L76 PolarHBondContact O-N 3.05Å; V72-I83 HydrophobicContact CG1-CD1 4.21Å
73	A	98.7	Very high	97.5	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60	-40.2	175.1	0	0	0	0	0	112.3	F32 F63 G69 A70 L71 L77 L135	F32-A73 HydrophobicContact CD2-CB 3.95Å; F32-A73 HydrophobicContact CE2-CB 4.34Å; F63-A73 HydrophobicContact CB-CB 4.33Å; G69-A73 VanDerWaalsContact O-CB 3.25Å; G69-A73 WeakPolarHBondContact O-CB 3.08Å; G69-A73 PolarHBondContact O-N 3.24Å; A70-A73 PolarHBondContact O-N 3.24Å; L71-A73 PolarHBondContact O-N 3.28Å; A73-L77 WeakPolarHBondContact O-CB 3.37Å; A73-L77 PolarHBondContact O-N 2.93Å; A73-L135 HydrophobicContact CB-CD1 3.74Å
74	A	98.6	Very high	97.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-64.3	-50.9	176	0	0	0	0	0	111.2	A70 L71 V72 L76 L77 T78 M119 L123 L135 L163	A70-A74 WeakPolarHBondContact O-CB 3.25Å; A70-A74 PolarHBondContact O-N 3.19Å; L71-A74 WeakPolarHBondContact O-CB 3.29Å; L71-A74 PolarHBondContact O-N 3.24Å; V72-A74 VanDerWaalsContact C-N 3.3Å; V72-A74 PolarHBondContact O-N 2.58Å; A74-L76 PolarHBondContact O-N 2.94Å; A74-L77 PolarHBondContact O-N 3.32Å; A74-T78 PolarHBondContact O-N 2.91Å; A74-T78 PolarHBondContact O-OG1 3.07Å; A74-M119 HydrophobicContact CB-CE 4.4Å; A74-L123 HydrophobicContact CB-CD2 4.3Å; A74-L135 HydrophobicContact CB-CD1 4.47Å; A74-L135 HydrophobicContact CB-CD2 3.75Å; A74-L163 HydrophobicContact CB-CD1 4.37Å; A74-L163 HydrophobicContact CB-CD2 4.04Å
75	L	98.4	Very high	97.3	Very high	3 Å²	3	23 Å²	23	2%	0.016	13%	0.125	C	C	.	.	H	α-helix	trans	-61.5	-43.9	179.5	-63.6	176.5	0	0	0	112.2	L71 V72 L77 T78 S79 S80 I83 A86 M119 L122 L123	L71-L75 WeakPolarHBondContact O-CG 3.25Å; L71-L75 PolarHBondContact O-N 3.41Å; V72-L75 PolarHBondContact O-N 2.95Å; L75-L77 PolarHBondContact O-N 2.82Å; L75-T78 PolarHBondContact O-N 2.89Å; L75-S79 CarbonylContact O-C 3.03Å; L75-S79 WeakPolarHBondContact O-CA 3.41Å; L75-S79 PolarHBondContact O-N 2.78Å; L75-S80 PolarHBondContact O-N 3.04Å; L75-S80 VanDerWaalsContact O-N 3.16Å; L75-I83 HydrophobicContact CB-CD1 3.74Å; L75-I83 HydrophobicContact CD1-CD1 4.4Å; L75-A86 HydrophobicContact CD1-CB 3.5Å; L75-A86 VanDerWaalsContact CD1-CB 3.5Å; L75-M119 HydrophobicContact CD2-CE 3.91Å; L75-M119 HydrophobicContact CG-CE 4.03Å; L75-L122 HydrophobicContact CD1-CD1 4Å; L75-L122 HydrophobicContact CD2-CB 3.63Å; L75-L122 HydrophobicContact CD2-CD1 4.14Å; L75-L123 HydrophobicContact CD2-CD2 3.96Å
76	L	98	Very high	97.3	Very high	11 Å²	11	23.5 Å²	23.5	6%	0.058	13%	0.129	C	C	.	.	H	α-helix	trans	-61.5	-32.4	178.7	-176.2	59	0	0	0	112.3	I30 F32 A46 L57 F63 V72 A74	I30-L76 HydrophobicContact CD1-CD2 4.26Å; F32-L76 HydrophobicContact CE2-CD2 4.08Å; F32-L76 HydrophobicContact CZ-CD2 3.74Å; A46-L76 HydrophobicContact CB-CD1 4.24Å; A46-L76 HydrophobicContact CB-CD2 4.24Å; L57-L76 HydrophobicContact CD1-CD1 4.02Å; L57-L76 HydrophobicContact CD2-CD1 4.35Å; L57-L76 HydrophobicContact CD2-CD2 3.97Å; L57-L76 HydrophobicContact CD2-CG 4.25Å; F63-L76 HydrophobicContact CD1-CD2 4.32Å; F63-L76 HydrophobicContact CD1-CG 4.44Å; F63-L76 HydrophobicContact CE1-CB 4.44Å; F63-L76 HydrophobicContact CE1-CD2 3.9Å; F63-L76 HydrophobicContact CE1-CG 3.88Å; V72-L76 VanDerWaalsContact O-CB 3.26Å; V72-L76 WeakPolarHBondContact O-CB 3.42Å; V72-L76 PolarHBondContact O-N 3.05Å; A74-L76 PolarHBondContact O-N 2.94Å
77	L	97.4	Very high	97.2	Very high	35 Å²	35	23.6 Å²	23.6	18%	0.183	13%	0.13	C	C	.	.	H	α-helix	trans	-81.6	-30.9	179	178.5	57.4	0	0	0	113.3	F63 A73 A74 L75 V131 K134 L135	F63-L77 HydrophobicContact CB-CD2 4.34Å; F63-L77 HydrophobicContact CD1-CB 4.21Å; F63-L77 HydrophobicContact CD2-CB 4.26Å; F63-L77 HydrophobicContact CD2-CD1 3.78Å; F63-L77 HydrophobicContact CD2-CD2 4.06Å; F63-L77 HydrophobicContact CD2-CG 4.25Å; F63-L77 HydrophobicContact CE2-CD1 3.69Å; F63-L77 HydrophobicContact CG-CB 4.09Å; F63-L77 HydrophobicContact CG-CD1 4.47Å; F63-L77 HydrophobicContact CG-CD2 4.29Å; F63-L77 HydrophobicContact CZ-CD1 4.3Å; A73-L77 WeakPolarHBondContact O-CB 3.37Å; A73-L77 PolarHBondContact O-N 2.93Å; A74-L77 PolarHBondContact O-N 3.32Å; L75-L77 PolarHBondContact O-N 2.82Å; L77-V131 HydrophobicContact CD2-CB 4.03Å; L77-V131 HydrophobicContact CD2-CG1 3.81Å; L77-V131 HydrophobicContact CG-CG1 4.18Å; L77-K134 HydrophobicContact CD1-CD 4.48Å; L77-K134 HydrophobicContact CD2-CB 3.75Å; L77-L135 HydrophobicContact CD2-CB 4.12Å
78	T	96.7	Very high	97.2	Very high	29 Å²	29	28 Å²	28	18%	0.178	15%	0.153	C	C	.	.	H	α-helix	trans	-110.5	-29.2	-172	58.7	0	0	0	0	115.9	A74 L75 L123 A127 V130 V131	A74-T78 PolarHBondContact O-N 2.91Å; A74-T78 PolarHBondContact O-OG1 3.07Å; L75-T78 PolarHBondContact O-N 2.89Å; T78-L123 WeakPolarHBondContact OG1-CD2 3.21Å; T78-A127 HydrophobicContact CG2-CB 4.21Å; T78-V130 HydrophobicContact CG2-CB 4.4Å; T78-V130 HydrophobicContact CG2-CG1 4.26Å; T78-V131 HydrophobicContact CG2-CG1 3.13Å
79	S	93.2	Very high	97.1	Very high	3 Å²	3	29.1 Å²	29.1	2%	0.021	16%	0.157	C	C	.	.			trans	-160.5	55.4	-163.9	49	0	0	0	0	110.6	L75 E81 T82 L122	L75-S79 CarbonylContact O-C 3.03Å; L75-S79 WeakPolarHBondContact O-CA 3.41Å; L75-S79 PolarHBondContact O-N 2.78Å; S79-E81 WeakPolarHBondContact CA-OE2 3.47Å; S79-E81 PolarHBondContact O-N 3Å; S79-E81 VanDerWaalsContact O-N 3.08Å; S79-T82 WeakPolarHBondContact O-CB 3.4Å; S79-T82 PolarHBondContact O-N 2.85Å; S79-T82 PolarHBondContact O-OG1 2.84Å; S79-T82 PolarHBondContact OG-OG1 2.83Å; S79-L122 PolarHBondContact OG-O 3.48Å
80	S	94.7	Very high	97	Very high	41 Å²	41	30.7 Å²	30.7	29%	0.287	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-58.3	-24.1	-173.3	66.5	0	0	0	0	114.3	L75 T82 I83	L75-S80 PolarHBondContact O-N 3.04Å; L75-S80 VanDerWaalsContact O-N 3.16Å; S80-T82 PolarHBondContact O-N 2.75Å; S80-I83 WeakPolarHBondContact O-CB 3.47Å; S80-I83 VanDerWaalsContact O-CG1 3.24Å; S80-I83 WeakPolarHBondContact O-CG1 3.46Å; S80-I83 PolarHBondContact O-N 2.85Å
81	E	94.5	Very high	97	Very high	140 Å²	140	31 Å²	31	65%	0.654	17%	0.168	S	C	*	.	G	3₁₀ helix	trans	-65.6	-19.1	173.3	67.4	-76.1	178.9	0	0	113.1	S79	S79-E81 WeakPolarHBondContact CA-OE2 3.47Å; S79-E81 PolarHBondContact O-N 3Å; S79-E81 VanDerWaalsContact O-N 3.08Å
82	T	96	Very high	96.9	Very high	18 Å²	18	32.3 Å²	32.3	11%	0.11	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-89	-2.3	179.9	69.6	0	0	0	0	113.6	S79 S80 D84 I85 A86	S79-T82 WeakPolarHBondContact O-CB 3.4Å; S79-T82 PolarHBondContact O-N 2.85Å; S79-T82 PolarHBondContact O-OG1 2.84Å; S79-T82 PolarHBondContact OG-OG1 2.83Å; S80-T82 PolarHBondContact O-N 2.75Å; T82-D84 VanDerWaalsContact C-N 3.34Å; T82-D84 PolarHBondContact O-N 2.8Å; T82-I85 WeakPolarHBondContact O-CA 3.45Å; T82-I85 WeakPolarHBondContact O-CB 3.31Å; T82-I85 PolarHBondContact O-N 3.48Å; T82-A86 PolarHBondContact O-N 2.82Å
83	I	97	Very high	96.7	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.021	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-40.6	-177.5	-69.7	-68.7	0	0	0	112.3	C43 A46 R47 V72 L75 S80 I85 A86 A87	C43-I83 HydrophobicContact CB-CG2 4.13Å; C43-I83 WeakPolarHBondContact O-CG2 3.37Å; A46-I83 HydrophobicContact CB-CD1 4Å; A46-I83 HydrophobicContact CB-CG1 4.32Å; A46-I83 HydrophobicContact CB-CG2 4.22Å; R47-I83 HydrophobicContact CB-CG2 4.35Å; V72-I83 HydrophobicContact CG1-CD1 4.21Å; L75-I83 HydrophobicContact CB-CD1 3.74Å; L75-I83 HydrophobicContact CD1-CD1 4.4Å; S80-I83 WeakPolarHBondContact O-CB 3.47Å; S80-I83 VanDerWaalsContact O-CG1 3.24Å; S80-I83 WeakPolarHBondContact O-CG1 3.46Å; S80-I83 PolarHBondContact O-N 2.85Å; I83-I85 VanDerWaalsContact C-N 3.31Å; I83-I85 PolarHBondContact O-N 2.71Å; I83-A86 PolarHBondContact O-N 2.83Å; I83-A87 PolarHBondContact O-N 2.99Å
84	D	96.4	Very high	96.6	Very high	72 Å²	72	33.5 Å²	33.5	39%	0.385	19%	0.189	S	C	.	.	H	α-helix	trans	-67.9	-32.5	176.4	-74.3	-42.6	0	0	0	111.8	R47 T82 A87 N88	R47-D84 WeakPolarHBondContact CD-OD1 3.4Å; R47-D84 IonicContact CZ-OD1 3.4Å; R47-D84 IonicContact NE-OD1 3.1Å; R47-D84 IonicContact NH1-OD1 2.68Å; R47-D84 PolarHBondContact NH1-OD1 2.81Å; T82-D84 VanDerWaalsContact C-N 3.34Å; T82-D84 PolarHBondContact O-N 2.8Å; D84-A87 PolarHBondContact O-N 3.39Å; D84-N88 PolarHBondContact O-N 3.11Å; D84-N88 PolarHBondContact O-ND2 2.84Å; D84-N88 VanDerWaalsContact O-ND2 3.11Å
85	I	97.3	Very high	96.6	Very high	76 Å²	76	39.1 Å²	39.1	39%	0.39	22%	0.215	S	C	.	.	H	α-helix	trans	-66.6	-46.4	173.2	-56.6	175.5	0	0	0	109.4	T82 I83 A87 N88 L89 L122	T82-I85 WeakPolarHBondContact O-CA 3.45Å; T82-I85 WeakPolarHBondContact O-CB 3.31Å; T82-I85 PolarHBondContact O-N 3.48Å; I83-I85 VanDerWaalsContact C-N 3.31Å; I83-I85 PolarHBondContact O-N 2.71Å; I85-A87 VanDerWaalsContact C-N 3.3Å; I85-A87 PolarHBondContact O-N 3.24Å; I85-N88 PolarHBondContact O-N 3.32Å; I85-N88 VanDerWaalsContact O-N 3.14Å; I85-L89 HydrophobicContact CG2-CD1 4.44Å; I85-L89 WeakPolarHBondContact O-CG 3.38Å; I85-L89 PolarHBondContact O-N 2.86Å; I85-L122 HydrophobicContact CB-CD2 4.15Å; I85-L122 HydrophobicContact CG2-CD2 3.74Å
86	A	97.2	Very high	96.4	Very high	10 Å²	10	41.8 Å²	41.8	8%	0.083	23%	0.227	C	C	.	.	H	α-helix	trans	-58.9	-40.8	177.2	0	0	0	0	0	112.2	L75 T82 I83 N88 L89 V90 L122	L75-A86 HydrophobicContact CD1-CB 3.5Å; L75-A86 VanDerWaalsContact CD1-CB 3.5Å; T82-A86 PolarHBondContact O-N 2.82Å; I83-A86 PolarHBondContact O-N 2.83Å; A86-N88 PolarHBondContact O-N 3.25Å; A86-L89 WeakPolarHBondContact O-CB 3.37Å; A86-L89 PolarHBondContact O-N 3.4Å; A86-V90 WeakPolarHBondContact O-CG2 3.49Å; A86-V90 PolarHBondContact O-N 2.89Å; A86-L122 HydrophobicContact CB-CD1 4.02Å
87	A	98	Very high	96.2	Very high	2 Å²	2	41.4 Å²	41.4	2%	0.017	23%	0.226	C	C	.	.	H	α-helix	trans	-59.2	-45.6	174.4	0	0	0	0	0	112	L40 C43 I83 D84 I85 L89 V90 L91 L263	L40-A87 HydrophobicContact CD2-CB 3.59Å; L40-A87 WeakPolarHBondContact CD2-O 3.48Å; C43-A87 HydrophobicContact CB-CB 4.06Å; I83-A87 PolarHBondContact O-N 2.99Å; D84-A87 PolarHBondContact O-N 3.39Å; I85-A87 VanDerWaalsContact C-N 3.3Å; I85-A87 PolarHBondContact O-N 3.24Å; A87-L89 VanDerWaalsContact C-N 3.31Å; A87-L89 PolarHBondContact O-N 2.78Å; A87-V90 PolarHBondContact O-N 2.95Å; A87-L91 PolarHBondContact O-N 3.23Å; A87-L263 HydrophobicContact CB-CD1 4.19Å; A87-L263 HydrophobicContact CB-CD2 4.39Å
88	N	97.4	Very high	96.1	Very high	95 Å²	95	44.1 Å²	44.1	51%	0.508	23%	0.233	S	C	.	.	H	α-helix	trans	-64.5	-34.5	177.2	-71.8	-41	0	0	0	112.9	D84 I85 A86 L91 A92	D84-N88 PolarHBondContact O-N 3.11Å; D84-N88 PolarHBondContact O-ND2 2.84Å; D84-N88 VanDerWaalsContact O-ND2 3.11Å; I85-N88 PolarHBondContact O-N 3.32Å; I85-N88 VanDerWaalsContact O-N 3.14Å; A86-N88 PolarHBondContact O-N 3.25Å; N88-L91 PolarHBondContact O-N 3.35Å; N88-A92 PolarHBondContact O-N 2.95Å
89	L	96.3	Very high	96	Very high	38 Å²	38	47.2 Å²	47.2	20%	0.199	26%	0.256	C	S	.	.	H	α-helix	trans	-66.3	-39.6	174.2	-66.5	170.3	0	0	0	112.6	I85 A86 A87 L91 A92 L93 E118 R121 L122	I85-L89 HydrophobicContact CG2-CD1 4.44Å; I85-L89 WeakPolarHBondContact O-CG 3.38Å; I85-L89 PolarHBondContact O-N 2.86Å; A86-L89 WeakPolarHBondContact O-CB 3.37Å; A86-L89 PolarHBondContact O-N 3.4Å; A87-L89 VanDerWaalsContact C-N 3.31Å; A87-L89 PolarHBondContact O-N 2.78Å; L89-L91 VanDerWaalsContact C-N 3.28Å; L89-L91 PolarHBondContact O-N 3.08Å; L89-A92 PolarHBondContact O-N 2.88Å; L89-L93 VanDerWaalsContact O-CB 3.25Å; L89-L93 WeakPolarHBondContact O-CB 3.32Å; L89-L93 PolarHBondContact O-N 2.99Å; L89-E118 HydrophobicContact CD1-CB 4Å; L89-E118 HydrophobicContact CD1-CG 3.96Å; L89-E118 WeakPolarHBondContact CD1-OE2 3.37Å; L89-E118 HydrophobicContact CD2-CG 4.27Å; L89-E118 VanDerWaalsContact CD2-OE2 3.32Å; L89-E118 WeakPolarHBondContact CD2-OE2 3.4Å; L89-R121 VanDerWaalsContact CD1-NH2 3.27Å; L89-L122 HydrophobicContact CD1-CD1 3.77Å; L89-L122 HydrophobicContact CD1-CD2 4.26Å; L89-L122 HydrophobicContact CD1-CG 4.24Å
90	V	96.4	Very high	96	Very high	33 Å²	33	49.1 Å²	49.1	20%	0.2	27%	0.266	C	S	.	.	H	α-helix	trans	-62.7	-39.1	176	175.8	0	0	0	0	110.7	F37 L40 A86 A87 A94	F37-V90 HydrophobicContact CD1-CG1 4.28Å; L40-V90 HydrophobicContact CD1-CB 4.45Å; L40-V90 HydrophobicContact CD1-CG1 3.96Å; L40-V90 HydrophobicContact CD2-CB 4.37Å; L40-V90 HydrophobicContact CG-CB 4.09Å; L40-V90 HydrophobicContact CG-CG1 3.8Å; A86-V90 WeakPolarHBondContact O-CG2 3.49Å; A86-V90 PolarHBondContact O-N 2.89Å; A87-V90 PolarHBondContact O-N 2.95Å; V90-A94 VanDerWaalsContact O-CB 3.3Å; V90-A94 WeakPolarHBondContact O-CB 3.37Å; V90-A94 PolarHBondContact O-N 3.23Å
91	L	97.6	Very high	95.7	Very high	7 Å²	7	54.3 Å²	54.3	4%	0.037	28%	0.283	C	S	.	.	H	α-helix	trans	-65	-46.9	175.4	-69.9	159.3	0	0	0	111.8	L40 A87 N88 L89 L93 A94 E95 D256 L259 R260	L40-L91 HydrophobicContact CD1-CD2 3.77Å; L40-L91 HydrophobicContact CD1-CG 3.9Å; L40-L91 HydrophobicContact CD2-CG 4.43Å; A87-L91 PolarHBondContact O-N 3.23Å; N88-L91 PolarHBondContact O-N 3.35Å; L89-L91 VanDerWaalsContact C-N 3.28Å; L89-L91 PolarHBondContact O-N 3.08Å; L91-L93 VanDerWaalsContact C-N 3.34Å; L91-L93 PolarHBondContact O-N 2.88Å; L91-A94 WeakPolarHBondContact O-CB 3.23Å; L91-A94 PolarHBondContact O-N 2.9Å; L91-E95 PolarHBondContact O-N 3.21Å; L91-D256 HydrophobicContact CD2-CB 4.43Å; L91-L259 HydrophobicContact CD2-CB 3.71Å; L91-L259 HydrophobicContact CD2-CD1 4.1Å; L91-R260 HydrophobicContact CD2-CG 4.38Å
92	A	96.6	Very high	95.4	Very high	54 Å²	54	55.9 Å²	55.9	45%	0.446	28%	0.284	S	S	.	.	H	α-helix	trans	-61.8	-41.6	176.7	0	0	0	0	0	112	N88 L89 A94 E95 E96	N88-A92 PolarHBondContact O-N 2.95Å; L89-A92 PolarHBondContact O-N 2.88Å; A92-A94 VanDerWaalsContact C-N 3.35Å; A92-E95 PolarHBondContact O-N 2.95Å; A92-E96 PolarHBondContact O-N 3.37Å
93	L	95.4	Very high	95.1	Very high	32 Å²	32	55.8 Å²	55.8	17%	0.168	29%	0.287	C	S	.	.	H	α-helix	trans	-63.9	-40.5	175.4	-174.2	66	0	0	0	111.7	F37 L89 L91 E95 E96 V97 F109 L111 R114	F37-L93 HydrophobicContact CE1-CB 4.41Å; F37-L93 HydrophobicContact CE1-CD2 4.17Å; F37-L93 HydrophobicContact CE1-CG 4.04Å; F37-L93 HydrophobicContact CZ-CG 4.46Å; L89-L93 VanDerWaalsContact O-CB 3.25Å; L89-L93 WeakPolarHBondContact O-CB 3.32Å; L89-L93 PolarHBondContact O-N 2.99Å; L91-L93 VanDerWaalsContact C-N 3.34Å; L91-L93 PolarHBondContact O-N 2.88Å; L93-E95 VanDerWaalsContact C-N 3.34Å; L93-E96 PolarHBondContact O-N 3.33Å; L93-V97 WeakPolarHBondContact O-CB 3.35Å; L93-V97 VanDerWaalsContact O-CG2 3.28Å; L93-V97 WeakPolarHBondContact O-CG2 3.45Å; L93-V97 PolarHBondContact O-N 2.65Å; L93-F109 HydrophobicContact CD1-CE2 3.93Å; L93-F109 HydrophobicContact CD1-CZ 3.7Å; L93-L111 HydrophobicContact CD2-CD1 3.73Å; L93-R114 HydrophobicContact CD1-CB 4.07Å; L93-R114 HydrophobicContact CD1-CG 4.04Å
94	A	96.5	Very high	94.7	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.3	-41.3	175.1	0	0	0	0	0	111.5	F37 V90 L91 A92 V97 R98 P253 L259	F37-A94 HydrophobicContact CD1-CB 3.89Å; F37-A94 HydrophobicContact CE1-CB 3.92Å; V90-A94 VanDerWaalsContact O-CB 3.3Å; V90-A94 WeakPolarHBondContact O-CB 3.37Å; V90-A94 PolarHBondContact O-N 3.23Å; L91-A94 WeakPolarHBondContact O-CB 3.23Å; L91-A94 PolarHBondContact O-N 2.9Å; A92-A94 VanDerWaalsContact C-N 3.35Å; A94-V97 PolarHBondContact O-N 3.01Å; A94-R98 VanDerWaalsContact O-CG 3.29Å; A94-R98 WeakPolarHBondContact O-CG 3.39Å; A94-R98 PolarHBondContact O-N 2.9Å; A94-P253 HydrophobicContact CB-CB 3.64Å; A94-P253 HydrophobicContact CB-CG 4.32Å; A94-L259 HydrophobicContact CB-CD1 3.42Å; A94-L259 VanDerWaalsContact CB-CD1 3.42Å
95	E	96.6	Very high	94.2	Very high	119 Å²	119	56.1 Å²	56.1	56%	0.556	29%	0.288	S	S	*	.	H	α-helix	trans	-62.5	-48.7	174.8	-170.7	179.6	-177	0	0	112.3	L91 A92 L93 V97 R98 S99	L91-E95 PolarHBondContact O-N 3.21Å; A92-E95 PolarHBondContact O-N 2.95Å; L93-E95 VanDerWaalsContact C-N 3.34Å; E95-V97 VanDerWaalsContact C-N 3.33Å; E95-V97 PolarHBondContact O-N 3.23Å; E95-R98 VanDerWaalsContact CA-NH2 3.31Å; E95-R98 PolarHBondContact O-N 3.27Å; E95-S99 PolarHBondContact O-N 2.9Å
96	E	95.1	Very high	93.7	Very high	58 Å²	58	54 Å²	54	27%	0.271	28%	0.277	S	S	.	.	H	α-helix	trans	-53.6	-52.7	174.2	-178	178.5	-161.5	0	0	109.8	A92 L93 R98 S99 L100 F109 R114	A92-E96 PolarHBondContact O-N 3.37Å; L93-E96 PolarHBondContact O-N 3.33Å; E96-R98 VanDerWaalsContact C-N 3.35Å; E96-R98 PolarHBondContact O-N 3.44Å; E96-S99 WeakPolarHBondContact O-CB 3.28Å; E96-S99 PolarHBondContact O-N 3.49Å; E96-S99 PolarHBondContact O-OG 3.23Å; E96-L100 WeakPolarHBondContact O-CG 3.32Å; E96-L100 PolarHBondContact O-N 3.5Å; E96-F109 HydrophobicContact CG-CE2 4.3Å; E96-R114 IonicContact OE1-CZ 2.96Å; E96-R114 IonicContact OE1-NE 3.91Å; E96-R114 PolarHBondContact OE1-NE 3.23Å; E96-R114 IonicContact OE1-NH2 3.62Å; E96-R114 PolarHBondContact OE1-NH2 3.47Å; E96-R114 IonicContact OE2-CZ 3.6Å; E96-R114 IonicContact OE2-NE 3.21Å; E96-R114 PolarHBondContact OE2-NE 2.84Å; E96-R114 IonicContact OE2-NH2 2.71Å
97	V	94.3	Very high	93.1	Very high	4 Å²	4	62.7 Å²	62.7	2%	0.024	31%	0.308	C	S	.	.	H	α-helix	trans	-62	-38.4	-178.4	169.1	0	0	0	0	112.6	F37 L93 A94 E95 S99 L100 G103 L104 F109 P253	F37-V97 HydrophobicContact CZ-CB 4.21Å; F37-V97 HydrophobicContact CZ-CG1 4.31Å; F37-V97 HydrophobicContact CZ-CG2 4.02Å; L93-V97 WeakPolarHBondContact O-CB 3.35Å; L93-V97 VanDerWaalsContact O-CG2 3.28Å; L93-V97 WeakPolarHBondContact O-CG2 3.45Å; L93-V97 PolarHBondContact O-N 2.65Å; A94-V97 PolarHBondContact O-N 3.01Å; E95-V97 VanDerWaalsContact C-N 3.33Å; E95-V97 PolarHBondContact O-N 3.23Å; V97-S99 VanDerWaalsContact C-N 3.28Å; V97-S99 PolarHBondContact O-N 2.9Å; V97-L100 PolarHBondContact O-N 3.28Å; V97-G103 VanDerWaalsContact O-CA 3.3Å; V97-G103 WeakPolarHBondContact O-CA 3.47Å; V97-L104 HydrophobicContact CB-CD2 4.44Å; V97-L104 HydrophobicContact CG1-CD2 3.89Å; V97-L104 HydrophobicContact CG1-CG 3.85Å; V97-L104 HydrophobicContact CG2-CD2 3.63Å; V97-F109 HydrophobicContact CG2-CE1 3.84Å; V97-F109 HydrophobicContact CG2-CE2 3.79Å; V97-F109 HydrophobicContact CG2-CZ 3.39Å; V97-P253 HydrophobicContact CB-CG 4.1Å; V97-P253 HydrophobicContact CG1-CG 3.71Å
98	R	94.9	Very high	92.5	Very high	92 Å²	92	71.6 Å²	71.6	35%	0.347	35%	0.349	S	S	.	.	H	α-helix	trans	-67.6	-28.7	175.1	-70.5	-177.3	-49.2	-107.7	-4.9	112.8	A94 E95 E96 L100 P253 P254 D256	A94-R98 VanDerWaalsContact O-CG 3.29Å; A94-R98 WeakPolarHBondContact O-CG 3.39Å; A94-R98 PolarHBondContact O-N 2.9Å; E95-R98 VanDerWaalsContact CA-NH2 3.31Å; E95-R98 PolarHBondContact O-N 3.27Å; E96-R98 VanDerWaalsContact C-N 3.35Å; E96-R98 PolarHBondContact O-N 3.44Å; R98-L100 VanDerWaalsContact C-N 3.33Å; R98-P253 HydrophobicContact CG-CB 4.5Å; R98-P253 HydrophobicContact CG-CG 3.98Å; R98-P254 PolarHBondContact NH1-O 2.96Å; R98-D256 IonicContact CZ-OD1 3.19Å; R98-D256 IonicContact NH1-OD1 2.83Å; R98-D256 PolarHBondContact NH1-OD1 2.73Å; R98-D256 VanDerWaalsContact NH2-CG 3.29Å; R98-D256 IonicContact NH2-OD1 3.55Å; R98-D256 PolarHBondContact NH2-OD1 3.37Å; R98-D256 IonicContact NH2-OD2 3.62Å; R98-D256 PolarHBondContact NH2-OD2 3.37Å
99	S	95.1	Very high	92.1	Very high	94 Å²	94	67.3 Å²	67.3	66%	0.657	33%	0.326	S	S	*	.	H	α-helix	trans	-74.4	-23.6	177.7	81.5	0	0	0	0	113.3	E95 E96 V97	E95-S99 PolarHBondContact O-N 2.9Å; E96-S99 WeakPolarHBondContact O-CB 3.28Å; E96-S99 PolarHBondContact O-N 3.49Å; E96-S99 PolarHBondContact O-OG 3.23Å; V97-S99 VanDerWaalsContact C-N 3.28Å; V97-S99 PolarHBondContact O-N 2.9Å
100	L	93.3	Very high	91.9	Very high	42 Å²	42	66 Å²	66	22%	0.22	32%	0.321	C	S	.	.	S	Bend	trans	-75.9	135	-177	-66.8	171.9	0	0	0	112.1	E96 V97 R98 Y102 G103 N106 F109	E96-L100 WeakPolarHBondContact O-CG 3.32Å; E96-L100 PolarHBondContact O-N 3.5Å; V97-L100 PolarHBondContact O-N 3.28Å; R98-L100 VanDerWaalsContact C-N 3.33Å; L100-Y102 PolarHBondContact O-N 3.43Å; L100-Y102 VanDerWaalsContact O-N 3.1Å; L100-G103 PolarHBondContact O-N 2.98Å; L100-N106 HydrophobicContact CB-CB 4.09Å; L100-N106 HydrophobicContact CD1-CB 4.09Å; L100-N106 HydrophobicContact CG-CB 4.48Å; L100-F109 HydrophobicContact CD1-CB 3.54Å; L100-F109 HydrophobicContact CD1-CD1 4.47Å; L100-F109 HydrophobicContact CD1-CD2 3.51Å; L100-F109 HydrophobicContact CD1-CE2 4.34Å; L100-F109 HydrophobicContact CD1-CG 3.58Å
101	K	87.4	Confident	91.7	Very high	150 Å²	150	65.3 Å²	65.3	65%	0.652	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	117.7	166.1	-166.7	-178.7	179.4	179.9	0	108.6	N106	K101-N106 PolarHBondContact O-ND2 3.2Å
102	Y	87.8	Confident	91.5	Very high	174 Å²	174	65.4 Å²	65.4	68%	0.682	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.5	11	-173.5	-45.1	-66.6	0	0	0	116.5	L100 L104 L105	L100-Y102 PolarHBondContact O-N 3.43Å; L100-Y102 VanDerWaalsContact O-N 3.1Å; Y102-L104 PolarHBondContact O-N 3.28Å; Y102-L105 WeakPolarHBondContact O-CB 3.38Å; Y102-L105 PolarHBondContact O-N 3.4Å; Y102-L105 VanDerWaalsContact O-N 3.08Å
103	G	89.8	Confident	91.3	Very high	15 Å²	15	68.4 Å²	68.4	16%	0.155	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	56	-129.8	174.8	0	0	0	0	0	113.4	V97 L100 L105 N106	V97-G103 VanDerWaalsContact O-CA 3.3Å; V97-G103 WeakPolarHBondContact O-CA 3.47Å; L100-G103 PolarHBondContact O-N 2.98Å; G103-L105 PolarHBondContact O-N 3.01Å; G103-N106 WeakPolarHBondContact O-CB 3.49Å; G103-N106 PolarHBondContact O-N 3.46Å
104	L	88.7	Confident	91.2	Very high	10 Å²	10	71.4 Å²	71.4	5%	0.052	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-58.6	-17.3	178.2	-69.1	-177	0	0	0	114.4	F37 V97 Y102 N106 F109 F172 L251	F37-L104 HydrophobicContact CE2-CD1 4.1Å; F37-L104 HydrophobicContact CE2-CD2 4.25Å; F37-L104 HydrophobicContact CE2-CG 4.39Å; F37-L104 HydrophobicContact CZ-CD2 4.25Å; V97-L104 HydrophobicContact CB-CD2 4.44Å; V97-L104 HydrophobicContact CG1-CD2 3.89Å; V97-L104 HydrophobicContact CG1-CG 3.85Å; V97-L104 HydrophobicContact CG2-CD2 3.63Å; Y102-L104 PolarHBondContact O-N 3.28Å; L104-N106 VanDerWaalsContact C-N 3.29Å; L104-F109 HydrophobicContact CD2-CD1 4.17Å; L104-F109 HydrophobicContact CD2-CE1 3.44Å; L104-F109 VanDerWaalsContact CD2-CE1 3.44Å; L104-F109 HydrophobicContact CD2-CZ 4.16Å; L104-F172 HydrophobicContact CB-CB 4.47Å; L104-F172 HydrophobicContact CB-CD1 4.05Å; L104-F172 HydrophobicContact CD1-CB 4.05Å; L104-F172 HydrophobicContact CD1-CD1 3.88Å; L104-F172 HydrophobicContact CD1-CG 4.38Å; L104-L251 WeakPolarHBondContact CD1-O 3.25Å
105	L	86.3	Confident	91.2	Very high	74 Å²	74	72.1 Å²	72.1	39%	0.387	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-87.6	0.9	178	-57.7	179.1	0	0	0	112.8	Y102 G103 R107 F171 F172 I175	Y102-L105 WeakPolarHBondContact O-CB 3.38Å; Y102-L105 PolarHBondContact O-N 3.4Å; Y102-L105 VanDerWaalsContact O-N 3.08Å; G103-L105 PolarHBondContact O-N 3.01Å; L105-R107 PolarHBondContact O-N 3.16Å; L105-F171 WeakPolarHBondContact CD2-O 3.37Å; L105-F172 HydrophobicContact CD2-CD1 4.32Å; L105-I175 HydrophobicContact CB-CD1 4.15Å; L105-I175 HydrophobicContact CD2-CD1 4.27Å; L105-I175 HydrophobicContact CD2-CG1 4.43Å; L105-I175 WeakPolarHBondContact O-CD1 3.47Å
106	N	87.2	Confident	91.2	Very high	30 Å²	30	70.1 Å²	70.1	16%	0.16	32%	0.323	C	S	.	.			trans	-64.2	131.1	174.1	-171.5	-56.3	0	0	0	110.2	L100 K101 G103 L104 E108 F109	L100-N106 HydrophobicContact CB-CB 4.09Å; L100-N106 HydrophobicContact CD1-CB 4.09Å; L100-N106 HydrophobicContact CG-CB 4.48Å; K101-N106 PolarHBondContact O-ND2 3.2Å; G103-N106 WeakPolarHBondContact O-CB 3.49Å; G103-N106 PolarHBondContact O-N 3.46Å; L104-N106 VanDerWaalsContact C-N 3.29Å; N106-E108 VanDerWaalsContact C-N 3.29Å; N106-E108 PolarHBondContact O-N 2.65Å; N106-E108 PolarHBondContact OD1-N 2.87Å; N106-F109 HydrophobicContact CB-CB 4.12Å; N106-F109 PolarHBondContact O-N 3.08Å
107	R	84.9	Confident	91.2	Very high	194 Å²	194	71.4 Å²	71.4	73%	0.732	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	-21.6	-174.4	-65.2	-175.3	177.8	-164.7	-2.2	114.3	L105 F109 H176	L105-R107 PolarHBondContact O-N 3.16Å; R107-F109 VanDerWaalsContact C-N 3.33Å; R107-H176 WeakPolarHBondContact CD-NE2 3.32Å; R107-H176 PolarHBondContact NE-NE2 3.42Å
108	E	85.9	Confident	91.4	Very high	188 Å²	188	74 Å²	74	88%	0.879	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-7.6	178.2	-62	177.7	-179	0	0	111.7	N106	N106-E108 VanDerWaalsContact C-N 3.29Å; N106-E108 PolarHBondContact O-N 2.65Å; N106-E108 PolarHBondContact OD1-N 2.87Å
109	F	89	Confident	91.5	Very high	5 Å²	5	70 Å²	70	2%	0.022	33%	0.329	C	S	.	.			trans	-99.5	130.3	-179.9	-178.5	-94.9	0	0	0	111.5	L93 E96 V97 L100 L104 N106 R107 L111 R114	L93-F109 HydrophobicContact CD1-CE2 3.93Å; L93-F109 HydrophobicContact CD1-CZ 3.7Å; E96-F109 HydrophobicContact CG-CE2 4.3Å; V97-F109 HydrophobicContact CG2-CE1 3.84Å; V97-F109 HydrophobicContact CG2-CE2 3.79Å; V97-F109 HydrophobicContact CG2-CZ 3.39Å; L100-F109 HydrophobicContact CD1-CB 3.54Å; L100-F109 HydrophobicContact CD1-CD1 4.47Å; L100-F109 HydrophobicContact CD1-CD2 3.51Å; L100-F109 HydrophobicContact CD1-CE2 4.34Å; L100-F109 HydrophobicContact CD1-CG 3.58Å; L104-F109 HydrophobicContact CD2-CD1 4.17Å; L104-F109 HydrophobicContact CD2-CE1 3.44Å; L104-F109 VanDerWaalsContact CD2-CE1 3.44Å; L104-F109 HydrophobicContact CD2-CZ 4.16Å; N106-F109 HydrophobicContact CB-CB 4.12Å; N106-F109 PolarHBondContact O-N 3.08Å; R107-F109 VanDerWaalsContact C-N 3.33Å; F109-L111 HydrophobicContact CE1-CB 3.93Å; F109-L111 HydrophobicContact CE1-CD1 4.43Å; F109-L111 HydrophobicContact CZ-CD1 4.38Å; F109-R114 HydrophobicContact CE2-CG 4.23Å; F109-R114 HydrophobicContact CZ-CG 4.49Å
110	S	91.1	Very high	91.6	Very high	12 Å²	12	66.9 Å²	66.9	8%	0.084	31%	0.307	C	S	.	.			trans	-121.6	106.8	175.6	-179.9	0	0	0	0	109.7	S112 H113 R114 E177	S110-S112 PolarHBondContact O-N 3.27Å; S110-H113 WeakPolarHBondContact OG-CB 3.31Å; S110-H113 PolarHBondContact OG-N 3.31Å; S110-R114 VanDerWaalsContact O-CG 3.26Å; S110-R114 WeakPolarHBondContact O-CG 3.28Å; S110-R114 PolarHBondContact O-N 3.4Å; S110-E177 WeakPolarHBondContact CB-OE1 3.2Å; S110-E177 PolarHBondContact OG-OE1 3.17Å; S110-E177 PolarHBondContact OG-OE2 3.35Å
111	L	92.1	Very high	91.8	Very high	18 Å²	18	71.6 Å²	71.6	9%	0.094	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-37.7	171.5	-174.1	57.5	0	0	0	110.4	L93 F109 R114 V115	L93-L111 HydrophobicContact CD2-CD1 3.73Å; F109-L111 HydrophobicContact CE1-CB 3.93Å; F109-L111 HydrophobicContact CE1-CD1 4.43Å; F109-L111 HydrophobicContact CZ-CD1 4.38Å; L111-R114 PolarHBondContact O-N 2.82Å; L111-V115 HydrophobicContact CD1-CG2 4.23Å; L111-V115 HydrophobicContact CG-CG2 4.33Å; L111-V115 VanDerWaalsContact O-CG2 3.32Å; L111-V115 WeakPolarHBondContact O-CG2 3.09Å; L111-V115 PolarHBondContact O-N 2.99Å
112	S	92.8	Very high	92.3	Very high	9 Å²	9	65.1 Å²	65.1	6%	0.063	29%	0.294	C	S	.	.	H	α-helix	trans	-60.1	-48	-178.6	-44.4	0	0	0	0	111.7	S110 V115 Y116 Y168 S173 E177	S110-S112 PolarHBondContact O-N 3.27Å; S112-V115 PolarHBondContact O-N 3.19Å; S112-Y116 WeakPolarHBondContact O-CB 3.43Å; S112-Y116 PolarHBondContact O-N 2.89Å; S112-Y168 VanDerWaalsContact OG-CD2 3.26Å; S112-Y168 WeakPolarHBondContact OG-CD2 3.15Å; S112-Y168 WeakPolarHBondContact OG-CE2 3.44Å; S112-S173 PolarHBondContact OG-O 3.34Å; S112-E177 WeakPolarHBondContact CB-OE2 3.37Å; S112-E177 PolarHBondContact OG-OE2 3.45Å
113	H	92.7	Very high	92.8	Very high	116 Å²	116	57.1 Å²	57.1	54%	0.537	26%	0.263	S	S	.	.	H	α-helix	trans	-67	-42.7	177.7	-65.4	169.9	0	0	0	111.6	S110 V115 Y116 D117	S110-H113 WeakPolarHBondContact OG-CB 3.31Å; S110-H113 PolarHBondContact OG-N 3.31Å; H113-V115 VanDerWaalsContact C-N 3.34Å; H113-V115 PolarHBondContact O-N 2.86Å; H113-Y116 WeakPolarHBondContact O-CB 3.48Å; H113-Y116 PolarHBondContact O-N 3.11Å; H113-Y116 VanDerWaalsContact O-N 3.16Å; H113-D117 WeakPolarHBondContact O-CB 3.43Å; H113-D117 VanDerWaalsContact O-CG 3.32Å; H113-D117 PolarHBondContact O-N 3.47Å
114	R	93.9	Very high	93.1	Very high	95 Å²	95	59 Å²	59	36%	0.358	27%	0.273	S	S	.	.	H	α-helix	trans	-58.3	-45.4	176.1	-70.2	-74.2	-173.4	-99.9	-2.6	111.8	L93 E96 F109 S110 L111 E118	L93-R114 HydrophobicContact CD1-CB 4.07Å; L93-R114 HydrophobicContact CD1-CG 4.04Å; E96-R114 IonicContact OE1-CZ 2.96Å; E96-R114 IonicContact OE1-NE 3.91Å; E96-R114 PolarHBondContact OE1-NE 3.23Å; E96-R114 IonicContact OE1-NH2 3.62Å; E96-R114 PolarHBondContact OE1-NH2 3.47Å; E96-R114 IonicContact OE2-CZ 3.6Å; E96-R114 IonicContact OE2-NE 3.21Å; E96-R114 PolarHBondContact OE2-NE 2.84Å; E96-R114 IonicContact OE2-NH2 2.71Å; F109-R114 HydrophobicContact CE2-CG 4.23Å; F109-R114 HydrophobicContact CZ-CG 4.49Å; S110-R114 VanDerWaalsContact O-CG 3.26Å; S110-R114 WeakPolarHBondContact O-CG 3.28Å; S110-R114 PolarHBondContact O-N 3.4Å; L111-R114 PolarHBondContact O-N 2.82Å; R114-E118 WeakPolarHBondContact O-CB 3.42Å; R114-E118 WeakPolarHBondContact O-CG 3.27Å; R114-E118 PolarHBondContact O-N 3.47Å
115	V	95.8	Very high	93.5	Very high	15 Å²	15	66.1 Å²	66.1	9%	0.091	31%	0.306	C	S	.	.	H	α-helix	trans	-63.6	-43.6	175.7	172.1	0	0	0	0	110.9	L71 L111 S112 H113 M119 V164	L71-V115 HydrophobicContact CD1-CG1 3.99Å; L71-V115 HydrophobicContact CD2-CG1 4Å; L111-V115 HydrophobicContact CD1-CG2 4.23Å; L111-V115 HydrophobicContact CG-CG2 4.33Å; L111-V115 VanDerWaalsContact O-CG2 3.32Å; L111-V115 WeakPolarHBondContact O-CG2 3.09Å; L111-V115 PolarHBondContact O-N 2.99Å; S112-V115 PolarHBondContact O-N 3.19Å; H113-V115 VanDerWaalsContact C-N 3.34Å; H113-V115 PolarHBondContact O-N 2.86Å; V115-M119 HydrophobicContact CG1-CG 4.12Å; V115-M119 VanDerWaalsContact O-CB 3.27Å; V115-M119 WeakPolarHBondContact O-CB 3.38Å; V115-M119 WeakPolarHBondContact O-CG 3.44Å; V115-M119 PolarHBondContact O-N 3Å; V115-V164 HydrophobicContact CG1-CG2 4.18Å
116	Y	96.6	Very high	94	Very high	78 Å²	78	66.6 Å²	66.6	31%	0.306	31%	0.306	S	S	.	.	H	α-helix	trans	-59.1	-49.8	177.8	-179.4	-88.8	0	0	0	111.8	S112 H113 S120 E157 L160 V164	S112-Y116 WeakPolarHBondContact O-CB 3.43Å; S112-Y116 PolarHBondContact O-N 2.89Å; H113-Y116 WeakPolarHBondContact O-CB 3.48Å; H113-Y116 PolarHBondContact O-N 3.11Å; H113-Y116 VanDerWaalsContact O-N 3.16Å; Y116-S120 WeakPolarHBondContact O-CB 3.24Å; Y116-S120 PolarHBondContact O-N 3.07Å; Y116-S120 PolarHBondContact O-OG 2.85Å; Y116-E157 PolarHBondContact OH-OE2 2.82Å; Y116-L160 HydrophobicContact CD2-CB 4.11Å; Y116-L160 HydrophobicContact CE2-CB 3.89Å; Y116-L160 HydrophobicContact CE2-CD1 4.08Å; Y116-V164 HydrophobicContact CD2-CG2 4.13Å; Y116-V164 HydrophobicContact CG-CG2 4.44Å
117	D	96.8	Very high	94.5	Very high	84 Å²	84	65.1 Å²	65.1	45%	0.449	30%	0.298	S	S	.	.	H	α-helix	trans	-63.9	-47.8	-177	-70.7	-17.7	0	0	0	111.2	H113 S120 R121	H113-D117 WeakPolarHBondContact O-CB 3.43Å; H113-D117 VanDerWaalsContact O-CG 3.32Å; H113-D117 PolarHBondContact O-N 3.47Å; D117-S120 WeakPolarHBondContact O-CB 3.46Å; D117-S120 PolarHBondContact O-N 3.41Å; D117-R121 PolarHBondContact O-N 3.47Å
118	E	96.9	Very high	95.1	Very high	60 Å²	60	57 Å²	57	28%	0.28	27%	0.268	S	S	.	.	H	α-helix	trans	-68.4	-42.6	-179.1	-68	-51.5	154	0	0	112.3	L89 R114 S120 R121 L122	L89-E118 HydrophobicContact CD1-CB 4Å; L89-E118 HydrophobicContact CD1-CG 3.96Å; L89-E118 WeakPolarHBondContact CD1-OE2 3.37Å; L89-E118 HydrophobicContact CD2-CG 4.27Å; L89-E118 VanDerWaalsContact CD2-OE2 3.32Å; L89-E118 WeakPolarHBondContact CD2-OE2 3.4Å; R114-E118 WeakPolarHBondContact O-CB 3.42Å; R114-E118 WeakPolarHBondContact O-CG 3.27Å; R114-E118 PolarHBondContact O-N 3.47Å; E118-S120 VanDerWaalsContact C-N 3.29Å; E118-S120 PolarHBondContact O-N 3.24Å; E118-R121 WeakPolarHBondContact O-CB 3.38Å; E118-R121 PolarHBondContact O-N 3.11Å; E118-R121 IonicContact OE2-CZ 3.83Å; E118-R121 IonicContact OE2-NE 3.12Å; E118-R121 PolarHBondContact OE2-NE 3.48Å; E118-R121 IonicContact OE2-NH2 2.66Å; E118-R121 PolarHBondContact OE2-NH2 3.33Å; E118-L122 VanDerWaalsContact O-CG 3.28Å; E118-L122 WeakPolarHBondContact O-CG 3.32Å; E118-L122 PolarHBondContact O-N 3.11Å
119	M	97.9	Very high	95.7	Very high	8 Å²	8	54.6 Å²	54.6	4%	0.039	26%	0.255	C	S	.	.	H	α-helix	trans	-66.7	-34.3	175.5	-66	-53.8	-62.8	0	0	111.8	L71 A74 L75 V115 R121 L122 L123 L160 L163	L71-M119 HydrophobicContact CB-CE 4.34Å; L71-M119 HydrophobicContact CB-SD 4.09Å; L71-M119 HydrophobicContact CD2-CE 4.36Å; L71-M119 HydrophobicContact CD2-CG 3.98Å; L71-M119 HydrophobicContact CD2-SD 4.11Å; L71-M119 HydrophobicContact CG-SD 4.46Å; A74-M119 HydrophobicContact CB-CE 4.4Å; L75-M119 HydrophobicContact CD2-CE 3.91Å; L75-M119 HydrophobicContact CG-CE 4.03Å; V115-M119 HydrophobicContact CG1-CG 4.12Å; V115-M119 VanDerWaalsContact O-CB 3.27Å; V115-M119 WeakPolarHBondContact O-CB 3.38Å; V115-M119 WeakPolarHBondContact O-CG 3.44Å; V115-M119 PolarHBondContact O-N 3Å; M119-R121 PolarHBondContact O-N 2.96Å; M119-L122 PolarHBondContact O-N 3.28Å; M119-L123 HydrophobicContact CB-CD1 4.37Å; M119-L123 HydrophobicContact CE-CD1 3.9Å; M119-L123 HydrophobicContact CE-CD2 4.11Å; M119-L123 HydrophobicContact CE-CG 3.91Å; M119-L123 VanDerWaalsContact O-CB 3.27Å; M119-L123 WeakPolarHBondContact O-CB 3.45Å; M119-L123 VanDerWaalsContact O-CG 3.32Å; M119-L123 WeakPolarHBondContact O-CG 3.46Å; M119-L123 PolarHBondContact O-N 3.35Å; M119-L160 HydrophobicContact CB-CD2 3.84Å; M119-L163 HydrophobicContact CE-CD1 3.94Å
120	S	97.4	Very high	96.1	Very high	28 Å²	28	57.4 Å²	57.4	20%	0.196	27%	0.272	C	S	.	.	H	α-helix	trans	-64.1	-24.5	171.8	-66.6	0	0	0	0	112.8	Y116 D117 E118 R156 L160	Y116-S120 WeakPolarHBondContact O-CB 3.24Å; Y116-S120 PolarHBondContact O-N 3.07Å; Y116-S120 PolarHBondContact O-OG 2.85Å; D117-S120 WeakPolarHBondContact O-CB 3.46Å; D117-S120 PolarHBondContact O-N 3.41Å; E118-S120 VanDerWaalsContact C-N 3.29Å; E118-S120 PolarHBondContact O-N 3.24Å; S120-R156 PolarHBondContact O-NH2 3.33Å; S120-L160 VanDerWaalsContact OG-CD1 3.3Å; S120-L160 WeakPolarHBondContact OG-CD1 3.33Å
121	R	96.9	Very high	96.4	Very high	141 Å²	141	56.8 Å²	56.8	53%	0.532	27%	0.268	S	S	.	.	H	α-helix	trans	-88.6	-38.7	176.7	-170.6	177.8	64.3	83.2	-0.4	112.7	L89 D117 E118 M119	L89-R121 VanDerWaalsContact CD1-NH2 3.27Å; D117-R121 PolarHBondContact O-N 3.47Å; E118-R121 WeakPolarHBondContact O-CB 3.38Å; E118-R121 PolarHBondContact O-N 3.11Å; E118-R121 IonicContact OE2-CZ 3.83Å; E118-R121 IonicContact OE2-NE 3.12Å; E118-R121 PolarHBondContact OE2-NE 3.48Å; E118-R121 IonicContact OE2-NH2 2.66Å; E118-R121 PolarHBondContact OE2-NH2 3.33Å; M119-R121 PolarHBondContact O-N 2.96Å
122	L	97.5	Very high	96.7	Very high	13 Å²	13	57.3 Å²	57.3	7%	0.068	27%	0.272	C	S	.	.	H	α-helix	trans	-81.5	-29.8	-175.1	-64.1	173.9	0	0	0	113.7	L75 S79 I85 A86 L89 E118 M119	L75-L122 HydrophobicContact CD1-CD1 4Å; L75-L122 HydrophobicContact CD2-CB 3.63Å; L75-L122 HydrophobicContact CD2-CD1 4.14Å; S79-L122 PolarHBondContact OG-O 3.48Å; I85-L122 HydrophobicContact CB-CD2 4.15Å; I85-L122 HydrophobicContact CG2-CD2 3.74Å; A86-L122 HydrophobicContact CB-CD1 4.02Å; L89-L122 HydrophobicContact CD1-CD1 3.77Å; L89-L122 HydrophobicContact CD1-CD2 4.26Å; L89-L122 HydrophobicContact CD1-CG 4.24Å; E118-L122 VanDerWaalsContact O-CG 3.28Å; E118-L122 WeakPolarHBondContact O-CG 3.32Å; E118-L122 PolarHBondContact O-N 3.11Å; M119-L122 PolarHBondContact O-N 3.28Å
123	L	97.9	Very high	96.9	Very high	6 Å²	6	61.8 Å²	61.8	3%	0.031	30%	0.295	C	S	.	.	S	Bend	trans	-84.4	135.1	-178.4	-67.6	174.9	0	0	0	111.7	A74 L75 T78 M119 A127 R156 L159 L160 L163	A74-L123 HydrophobicContact CB-CD2 4.3Å; L75-L123 HydrophobicContact CD2-CD2 3.96Å; T78-L123 WeakPolarHBondContact OG1-CD2 3.21Å; M119-L123 HydrophobicContact CB-CD1 4.37Å; M119-L123 HydrophobicContact CE-CD1 3.9Å; M119-L123 HydrophobicContact CE-CD2 4.11Å; M119-L123 HydrophobicContact CE-CG 3.91Å; M119-L123 VanDerWaalsContact O-CB 3.27Å; M119-L123 WeakPolarHBondContact O-CB 3.45Å; M119-L123 VanDerWaalsContact O-CG 3.32Å; M119-L123 WeakPolarHBondContact O-CG 3.46Å; M119-L123 PolarHBondContact O-N 3.35Å; L123-A127 HydrophobicContact CB-CB 4.04Å; L123-A127 HydrophobicContact CD2-CB 4.43Å; L123-R156 PolarHBondContact O-NH2 3.16Å; L123-L159 HydrophobicContact CD1-CD2 4.15Å; L123-L160 HydrophobicContact CD1-CD2 4.08Å; L123-L163 HydrophobicContact CD1-CD1 3.69Å
124	P	96.9	Very high	97.2	Very high	56 Å²	56	61 Å²	61	36%	0.364	29%	0.29	S	S	.	.			trans	-53.8	156.3	170.5	-24.9	33.3	0	0	0	112.8	E126 A127 R156	P124-E126 PolarHBondContact O-N 3.2Å; P124-A127 VanDerWaalsContact O-CB 3.28Å; P124-A127 WeakPolarHBondContact O-CB 3.3Å; P124-A127 PolarHBondContact O-N 3.13Å; P124-A127 VanDerWaalsContact O-N 3.15Å; P124-R156 PolarHBondContact O-NE 2.82Å
125	E	96.5	Very high	97.4	Very high	159 Å²	159	56.4 Å²	56.4	74%	0.743	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-37.2	177.6	-170.6	171.9	-171.7	0	0	111.9	R156	E125-R156 VanDerWaalsContact O-CD 3.31Å; E125-R156 WeakPolarHBondContact O-CD 3.25Å
126	E	96.5	Very high	97.6	Very high	83 Å²	83	57.1 Å²	57.1	39%	0.388	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	18.6	-177.9	-63.2	-65.5	-173	0	0	114.1	P124 H128 K129 V130	P124-E126 PolarHBondContact O-N 3.2Å; E126-H128 VanDerWaalsContact C-N 3.27Å; E126-H128 PolarHBondContact O-N 2.86Å; E126-H128 IonicContact OE2-CE1 3.23Å; E126-H128 PolarHBondContact OE2-CE1 3.14Å; E126-H128 IonicContact OE2-NE2 3.32Å; E126-K129 PolarHBondContact O-N 2.84Å; E126-K129 IonicContact OE1-NZ 2.83Å; E126-K129 PolarHBondContact OE1-NZ 2.93Å; E126-K129 WeakPolarHBondContact OE2-CD 3.38Å; E126-K129 WeakPolarHBondContact OE2-CE 3.49Å; E126-K129 IonicContact OE2-NZ 2.71Å; E126-K129 PolarHBondContact OE2-NZ 3.44Å; E126-V130 PolarHBondContact O-N 3.31Å
127	A	97.9	Very high	97.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-52.6	-43.2	-177.5	0	0	0	0	0	112.8	T78 L123 P124 K129 V130 V131 L159	T78-A127 HydrophobicContact CG2-CB 4.21Å; L123-A127 HydrophobicContact CB-CB 4.04Å; L123-A127 HydrophobicContact CD2-CB 4.43Å; P124-A127 VanDerWaalsContact O-CB 3.28Å; P124-A127 WeakPolarHBondContact O-CB 3.3Å; P124-A127 PolarHBondContact O-N 3.13Å; P124-A127 VanDerWaalsContact O-N 3.15Å; A127-K129 VanDerWaalsContact C-N 3.27Å; A127-K129 PolarHBondContact O-N 2.62Å; A127-V130 PolarHBondContact O-N 3.25Å; A127-V131 WeakPolarHBondContact O-CG1 3.26Å; A127-V131 WeakPolarHBondContact O-CG2 3.42Å; A127-V131 PolarHBondContact O-N 3.39Å; A127-L159 HydrophobicContact CB-CD2 3.88Å
128	H	98.3	Very high	97.8	Very high	22 Å²	22	49.5 Å²	49.5	10%	0.102	24%	0.239	C	C	.	.	H	α-helix	trans	-57.2	-34.5	179	66.7	-70.9	0	0	0	114.2	E126 T132 F153 T155 R156 L159	E126-H128 VanDerWaalsContact C-N 3.27Å; E126-H128 PolarHBondContact O-N 2.86Å; E126-H128 IonicContact OE2-CE1 3.23Å; E126-H128 PolarHBondContact OE2-CE1 3.14Å; E126-H128 IonicContact OE2-NE2 3.32Å; H128-T132 WeakPolarHBondContact O-CB 3.36Å; H128-T132 PolarHBondContact O-N 3.13Å; H128-T132 PolarHBondContact O-OG1 2.99Å; H128-F153 HydrophobicContact CB-CB 4.02Å; H128-T155 WeakPolarHBondContact CB-O 3.44Å; H128-T155 VanDerWaalsContact CG-C 3.44Å; H128-R156 VanDerWaalsContact CG-N 3.26Å; H128-R156 PolarHBondContact ND1-N 3.16Å; H128-L159 HydrophobicContact CB-CB 4.31Å; H128-L159 HydrophobicContact CB-CD2 4.38Å
129	K	98	Very high	97.8	Very high	138 Å²	138	46.6 Å²	46.6	60%	0.6	23%	0.226	S	C	*	.	H	α-helix	trans	-71.8	-37.2	175.7	-62	-175.9	-176.6	150.2	0	111.8	E126 A127	E126-K129 PolarHBondContact O-N 2.84Å; E126-K129 IonicContact OE1-NZ 2.83Å; E126-K129 PolarHBondContact OE1-NZ 2.93Å; E126-K129 WeakPolarHBondContact OE2-CD 3.38Å; E126-K129 WeakPolarHBondContact OE2-CE 3.49Å; E126-K129 IonicContact OE2-NZ 2.71Å; E126-K129 PolarHBondContact OE2-NZ 3.44Å; A127-K129 VanDerWaalsContact C-N 3.27Å; A127-K129 PolarHBondContact O-N 2.62Å
130	V	96.9	Very high	97.8	Very high	64 Å²	64	46.2 Å²	46.2	39%	0.388	22%	0.224	S	C	.	.	H	α-helix	trans	-71.1	-42.3	-180	178.7	0	0	0	0	111.4	T78 E126 A127 K134	T78-V130 HydrophobicContact CG2-CB 4.4Å; T78-V130 HydrophobicContact CG2-CG1 4.26Å; E126-V130 PolarHBondContact O-N 3.31Å; A127-V130 PolarHBondContact O-N 3.25Å; V130-K134 WeakPolarHBondContact O-CD 3.25Å
131	V	98.2	Very high	97.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-90.4	-18	-170.1	-54.6	0	0	0	0	114.4	L77 T78 A127 N133 K134 L135 F153 L159	L77-V131 HydrophobicContact CD2-CB 4.03Å; L77-V131 HydrophobicContact CD2-CG1 3.81Å; L77-V131 HydrophobicContact CG-CG1 4.18Å; T78-V131 HydrophobicContact CG2-CG1 3.13Å; A127-V131 WeakPolarHBondContact O-CG1 3.26Å; A127-V131 WeakPolarHBondContact O-CG2 3.42Å; A127-V131 PolarHBondContact O-N 3.39Å; V131-N133 PolarHBondContact O-N 2.85Å; V131-K134 CarbonylContact O-C 3.57Å; V131-K134 WeakPolarHBondContact O-CA 3.48Å; V131-K134 PolarHBondContact O-N 3.34Å; V131-L135 HydrophobicContact CB-CB 3.7Å; V131-L135 HydrophobicContact CB-CD2 4.16Å; V131-L135 HydrophobicContact CG1-CB 4.46Å; V131-L135 HydrophobicContact CG1-CD2 4.44Å; V131-L135 HydrophobicContact CG2-CB 4.29Å; V131-L135 HydrophobicContact CG2-CD2 4.17Å; V131-L135 PolarHBondContact O-N 2.93Å; V131-F153 HydrophobicContact CG2-CD2 3.71Å; V131-F153 HydrophobicContact CG2-CE2 4Å; V131-L159 HydrophobicContact CG2-CD1 3.93Å; V131-L159 HydrophobicContact CG2-CD2 3.82Å; V131-L159 HydrophobicContact CG2-CG 4.49Å
132	T	98.3	Very high	97.6	Very high	28 Å²	28	44 Å²	44	17%	0.172	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	132.1	176.6	-76.9	0	0	0	0	111.1	H128 K134 S151 H152 F153	H128-T132 WeakPolarHBondContact O-CB 3.36Å; H128-T132 PolarHBondContact O-N 3.13Å; H128-T132 PolarHBondContact O-OG1 2.99Å; T132-K134 PolarHBondContact O-N 3.18Å; T132-S151 WeakPolarHBondContact CA-O 3.29Å; T132-H152 WeakPolarHBondContact CG2-ND1 3.49Å; T132-F153 PolarHBondContact OG1-N 2.75Å; T132-F153 PolarHBondContact OG1-O 3.07Å
133	N	98	Very high	97.4	Very high	104 Å²	104	48.2 Å²	48.2	56%	0.556	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.4	5.6	-173.1	-56.4	-43.7	0	0	0	115.8	V131 S151	V131-N133 PolarHBondContact O-N 2.85Å; N133-S151 PolarHBondContact N-O 3.49Å
134	K	98.4	Very high	97.3	Very high	98 Å²	98	51.6 Å²	51.6	43%	0.426	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-37.8	178.5	-62.9	-175.3	-169.3	166.6	0	112.5	R62 F63 L77 V130 V131 T132 F136	R62-K134 CarbonylContact C-O 3.43Å; R62-K134 VanDerWaalsContact CA-O 3.27Å; R62-K134 WeakPolarHBondContact CA-O 3.33Å; F63-K134 PolarHBondContact N-O 3.42Å; L77-K134 HydrophobicContact CD1-CD 4.48Å; L77-K134 HydrophobicContact CD2-CB 3.75Å; V130-K134 WeakPolarHBondContact O-CD 3.25Å; V131-K134 CarbonylContact O-C 3.57Å; V131-K134 WeakPolarHBondContact O-CA 3.48Å; V131-K134 PolarHBondContact O-N 3.34Å; T132-K134 PolarHBondContact O-N 3.18Å; K134-F136 WeakPolarHBondContact O-CD2 3.38Å
135	L	98.8	Very high	97.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	135	174.7	-178.6	67.5	0	0	0	110.2	F63 A73 A74 L77 V131 I137 S151 F153 L159	F63-L135 HydrophobicContact CB-CD1 4.19Å; F63-L135 CarbonylContact O-C 3.47Å; F63-L135 VanDerWaalsContact O-CA 3.26Å; F63-L135 WeakPolarHBondContact O-CA 3.35Å; A73-L135 HydrophobicContact CB-CD1 3.74Å; A74-L135 HydrophobicContact CB-CD1 4.47Å; A74-L135 HydrophobicContact CB-CD2 3.75Å; L77-L135 HydrophobicContact CD2-CB 4.12Å; V131-L135 HydrophobicContact CB-CB 3.7Å; V131-L135 HydrophobicContact CB-CD2 4.16Å; V131-L135 HydrophobicContact CG1-CB 4.46Å; V131-L135 HydrophobicContact CG1-CD2 4.44Å; V131-L135 HydrophobicContact CG2-CB 4.29Å; V131-L135 HydrophobicContact CG2-CD2 4.17Å; V131-L135 PolarHBondContact O-N 2.93Å; L135-I137 HydrophobicContact CD2-CD1 3.89Å; L135-I137 HydrophobicContact CD2-CG1 3.97Å; L135-I137 HydrophobicContact CG-CD1 4.4Å; L135-I137 HydrophobicContact CG-CG1 3.94Å; L135-S151 VanDerWaalsContact O-CA 3.25Å; L135-S151 WeakPolarHBondContact O-CA 3.46Å; L135-S151 WeakPolarHBondContact O-CB 3.35Å; L135-F153 HydrophobicContact CB-CE2 4.32Å; L135-L159 HydrophobicContact CD2-CD1 3.9Å
136	F	98.7	Very high	97.1	Very high	29 Å²	29	53.9 Å²	53.9	13%	0.127	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	106.3	-179.1	-69.6	-102.7	0	0	0	109.6	R62 F63 A64 G65 K134 L149 E150 F199	R62-F136 HydrophobicContact CB-CD2 4.09Å; R62-F136 HydrophobicContact CB-CE2 3.88Å; R62-F136 HydrophobicContact CG-CD2 4.33Å; R62-F136 HydrophobicContact CG-CE2 3.62Å; R62-F136 HydrophobicContact CG-CZ 4.28Å; F63-F136 PolarHBondContact O-N 3.3Å; A64-F136 VanDerWaalsContact CA-O 3.25Å; A64-F136 WeakPolarHBondContact CA-O 3.38Å; A64-F136 HydrophobicContact CB-CB 3.87Å; G65-F136 PolarHBondContact N-O 2.98Å; G65-F136 VanDerWaalsContact N-O 3.07Å; K134-F136 WeakPolarHBondContact O-CD2 3.38Å; F136-L149 HydrophobicContact CB-CD1 3.95Å; F136-L149 HydrophobicContact CB-CD2 4.16Å; F136-L149 HydrophobicContact CB-CG 3.96Å; F136-L149 HydrophobicContact CD1-CD2 3.86Å; F136-L149 HydrophobicContact CD1-CG 4.05Å; F136-L149 HydrophobicContact CG-CD2 4.44Å; F136-E150 CarbonylContact C-O 3.5Å; F136-E150 VanDerWaalsContact CA-O 3.31Å; F136-E150 WeakPolarHBondContact CA-O 3.48Å; F136-F199 HydrophobicContact CB-CE1 4.38Å; F136-F199 HydrophobicContact CB-CZ 3.87Å; F136-F199 AromaticContact CD1-CE1 3.69Å; F136-F199 HydrophobicContact CD1-CE1 3.69Å; F136-F199 HydrophobicContact CD1-CZ 4Å; F136-F199 AromaticContact CD2-CE1 3.9Å; F136-F199 HydrophobicContact CD2-CE1 3.9Å; F136-F199 AromaticContact CD2-CZ 3.51Å; F136-F199 HydrophobicContact CD2-CZ 3.51Å; F136-F199 AromaticContact CE1-CE1 3.87Å; F136-F199 HydrophobicContact CE1-CE1 3.87Å; F136-F199 HydrophobicContact CE1-CZ 4.45Å; F136-F199 HydrophobicContact CE2-CE1 4.1Å; F136-F199 HydrophobicContact CE2-CZ 4.05Å; F136-F199 AromaticContact CG-CE1 3.71Å; F136-F199 HydrophobicContact CG-CE1 3.71Å; F136-F199 AromaticContact CG-CZ 3.51Å; F136-F199 HydrophobicContact CG-CZ 3.51Å; F136-F199 HydrophobicContact CZ-CE1 4.07Å; F136-F199 HydrophobicContact CZ-CZ 4.49Å
137	I	98.7	Very high	97.1	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	116.9	-174.9	-58	178.9	0	0	0	109.1	A70 L135 M139 L149 E150 F153 L159 C162 L163 S166	A70-I137 HydrophobicContact CB-CG2 4.12Å; L135-I137 HydrophobicContact CD2-CD1 3.89Å; L135-I137 HydrophobicContact CD2-CG1 3.97Å; L135-I137 HydrophobicContact CG-CD1 4.4Å; L135-I137 HydrophobicContact CG-CG1 3.94Å; I137-M139 HydrophobicContact CG2-CG 4.07Å; I137-L149 WeakPolarHBondContact O-CA 3.09Å; I137-E150 PolarHBondContact N-O 3.16Å; I137-E150 PolarHBondContact O-N 3.08Å; I137-F153 HydrophobicContact CD1-CE1 3.78Å; I137-F153 HydrophobicContact CD1-CZ 3.63Å; I137-F153 HydrophobicContact CG1-CZ 4Å; I137-L159 HydrophobicContact CD1-CD1 3.96Å; I137-C162 HydrophobicContact CD1-CB 3.8Å; I137-C162 HydrophobicContact CG2-CB 4.45Å; I137-L163 HydrophobicContact CD1-CD2 3.65Å; I137-L163 HydrophobicContact CD1-CG 3.87Å; I137-L163 HydrophobicContact CG1-CD2 4.41Å; I137-S166 VanDerWaalsContact CG2-CB 3.43Å
138	S	98.5	Very high	97	Very high	2 Å²	2	55.1 Å²	55.1	1%	0.014	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	128.7	173.8	-173.3	0	0	0	0	109.9	G65 S166 G190 L194	G65-S138 WeakPolarHBondContact O-CB 3.4Å; G65-S138 PolarHBondContact O-N 3.42Å; S138-S166 WeakPolarHBondContact O-CB 3.34Å; S138-S166 PolarHBondContact O-OG 3.36Å; S138-G190 VanDerWaalsContact O-CA 3.25Å; S138-G190 WeakPolarHBondContact O-CA 3.23Å; S138-G190 WeakPolarHBondContact OG-CA 3.48Å; S138-G190 PolarHBondContact OG-O 2.81Å; S138-L194 WeakPolarHBondContact CB-O 3.12Å; S138-L194 PolarHBondContact OG-O 3.44Å
139	M	98.1	Very high	97	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	158.2	175.4	-63.5	-179.4	-64.1	0	0	109.2	I137 G147 R148 E150 C162 A165 I182 Y187	I137-M139 HydrophobicContact CG2-CG 4.07Å; M139-G147 CarbonylContact O-C 3.56Å; M139-G147 WeakPolarHBondContact O-CA 3.44Å; M139-R148 HydrophobicContact CE-CG 4.35Å; M139-R148 PolarHBondContact N-O 3.11Å; M139-R148 PolarHBondContact O-N 2.7Å; M139-E150 HydrophobicContact CE-CB 3.53Å; M139-E150 HydrophobicContact CE-CG 4.3Å; M139-C162 HydrophobicContact CE-CB 4.41Å; M139-C162 HydrophobicContact SD-CB 3.99Å; M139-A165 HydrophobicContact CG-CB 4.4Å; M139-A165 HydrophobicContact SD-CB 3.76Å; M139-I182 HydrophobicContact CE-CD1 4.31Å; M139-I182 HydrophobicContact SD-CD1 3.8Å; M139-Y187 HydrophobicContact CB-CD1 3.87Å; M139-Y187 HydrophobicContact CB-CG 4.26Å; M139-Y187 HydrophobicContact SD-CG 4.26Å
140	T	97.6	Very high	97	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	124.2	174	-55.4	0	0	0	0	108.7	R142 Y187 I188 D189 I192 C193	T140-R142 PolarHBondContact O-N 3.3Å; T140-Y187 CarbonylContact O-C 3.35Å; T140-Y187 WeakPolarHBondContact O-CA 3.42Å; T140-I188 HydrophobicContact CG2-CD1 4.44Å; T140-I188 HydrophobicContact CG2-CG1 4.2Å; T140-I188 PolarHBondContact N-O 3.29Å; T140-I188 WeakPolarHBondContact O-CG1 3.44Å; T140-I188 PolarHBondContact O-N 2.7Å; T140-D189 WeakPolarHBondContact CB-O 3.36Å; T140-D189 PolarHBondContact OG1-O 3.29Å; T140-I192 HydrophobicContact CG2-CB 4.43Å; T140-I192 HydrophobicContact CG2-CG2 4.29Å; T140-C193 HydrophobicContact CG2-CB 4.37Å; T140-C193 VanDerWaalsContact CG2-SG 3.51Å; T140-C193 WeakPolarHBondContact OG1-CB 3.47Å
141	D	96.7	Very high	97.1	Very high	17 Å²	17	49.6 Å²	49.6	9%	0.091	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	122	171.1	-179.1	-72.1	0	0	0	108.8	D143 T144 L145 K146 Y187	D141-D143 VanDerWaalsContact C-N 3.34Å; D141-D143 PolarHBondContact O-N 2.86Å; D141-D143 PolarHBondContact OD1-N 3.39Å; D141-D143 VanDerWaalsContact OD1-N 3.11Å; D141-T144 VanDerWaalsContact CB-OG1 3.31Å; D141-T144 WeakPolarHBondContact CB-OG1 3.44Å; D141-T144 WeakPolarHBondContact OD1-CB 3.47Å; D141-T144 PolarHBondContact OD1-N 3.41Å; D141-T144 PolarHBondContact OD1-OG1 2.84Å; D141-L145 WeakPolarHBondContact O-CA 3.16Å; D141-L145 PolarHBondContact O-N 2.8Å; D141-K146 WeakPolarHBondContact CB-O 3.48Å; D141-K146 PolarHBondContact N-O 3.36Å; D141-Y187 HydrophobicContact CB-CD1 4.22Å; D141-Y187 HydrophobicContact CB-CE1 3.79Å
142	R	93.8	Very high	97.1	Very high	104 Å²	104	53.5 Å²	53.5	39%	0.392	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-40.7	-172.2	174.5	174.9	171.8	-92.6	10.2	112.7	T140 L145 R186 I188	T140-R142 PolarHBondContact O-N 3.3Å; R142-L145 WeakPolarHBondContact O-CD2 3.5Å; R142-R186 HydrophobicContact CB-CB 4.27Å; R142-R186 WeakPolarHBondContact CB-O 3.26Å; R142-R186 PolarHBondContact N-O 2.81Å; R142-I188 HydrophobicContact CB-CG2 4.18Å; R142-I188 HydrophobicContact CG-CG2 4.47Å
143	D	93.3	Very high	97.1	Very high	103 Å²	103	52.3 Å²	52.3	55%	0.551	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-32.7	-167.2	-59.5	-33.7	0	0	0	110.8	D141	D141-D143 VanDerWaalsContact C-N 3.34Å; D141-D143 PolarHBondContact O-N 2.86Å; D141-D143 PolarHBondContact OD1-N 3.39Å; D141-D143 VanDerWaalsContact OD1-N 3.11Å
144	T	95.5	Very high	97	Very high	76 Å²	76	52.1 Å²	52.1	47%	0.466	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-13.8	178.3	66.3	0	0	0	0	114.2	D141 K146	D141-T144 VanDerWaalsContact CB-OG1 3.31Å; D141-T144 WeakPolarHBondContact CB-OG1 3.44Å; D141-T144 WeakPolarHBondContact OD1-CB 3.47Å; D141-T144 PolarHBondContact OD1-N 3.41Å; D141-T144 PolarHBondContact OD1-OG1 2.84Å; T144-K146 PolarHBondContact O-N 2.89Å; T144-K146 PolarHBondContact OG1-N 3.41Å
145	L	92.9	Very high	97	Very high	116 Å²	116	50.7 Å²	50.7	61%	0.607	26%	0.262	S	S	*	.			trans	54.8	30.1	-173.3	-57	177.8	0	0	0	113.4	D141 R142 C193	D141-L145 WeakPolarHBondContact O-CA 3.16Å; D141-L145 PolarHBondContact O-N 2.8Å; R142-L145 WeakPolarHBondContact O-CD2 3.5Å; L145-C193 PolarHBondContact O-SG 3.33Å; L145-C193 VanDerWaalsContact O-SG 3.35Å
146	K	96.1	Very high	96.9	Very high	147 Å²	147	53.8 Å²	53.8	64%	0.639	27%	0.274	S	S	*	.			trans	-98.7	138.7	176.4	-67.6	179.6	-178.7	175.5	0	110.3	D141 T144	D141-K146 WeakPolarHBondContact CB-O 3.48Å; D141-K146 PolarHBondContact N-O 3.36Å; T144-K146 PolarHBondContact O-N 2.89Å; T144-K146 PolarHBondContact OG1-N 3.41Å
147	G	95.9	Very high	96.9	Very high	49 Å²	49	55.9 Å²	55.9	51%	0.505	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	138.6	174.2	0	0	0	0	0	112.3	M139	M139-G147 CarbonylContact O-C 3.56Å; M139-G147 WeakPolarHBondContact O-CA 3.44Å
148	R	97	Very high	96.8	Very high	60 Å²	60	56.8 Å²	56.8	23%	0.226	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	132.7	168.2	179.2	173.3	179.1	161.5	3.3	108.1	M139 E150 E183 Y187	M139-R148 HydrophobicContact CE-CG 4.35Å; M139-R148 PolarHBondContact N-O 3.11Å; M139-R148 PolarHBondContact O-N 2.7Å; R148-E150 IonicContact CZ-OE2 2.84Å; R148-E150 IonicContact NE-OE2 2.87Å; R148-E150 PolarHBondContact NE-OE2 3.38Å; R148-E150 IonicContact NH2-OE2 2.82Å; R148-E150 PolarHBondContact NH2-OE2 3.02Å; R148-E183 IonicContact CZ-OE2 3.87Å; R148-E183 IonicContact NH1-OE2 3.93Å; R148-E183 PolarHBondContact NH1-OE2 3.38Å; R148-E183 VanDerWaalsContact NH1-OE2 3.1Å; R148-E183 IonicContact NH2-OE1 3.24Å; R148-E183 IonicContact NH2-OE2 2.91Å; R148-E183 PolarHBondContact NH2-OE2 2.86Å; R148-Y187 HydrophobicContact CB-CE1 3.89Å; R148-Y187 VanDerWaalsContact CD-CZ 3.47Å; R148-Y187 VanDerWaalsContact CD-OH 3.22Å; R148-Y187 WeakPolarHBondContact CD-OH 3.08Å; R148-Y187 HydrophobicContact CG-CE1 4.42Å; R148-Y187 PolarHBondContact NH1-OH 2.84Å
149	L	97.8	Very high	96.9	Very high	67 Å²	67	56.7 Å²	56.7	35%	0.351	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	93.6	171.9	-170.6	68.8	0	0	0	107.4	F136 I137 L194 P197	F136-L149 HydrophobicContact CB-CD1 3.95Å; F136-L149 HydrophobicContact CB-CD2 4.16Å; F136-L149 HydrophobicContact CB-CG 3.96Å; F136-L149 HydrophobicContact CD1-CD2 3.86Å; F136-L149 HydrophobicContact CD1-CG 4.05Å; F136-L149 HydrophobicContact CG-CD2 4.44Å; I137-L149 WeakPolarHBondContact O-CA 3.09Å; L149-L194 HydrophobicContact CD1-CD2 4.48Å; L149-P197 HydrophobicContact CD1-CB 4.16Å; L149-P197 HydrophobicContact CD1-CG 4.1Å
150	E	98.2	Very high	96.9	Very high	16 Å²	16	56.8 Å²	56.8	8%	0.075	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	137.1	-176	-174.5	52.5	-110	0	0	110.8	F136 I137 M139 R148 H152 F153	F136-E150 CarbonylContact C-O 3.5Å; F136-E150 VanDerWaalsContact CA-O 3.31Å; F136-E150 WeakPolarHBondContact CA-O 3.48Å; I137-E150 PolarHBondContact N-O 3.16Å; I137-E150 PolarHBondContact O-N 3.08Å; M139-E150 HydrophobicContact CE-CB 3.53Å; M139-E150 HydrophobicContact CE-CG 4.3Å; R148-E150 IonicContact CZ-OE2 2.84Å; R148-E150 IonicContact NE-OE2 2.87Å; R148-E150 PolarHBondContact NE-OE2 3.38Å; R148-E150 IonicContact NH2-OE2 2.82Å; R148-E150 PolarHBondContact NH2-OE2 3.02Å; E150-H152 WeakPolarHBondContact OE1-CA 3.17Å; E150-H152 PolarHBondContact OE1-N 3.35Å; E150-H152 VanDerWaalsContact OE1-O 3.13Å; E150-F153 HydrophobicContact CG-CD1 4.4Å; E150-F153 HydrophobicContact CG-CE1 3.76Å; E150-F153 HydrophobicContact CG-CZ 4.21Å
151	S	98.3	Very high	96.9	Very high	26 Å²	26	60.5 Å²	60.5	18%	0.182	30%	0.304	C	S	.	.			trans	-139.7	-1.4	178.3	59.3	0	0	0	0	114.1	T132 N133 L135	T132-S151 WeakPolarHBondContact CA-O 3.29Å; N133-S151 PolarHBondContact N-O 3.49Å; L135-S151 VanDerWaalsContact O-CA 3.25Å; L135-S151 WeakPolarHBondContact O-CA 3.46Å; L135-S151 WeakPolarHBondContact O-CB 3.35Å
152	H	98.1	Very high	97	Very high	81 Å²	81	59.7 Å²	59.7	38%	0.375	30%	0.3	S	S	.	.			trans	-115.6	122.7	-178.9	-170.6	63.1	0	0	0	110.8	T132 E150 E154 K158	T132-H152 WeakPolarHBondContact CG2-ND1 3.49Å; E150-H152 WeakPolarHBondContact OE1-CA 3.17Å; E150-H152 PolarHBondContact OE1-N 3.35Å; E150-H152 VanDerWaalsContact OE1-O 3.13Å; H152-E154 IonicContact CD2-OE1 3.05Å; H152-E154 PolarHBondContact CD2-OE1 3.22Å; H152-E154 IonicContact NE2-OE1 3.87Å; H152-E154 PolarHBondContact NE2-OE1 3.5Å; H152-K158 WeakPolarHBondContact O-CE 3.4Å; H152-K158 PolarHBondContact O-NZ 2.91Å
153	F	98	Very high	97.2	Very high	3 Å²	3	54.8 Å²	54.8	1%	0.013	28%	0.281	C	S	.	.			trans	-130.6	96.1	-175	-46.6	-80	0	0	0	110.4	H128 V131 T132 L135 I137 E150 T155 L159 C162	H128-F153 HydrophobicContact CB-CB 4.02Å; V131-F153 HydrophobicContact CG2-CD2 3.71Å; V131-F153 HydrophobicContact CG2-CE2 4Å; T132-F153 PolarHBondContact OG1-N 2.75Å; T132-F153 PolarHBondContact OG1-O 3.07Å; L135-F153 HydrophobicContact CB-CE2 4.32Å; I137-F153 HydrophobicContact CD1-CE1 3.78Å; I137-F153 HydrophobicContact CD1-CZ 3.63Å; I137-F153 HydrophobicContact CG1-CZ 4Å; E150-F153 HydrophobicContact CG-CD1 4.4Å; E150-F153 HydrophobicContact CG-CE1 3.76Å; E150-F153 HydrophobicContact CG-CZ 4.21Å; F153-T155 PolarHBondContact O-N 3.41Å; F153-L159 HydrophobicContact CB-CB 4.16Å; F153-L159 HydrophobicContact CD1-CB 4Å; F153-L159 HydrophobicContact CD1-CD1 3.98Å; F153-L159 HydrophobicContact CD2-CD1 4.27Å; F153-L159 HydrophobicContact CE1-CD1 3.95Å; F153-L159 HydrophobicContact CE2-CD1 4.25Å; F153-L159 HydrophobicContact CG-CB 4.12Å; F153-L159 HydrophobicContact CG-CD1 4.14Å; F153-L159 HydrophobicContact CZ-CD1 4.09Å; F153-C162 HydrophobicContact CE1-CB 3.91Å
154	E	96.8	Very high	97.4	Very high	100 Å²	100	50.2 Å²	50.2	47%	0.467	26%	0.257	S	S	.	.	S	Bend	trans	-69.5	-24.1	-179.4	-55.4	83.2	172	0	0	112.1	H152 K158	H152-E154 IonicContact CD2-OE1 3.05Å; H152-E154 PolarHBondContact CD2-OE1 3.22Å; H152-E154 IonicContact NE2-OE1 3.87Å; H152-E154 PolarHBondContact NE2-OE1 3.5Å; E154-K158 VanDerWaalsContact CD-NZ 3.3Å; E154-K158 IonicContact OE1-NZ 2.76Å; E154-K158 PolarHBondContact OE1-NZ 2.95Å; E154-K158 WeakPolarHBondContact OE2-CD 3.43Å; E154-K158 WeakPolarHBondContact OE2-CE 3.49Å; E154-K158 IonicContact OE2-NZ 3.84Å; E154-K158 PolarHBondContact OE2-NZ 2.63Å
155	T	97.8	Very high	97.5	Very high	69 Å²	69	46.6 Å²	46.6	42%	0.423	24%	0.235	S	C	.	.	S	Bend	trans	-137.9	155.7	179.8	63.9	0	0	0	0	111.2	H128 F153 E157 K158 L159	H128-T155 WeakPolarHBondContact CB-O 3.44Å; H128-T155 VanDerWaalsContact CG-C 3.44Å; F153-T155 PolarHBondContact O-N 3.41Å; T155-E157 PolarHBondContact O-N 3.5Å; T155-K158 PolarHBondContact O-N 2.98Å; T155-K158 PolarHBondContact OG1-N 3.42Å; T155-K158 VanDerWaalsContact OG1-N 3.08Å; T155-L159 PolarHBondContact O-N 3.2Å
156	R	97.8	Very high	97.7	Very high	64 Å²	64	41.1 Å²	41.1	24%	0.242	21%	0.206	C	C	.	.	H	α-helix	trans	-56.7	-37.9	170.1	-169.3	-176.5	-173	-105.3	3	112.1	S120 L123 P124 E125 H128 L159 L160	S120-R156 PolarHBondContact O-NH2 3.33Å; L123-R156 PolarHBondContact O-NH2 3.16Å; P124-R156 PolarHBondContact O-NE 2.82Å; E125-R156 VanDerWaalsContact O-CD 3.31Å; E125-R156 WeakPolarHBondContact O-CD 3.25Å; H128-R156 VanDerWaalsContact CG-N 3.26Å; H128-R156 PolarHBondContact ND1-N 3.16Å; R156-L159 WeakPolarHBondContact O-CB 3.19Å; R156-L159 PolarHBondContact O-N 2.94Å; R156-L160 HydrophobicContact CG-CD1 4.28Å; R156-L160 WeakPolarHBondContact O-CG 3.39Å; R156-L160 PolarHBondContact O-N 3.05Å
157	E	97.8	Very high	97.7	Very high	74 Å²	74	34.5 Å²	34.5	35%	0.346	18%	0.178	S	C	.	.	H	α-helix	trans	-63.2	-43.9	178.1	-178	56.6	-157	0	0	112.2	Y116 T155 L159 L160 K161	Y116-E157 PolarHBondContact OH-OE2 2.82Å; T155-E157 PolarHBondContact O-N 3.5Å; E157-L159 VanDerWaalsContact C-N 3.32Å; E157-L159 PolarHBondContact O-N 3.08Å; E157-L160 PolarHBondContact O-N 3.1Å; E157-K161 HydrophobicContact CG-CD 4.46Å; E157-K161 WeakPolarHBondContact O-CG 3.47Å; E157-K161 PolarHBondContact O-N 2.83Å; E157-K161 WeakPolarHBondContact OE1-CE 3.24Å
158	K	97.8	Very high	97.7	Very high	19 Å²	19	32.6 Å²	32.6	8%	0.083	16%	0.156	C	C	.	.	H	α-helix	trans	-60.5	-43.6	175.1	-177	178.9	172.1	176	0	111.3	H152 E154 T155 L160 K161 C162 E183	H152-K158 WeakPolarHBondContact O-CE 3.4Å; H152-K158 PolarHBondContact O-NZ 2.91Å; E154-K158 VanDerWaalsContact CD-NZ 3.3Å; E154-K158 IonicContact OE1-NZ 2.76Å; E154-K158 PolarHBondContact OE1-NZ 2.95Å; E154-K158 WeakPolarHBondContact OE2-CD 3.43Å; E154-K158 WeakPolarHBondContact OE2-CE 3.49Å; E154-K158 IonicContact OE2-NZ 3.84Å; E154-K158 PolarHBondContact OE2-NZ 2.63Å; T155-K158 PolarHBondContact O-N 2.98Å; T155-K158 PolarHBondContact OG1-N 3.42Å; T155-K158 VanDerWaalsContact OG1-N 3.08Å; K158-L160 PolarHBondContact O-N 2.9Å; K158-K161 PolarHBondContact O-N 2.92Å; K158-C162 WeakPolarHBondContact O-CB 3.12Å; K158-C162 PolarHBondContact O-N 3.21Å; K158-C162 PolarHBondContact O-SG 3.42Å; K158-E183 WeakPolarHBondContact CE-OE1 3.5Å; K158-E183 IonicContact NZ-OE1 2.71Å; K158-E183 PolarHBondContact NZ-OE1 2.87Å
159	L	98.6	Very high	97.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57	-50.4	175.4	172.6	62.4	0	0	0	111.5	L123 A127 H128 V131 L135 I137 F153 T155 R156 E157 K161 C162 L163	L123-L159 HydrophobicContact CD1-CD2 4.15Å; A127-L159 HydrophobicContact CB-CD2 3.88Å; H128-L159 HydrophobicContact CB-CB 4.31Å; H128-L159 HydrophobicContact CB-CD2 4.38Å; V131-L159 HydrophobicContact CG2-CD1 3.93Å; V131-L159 HydrophobicContact CG2-CD2 3.82Å; V131-L159 HydrophobicContact CG2-CG 4.49Å; L135-L159 HydrophobicContact CD2-CD1 3.9Å; I137-L159 HydrophobicContact CD1-CD1 3.96Å; F153-L159 HydrophobicContact CB-CB 4.16Å; F153-L159 HydrophobicContact CD1-CB 4Å; F153-L159 HydrophobicContact CD1-CD1 3.98Å; F153-L159 HydrophobicContact CD2-CD1 4.27Å; F153-L159 HydrophobicContact CE1-CD1 3.95Å; F153-L159 HydrophobicContact CE2-CD1 4.25Å; F153-L159 HydrophobicContact CG-CB 4.12Å; F153-L159 HydrophobicContact CG-CD1 4.14Å; F153-L159 HydrophobicContact CZ-CD1 4.09Å; T155-L159 PolarHBondContact O-N 3.2Å; R156-L159 WeakPolarHBondContact O-CB 3.19Å; R156-L159 PolarHBondContact O-N 2.94Å; E157-L159 VanDerWaalsContact C-N 3.32Å; E157-L159 PolarHBondContact O-N 3.08Å; L159-K161 PolarHBondContact O-N 3.17Å; L159-C162 PolarHBondContact O-N 3Å; L159-L163 HydrophobicContact CD1-CD1 4.04Å; L159-L163 HydrophobicContact CD1-CG 4.25Å; L159-L163 HydrophobicContact CG-CD1 4.06Å; L159-L163 WeakPolarHBondContact O-CG 3.35Å; L159-L163 PolarHBondContact O-N 2.92Å
160	L	98.4	Very high	96.9	Very high	1 Å²	1	30 Å²	30	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-46.3	178.8	-70.7	167	0	0	0	111.5	Y116 M119 S120 L123 R156 E157 K158 C162 L163 V164	Y116-L160 HydrophobicContact CD2-CB 4.11Å; Y116-L160 HydrophobicContact CE2-CB 3.89Å; Y116-L160 HydrophobicContact CE2-CD1 4.08Å; M119-L160 HydrophobicContact CB-CD2 3.84Å; S120-L160 VanDerWaalsContact OG-CD1 3.3Å; S120-L160 WeakPolarHBondContact OG-CD1 3.33Å; L123-L160 HydrophobicContact CD1-CD2 4.08Å; R156-L160 HydrophobicContact CG-CD1 4.28Å; R156-L160 WeakPolarHBondContact O-CG 3.39Å; R156-L160 PolarHBondContact O-N 3.05Å; E157-L160 PolarHBondContact O-N 3.1Å; K158-L160 PolarHBondContact O-N 2.9Å; L160-C162 VanDerWaalsContact C-N 3.33Å; L160-C162 PolarHBondContact O-N 2.84Å; L160-L163 PolarHBondContact O-N 2.67Å; L160-V164 VanDerWaalsContact O-CG2 3.32Å; L160-V164 WeakPolarHBondContact O-CG2 3.31Å; L160-V164 PolarHBondContact O-N 3.36Å
161	K	97.8	Very high	96.1	Very high	79 Å²	79	36.6 Å²	36.6	34%	0.343	18%	0.178	S	C	.	.	H	α-helix	trans	-59.5	-41.4	175.3	-74.2	-176	175.9	-173.6	0	112.7	E157 K158 L159 V164 A165 I182	E157-K161 HydrophobicContact CG-CD 4.46Å; E157-K161 WeakPolarHBondContact O-CG 3.47Å; E157-K161 PolarHBondContact O-N 2.83Å; E157-K161 WeakPolarHBondContact OE1-CE 3.24Å; K158-K161 PolarHBondContact O-N 2.92Å; L159-K161 PolarHBondContact O-N 3.17Å; K161-V164 PolarHBondContact O-N 2.83Å; K161-A165 WeakPolarHBondContact O-CB 3.2Å; K161-A165 PolarHBondContact O-N 3.08Å; K161-I182 HydrophobicContact CB-CD1 4.29Å; K161-I182 HydrophobicContact CB-CG1 4.02Å
162	C	98.5	Very high	95.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.8	-42.1	175.8	-70.9	0	0	0	0	112.1	I137 M139 F153 K158 L159 L160 A165 S166 I182	I137-C162 HydrophobicContact CD1-CB 3.8Å; I137-C162 HydrophobicContact CG2-CB 4.45Å; M139-C162 HydrophobicContact CE-CB 4.41Å; M139-C162 HydrophobicContact SD-CB 3.99Å; F153-C162 HydrophobicContact CE1-CB 3.91Å; K158-C162 WeakPolarHBondContact O-CB 3.12Å; K158-C162 PolarHBondContact O-N 3.21Å; K158-C162 PolarHBondContact O-SG 3.42Å; L159-C162 PolarHBondContact O-N 3Å; L160-C162 VanDerWaalsContact C-N 3.33Å; L160-C162 PolarHBondContact O-N 2.84Å; C162-A165 PolarHBondContact O-N 3.04Å; C162-S166 VanDerWaalsContact O-CB 3.3Å; C162-S166 WeakPolarHBondContact O-CB 3.34Å; C162-S166 PolarHBondContact O-N 2.71Å; C162-I182 HydrophobicContact CB-CD1 4.44Å
163	L	98.4	Very high	94.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-46.6	177	-70.1	166.4	0	0	0	111.4	A70 L71 A74 M119 L123 I137 L159 L160 S166 S167	A70-L163 HydrophobicContact CB-CD2 4.29Å; L71-L163 HydrophobicContact CD2-CB 3.76Å; L71-L163 HydrophobicContact CD2-CD2 3.88Å; L71-L163 HydrophobicContact CD2-CG 4.32Å; A74-L163 HydrophobicContact CB-CD1 4.37Å; A74-L163 HydrophobicContact CB-CD2 4.04Å; M119-L163 HydrophobicContact CE-CD1 3.94Å; L123-L163 HydrophobicContact CD1-CD1 3.69Å; I137-L163 HydrophobicContact CD1-CD2 3.65Å; I137-L163 HydrophobicContact CD1-CG 3.87Å; I137-L163 HydrophobicContact CG1-CD2 4.41Å; L159-L163 HydrophobicContact CD1-CD1 4.04Å; L159-L163 HydrophobicContact CD1-CG 4.25Å; L159-L163 HydrophobicContact CG-CD1 4.06Å; L159-L163 WeakPolarHBondContact O-CG 3.35Å; L159-L163 PolarHBondContact O-N 2.92Å; L160-L163 PolarHBondContact O-N 2.67Å; L163-S166 PolarHBondContact O-N 3.32Å; L163-S167 PolarHBondContact O-N 3.44Å; L163-S167 VanDerWaalsContact O-N 3.12Å; L163-S167 PolarHBondContact O-OG 3.09Å
164	V	97.4	Very high	92.9	Very high	8 Å²	8	34.4 Å²	34.4	5%	0.048	17%	0.166	C	C	.	.	H	α-helix	trans	-61.7	-45.8	176.1	176.7	0	0	0	0	110.8	V115 Y116 L160 K161 S166 S167 Y168 P180	V115-V164 HydrophobicContact CG1-CG2 4.18Å; Y116-V164 HydrophobicContact CD2-CG2 4.13Å; Y116-V164 HydrophobicContact CG-CG2 4.44Å; L160-V164 VanDerWaalsContact O-CG2 3.32Å; L160-V164 WeakPolarHBondContact O-CG2 3.31Å; L160-V164 PolarHBondContact O-N 3.36Å; K161-V164 PolarHBondContact O-N 2.83Å; V164-S166 VanDerWaalsContact C-N 3.33Å; V164-S166 PolarHBondContact O-N 2.86Å; V164-S167 CarbonylContact O-C 3.58Å; V164-S167 PolarHBondContact O-N 2.92Å; V164-S167 VanDerWaalsContact O-N 3.09Å; V164-Y168 PolarHBondContact O-N 3.25Å; V164-P180 HydrophobicContact CB-CG 4.1Å; V164-P180 HydrophobicContact CG1-CG 3.63Å
165	A	97.5	Very high	91.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.1	-42.4	177.6	0	0	0	0	0	111.9	M139 K161 C162 S167 Y168 P180 I182 I188 D189	M139-A165 HydrophobicContact CG-CB 4.4Å; M139-A165 HydrophobicContact SD-CB 3.76Å; K161-A165 WeakPolarHBondContact O-CB 3.2Å; K161-A165 PolarHBondContact O-N 3.08Å; C162-A165 PolarHBondContact O-N 3.04Å; A165-S167 PolarHBondContact O-N 2.9Å; A165-Y168 WeakPolarHBondContact O-CB 3.34Å; A165-Y168 PolarHBondContact O-N 3.46Å; A165-Y168 VanDerWaalsContact O-N 3.09Å; A165-P180 HydrophobicContact CB-CB 4.18Å; A165-P180 HydrophobicContact CB-CG 4.07Å; A165-I182 HydrophobicContact CB-CD1 4.02Å; A165-I188 CarbonylContact O-C 3.56Å; A165-D189 PolarHBondContact O-N 3.43Å
166	S	98	Very high	90.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.8	-26.9	175.8	-163.9	0	0	0	0	112.9	S67 I137 S138 C162 L163 V164 D189 G190	S67-S166 WeakPolarHBondContact CA-O 3.38Å; S67-S166 WeakPolarHBondContact CB-O 3.41Å; S67-S166 PolarHBondContact N-O 3.01Å; S67-S166 VanDerWaalsContact N-O 3.12Å; S67-S166 PolarHBondContact N-OG 2.87Å; I137-S166 VanDerWaalsContact CG2-CB 3.43Å; S138-S166 WeakPolarHBondContact O-CB 3.34Å; S138-S166 PolarHBondContact O-OG 3.36Å; C162-S166 VanDerWaalsContact O-CB 3.3Å; C162-S166 WeakPolarHBondContact O-CB 3.34Å; C162-S166 PolarHBondContact O-N 2.71Å; L163-S166 PolarHBondContact O-N 3.32Å; V164-S166 VanDerWaalsContact C-N 3.33Å; V164-S166 PolarHBondContact O-N 2.86Å; S166-D189 VanDerWaalsContact O-CA 3.26Å; S166-D189 WeakPolarHBondContact O-CA 3.29Å; S166-G190 PolarHBondContact O-N 3.05Å
167	S	96.3	Very high	89.7	Confident	8 Å²	8	35.2 Å²	35.2	6%	0.056	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	5.1	176.1	-67.7	0	0	0	0	114.1	L163 V164 A165 I169 S173	L163-S167 PolarHBondContact O-N 3.44Å; L163-S167 VanDerWaalsContact O-N 3.12Å; L163-S167 PolarHBondContact O-OG 3.09Å; V164-S167 CarbonylContact O-C 3.58Å; V164-S167 PolarHBondContact O-N 2.92Å; V164-S167 VanDerWaalsContact O-N 3.09Å; A165-S167 PolarHBondContact O-N 2.9Å; S167-I169 PolarHBondContact O-N 3.25Å; S167-S173 PolarHBondContact O-OG 3.47Å
168	Y	95.3	Very high	89.3	Confident	10 Å²	10	37.3 Å²	37.3	4%	0.039	18%	0.182	C	C	.	.			trans	-83.7	93.3	-178.5	-170.4	-79.4	0	0	0	110.3	S112 V164 A165 P170 S173 E177 P179 I188 D189	S112-Y168 VanDerWaalsContact OG-CD2 3.26Å; S112-Y168 WeakPolarHBondContact OG-CD2 3.15Å; S112-Y168 WeakPolarHBondContact OG-CE2 3.44Å; V164-Y168 PolarHBondContact O-N 3.25Å; A165-Y168 WeakPolarHBondContact O-CB 3.34Å; A165-Y168 PolarHBondContact O-N 3.46Å; A165-Y168 VanDerWaalsContact O-N 3.09Å; Y168-P170 WeakPolarHBondContact O-CD 3.27Å; Y168-S173 WeakPolarHBondContact CA-OG 3.22Å; Y168-E177 HydrophobicContact CE2-CB 4.26Å; Y168-E177 PolarHBondContact OH-O 2.98Å; Y168-P179 HydrophobicContact CD1-CB 3.84Å; Y168-P179 HydrophobicContact CD1-CG 4.11Å; Y168-P179 HydrophobicContact CD2-CB 4.31Å; Y168-P179 HydrophobicContact CE1-CB 3.87Å; Y168-P179 HydrophobicContact CE1-CG 3.72Å; Y168-P179 HydrophobicContact CE2-CB 4.33Å; Y168-P179 HydrophobicContact CG-CB 4.07Å; Y168-I188 HydrophobicContact CD1-CB 4.22Å; Y168-I188 HydrophobicContact CD1-CG2 3.7Å; Y168-I188 HydrophobicContact CE1-CG2 4.21Å; Y168-D189 WeakPolarHBondContact O-CB 3.3Å; Y168-D189 PolarHBondContact O-N 3.41Å
169	I	91.8	Very high	89	Confident	30 Å²	30	36.8 Å²	36.8	15%	0.154	18%	0.181	C	C	.	.			trans	-84.3	117.7	177.1	-54.5	174.2	0	0	0	108	S167 F171 F172 S173 D189 L251	S167-I169 PolarHBondContact O-N 3.25Å; I169-F171 PolarHBondContact O-N 3.09Å; I169-F172 HydrophobicContact CB-CB 4.04Å; I169-F172 HydrophobicContact CG2-CB 3.98Å; I169-F172 HydrophobicContact CG2-CD2 3.7Å; I169-F172 HydrophobicContact CG2-CG 4.24Å; I169-F172 PolarHBondContact O-N 2.94Å; I169-F172 VanDerWaalsContact O-N 3.08Å; I169-S173 PolarHBondContact N-OG 3.12Å; I169-S173 PolarHBondContact O-N 3.12Å; I169-S173 PolarHBondContact O-OG 3.04Å; I169-D189 HydrophobicContact CG1-CB 4.22Å; I169-D189 VanDerWaalsContact CG1-OD2 3.29Å; I169-D189 WeakPolarHBondContact CG1-OD2 3.5Å; I169-L251 HydrophobicContact CD1-CD2 3.8Å; I169-L251 HydrophobicContact CG2-CD2 4.24Å
170	P	86	Confident	88.8	Confident	43 Å²	43	38 Å²	38	28%	0.279	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	137.7	178.3	-26.9	34.9	0	0	0	112	Y168 F172 I188 I192	Y168-P170 WeakPolarHBondContact O-CD 3.27Å; P170-F172 PolarHBondContact O-N 3.5Å; P170-I188 HydrophobicContact CG-CB 4.28Å; P170-I188 HydrophobicContact CG-CD1 3.78Å; P170-I188 HydrophobicContact CG-CG2 4.37Å; P170-I192 HydrophobicContact CG-CD1 4.29Å
171	F	82.7	Confident	88.6	Confident	154 Å²	154	42.9 Å²	42.9	68%	0.675	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	69.8	-32.4	-173.9	-50.8	-80.5	0	0	0	116.2	L105 I169	L105-F171 WeakPolarHBondContact CD2-O 3.37Å; I169-F171 PolarHBondContact O-N 3.09Å
172	F	83.6	Confident	88.6	Confident	57 Å²	57	39.4 Å²	39.4	25%	0.25	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-20.7	-177.3	-69.6	-80.8	0	0	0	114	L104 L105 I169 P170 G174 L251	L104-F172 HydrophobicContact CB-CB 4.47Å; L104-F172 HydrophobicContact CB-CD1 4.05Å; L104-F172 HydrophobicContact CD1-CB 4.05Å; L104-F172 HydrophobicContact CD1-CD1 3.88Å; L104-F172 HydrophobicContact CD1-CG 4.38Å; L105-F172 HydrophobicContact CD2-CD1 4.32Å; I169-F172 HydrophobicContact CB-CB 4.04Å; I169-F172 HydrophobicContact CG2-CB 3.98Å; I169-F172 HydrophobicContact CG2-CD2 3.7Å; I169-F172 HydrophobicContact CG2-CG 4.24Å; I169-F172 PolarHBondContact O-N 2.94Å; I169-F172 VanDerWaalsContact O-N 3.08Å; P170-F172 PolarHBondContact O-N 3.5Å; F172-G174 VanDerWaalsContact C-N 3.31Å; F172-L251 HydrophobicContact CD2-CD2 4.4Å; F172-L251 HydrophobicContact CE1-CB 4.46Å; F172-L251 HydrophobicContact CE2-CD1 4.13Å; F172-L251 HydrophobicContact CZ-CD1 4.13Å
173	S	76.8	Confident	88.4	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-90.6	8.8	177.5	-64.3	0	0	0	0	114.3	S112 S167 Y168 I169 E177	S112-S173 PolarHBondContact OG-O 3.34Å; S167-S173 PolarHBondContact O-OG 3.47Å; Y168-S173 WeakPolarHBondContact CA-OG 3.22Å; I169-S173 PolarHBondContact N-OG 3.12Å; I169-S173 PolarHBondContact O-N 3.12Å; I169-S173 PolarHBondContact O-OG 3.04Å; S173-E177 VanDerWaalsContact O-OE2 3.1Å
174	G	66.9	Low	88.2	Confident	7 Å²	7	47.6 Å²	47.6	7%	0.072	25%	0.25	C	S	.	.			trans	127.3	116.1	-176.6	0	0	0	0	0	110.7	F172 H176 E177	F172-G174 VanDerWaalsContact C-N 3.31Å; G174-H176 PolarHBondContact O-N 2.92Å; G174-E177 PolarHBondContact O-N 3.33Å
175	I	67.5	Low	88.1	Confident	81 Å²	81	49.2 Å²	49.2	42%	0.415	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.2	-177.8	-63.7	173.5	0	0	0	111.8	L105	L105-I175 HydrophobicContact CB-CD1 4.15Å; L105-I175 HydrophobicContact CD2-CD1 4.27Å; L105-I175 HydrophobicContact CD2-CG1 4.43Å; L105-I175 WeakPolarHBondContact O-CD1 3.47Å
176	H	72.8	Confident	88.1	Confident	119 Å²	119	53.5 Å²	53.5	55%	0.551	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	1.8	-174.3	-58.8	-60.2	0	0	0	113.4	R107 G174	R107-H176 WeakPolarHBondContact CD-NE2 3.32Å; R107-H176 PolarHBondContact NE-NE2 3.42Å; G174-H176 PolarHBondContact O-N 2.92Å
177	E	83.7	Confident	88	Confident	50 Å²	50	54 Å²	54	23%	0.234	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-87.6	148	-178.3	-70.2	-178.3	-164	0	0	111.2	S110 S112 Y168 S173 G174	S110-E177 WeakPolarHBondContact CB-OE1 3.2Å; S110-E177 PolarHBondContact OG-OE1 3.17Å; S110-E177 PolarHBondContact OG-OE2 3.35Å; S112-E177 WeakPolarHBondContact CB-OE2 3.37Å; S112-E177 PolarHBondContact OG-OE2 3.45Å; Y168-E177 HydrophobicContact CE2-CB 4.26Å; Y168-E177 PolarHBondContact OH-O 2.98Å; S173-E177 VanDerWaalsContact O-OE2 3.1Å; G174-E177 PolarHBondContact O-N 3.33Å
178	N	89.1	Confident	88	Confident	117 Å²	117	54.1 Å²	54.1	63%	0.626	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-91.2	137.3	165.6	-70.4	-56.9	0	0	0	107.9
179	P	92.2	Very high	88.1	Confident	9 Å²	9	54.2 Å²	54.2	6%	0.058	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-58.7	154.3	172.8	-5.2	9.7	0	0	0	111.5	Y168 E181 R186 Y187 I188	Y168-P179 HydrophobicContact CD1-CB 3.84Å; Y168-P179 HydrophobicContact CD1-CG 4.11Å; Y168-P179 HydrophobicContact CD2-CB 4.31Å; Y168-P179 HydrophobicContact CE1-CB 3.87Å; Y168-P179 HydrophobicContact CE1-CG 3.72Å; Y168-P179 HydrophobicContact CE2-CB 4.33Å; Y168-P179 HydrophobicContact CG-CB 4.07Å; P179-E181 PolarHBondContact O-N 3.07Å; P179-R186 HydrophobicContact CG-CB 4.49Å; P179-Y187 WeakPolarHBondContact CB-O 3.45Å; P179-I188 HydrophobicContact CB-CG2 3.8Å; P179-I188 HydrophobicContact CG-CG2 3.65Å
180	P	93.5	Very high	88.3	Confident	24 Å²	24	52.8 Å²	52.8	16%	0.156	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-55.2	137.7	178.8	-24.6	33.6	0	0	0	112.4	V164 A165 R186 Y187	V164-P180 HydrophobicContact CB-CG 4.1Å; V164-P180 HydrophobicContact CG1-CG 3.63Å; A165-P180 HydrophobicContact CB-CB 4.18Å; A165-P180 HydrophobicContact CB-CG 4.07Å; P180-R186 WeakPolarHBondContact O-CA 3.08Å; P180-Y187 PolarHBondContact O-N 3.41Å; P180-Y187 VanDerWaalsContact O-N 3.11Å
181	E	95.9	Very high	88.6	Confident	104 Å²	104	51.1 Å²	51.1	49%	0.486	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.1	173.5	-167.8	177.9	129.6	0	0	110.2	P179 C185	P179-E181 PolarHBondContact O-N 3.07Å; E181-C185 WeakPolarHBondContact CA-O 3.45Å
182	I	96.4	Very high	89.1	Confident	7 Å²	7	47.8 Å²	47.8	4%	0.036	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	115.7	179.8	-56.8	162.8	0	0	0	106.4	M139 K161 C162 A165 G184 C185 Y187	M139-I182 HydrophobicContact CE-CD1 4.31Å; M139-I182 HydrophobicContact SD-CD1 3.8Å; K161-I182 HydrophobicContact CB-CD1 4.29Å; K161-I182 HydrophobicContact CB-CG1 4.02Å; C162-I182 HydrophobicContact CB-CD1 4.44Å; A165-I182 HydrophobicContact CB-CD1 4.02Å; I182-G184 PolarHBondContact O-N 3.49Å; I182-C185 PolarHBondContact N-O 3.26Å; I182-C185 PolarHBondContact O-N 2.98Å; I182-Y187 HydrophobicContact CB-CD2 3.86Å; I182-Y187 HydrophobicContact CB-CE2 3.95Å; I182-Y187 HydrophobicContact CD1-CD2 3.89Å; I182-Y187 HydrophobicContact CG1-CD2 4.23Å
183	E	94.1	Very high	89.6	Confident	115 Å²	115	46.1 Å²	46.1	54%	0.537	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	37.7	178.1	-59.4	167	176.4	0	0	113.5	R148 K158 C185	R148-E183 IonicContact CZ-OE2 3.87Å; R148-E183 IonicContact NH1-OE2 3.93Å; R148-E183 PolarHBondContact NH1-OE2 3.38Å; R148-E183 VanDerWaalsContact NH1-OE2 3.1Å; R148-E183 IonicContact NH2-OE1 3.24Å; R148-E183 IonicContact NH2-OE2 2.91Å; R148-E183 PolarHBondContact NH2-OE2 2.86Å; K158-E183 WeakPolarHBondContact CE-OE1 3.5Å; K158-E183 IonicContact NZ-OE1 2.71Å; K158-E183 PolarHBondContact NZ-OE1 2.87Å; E183-C185 VanDerWaalsContact C-N 3.29Å; E183-C185 PolarHBondContact O-N 2.97Å
184	G	94.8	Very high	90.5	Very high	56 Å²	56	48.2 Å²	48.2	58%	0.577	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-1	179.8	0	0	0	0	0	115.1	I182	I182-G184 PolarHBondContact O-N 3.49Å
185	C	95.6	Very high	91.9	Very high	43 Å²	43	48.2 Å²	48.2	29%	0.291	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.8	176.9	-67.5	0	0	0	0	110.9	E181 I182 E183 Y187	E181-C185 WeakPolarHBondContact CA-O 3.45Å; I182-C185 PolarHBondContact N-O 3.26Å; I182-C185 PolarHBondContact O-N 2.98Å; E183-C185 VanDerWaalsContact C-N 3.29Å; E183-C185 PolarHBondContact O-N 2.97Å; C185-Y187 HydrophobicContact CB-CD2 4.28Å; C185-Y187 HydrophobicContact CB-CE2 3.48Å; C185-Y187 VanDerWaalsContact CB-CE2 3.48Å; C185-Y187 WeakPolarHBondContact O-CD2 3.43Å
186	R	96.4	Very high	93.3	Very high	89 Å²	89	44.9 Å²	44.9	34%	0.336	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	128.8	175	-65.1	179.6	-169.7	137.7	-0.3	110.1	R142 P179 P180	R142-R186 HydrophobicContact CB-CB 4.27Å; R142-R186 WeakPolarHBondContact CB-O 3.26Å; R142-R186 PolarHBondContact N-O 2.81Å; P179-R186 HydrophobicContact CG-CB 4.49Å; P180-R186 WeakPolarHBondContact O-CA 3.08Å
187	Y	97.2	Very high	94.5	Very high	11 Å²	11	39.3 Å²	39.3	4%	0.043	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	142.5	-176.2	-70.4	-79.2	0	0	0	112.3	M139 T140 D141 R148 P179 P180 I182 C185	M139-Y187 HydrophobicContact CB-CD1 3.87Å; M139-Y187 HydrophobicContact CB-CG 4.26Å; M139-Y187 HydrophobicContact SD-CG 4.26Å; T140-Y187 CarbonylContact O-C 3.35Å; T140-Y187 WeakPolarHBondContact O-CA 3.42Å; D141-Y187 HydrophobicContact CB-CD1 4.22Å; D141-Y187 HydrophobicContact CB-CE1 3.79Å; R148-Y187 HydrophobicContact CB-CE1 3.89Å; R148-Y187 VanDerWaalsContact CD-CZ 3.47Å; R148-Y187 VanDerWaalsContact CD-OH 3.22Å; R148-Y187 WeakPolarHBondContact CD-OH 3.08Å; R148-Y187 HydrophobicContact CG-CE1 4.42Å; R148-Y187 PolarHBondContact NH1-OH 2.84Å; P179-Y187 WeakPolarHBondContact CB-O 3.45Å; P180-Y187 PolarHBondContact O-N 3.41Å; P180-Y187 VanDerWaalsContact O-N 3.11Å; I182-Y187 HydrophobicContact CB-CD2 3.86Å; I182-Y187 HydrophobicContact CB-CE2 3.95Å; I182-Y187 HydrophobicContact CD1-CD2 3.89Å; I182-Y187 HydrophobicContact CG1-CD2 4.23Å; C185-Y187 HydrophobicContact CB-CD2 4.28Å; C185-Y187 HydrophobicContact CB-CE2 3.48Å; C185-Y187 VanDerWaalsContact CB-CE2 3.48Å; C185-Y187 WeakPolarHBondContact O-CD2 3.43Å
188	I	96.6	Very high	95	Very high	10 Å²	10	40.1 Å²	40.1	5%	0.051	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	179.2	176.4	63.5	178.4	0	0	0	110.2	T140 R142 A165 Y168 P170 P179 G190 I192	T140-I188 HydrophobicContact CG2-CD1 4.44Å; T140-I188 HydrophobicContact CG2-CG1 4.2Å; T140-I188 PolarHBondContact N-O 3.29Å; T140-I188 WeakPolarHBondContact O-CG1 3.44Å; T140-I188 PolarHBondContact O-N 2.7Å; R142-I188 HydrophobicContact CB-CG2 4.18Å; R142-I188 HydrophobicContact CG-CG2 4.47Å; A165-I188 CarbonylContact O-C 3.56Å; Y168-I188 HydrophobicContact CD1-CB 4.22Å; Y168-I188 HydrophobicContact CD1-CG2 3.7Å; Y168-I188 HydrophobicContact CE1-CG2 4.21Å; P170-I188 HydrophobicContact CG-CB 4.28Å; P170-I188 HydrophobicContact CG-CD1 3.78Å; P170-I188 HydrophobicContact CG-CG2 4.37Å; P179-I188 HydrophobicContact CB-CG2 3.8Å; P179-I188 HydrophobicContact CG-CG2 3.65Å; I188-G190 PolarHBondContact O-N 3.44Å; I188-I192 HydrophobicContact CD1-CD1 3.6Å; I188-I192 HydrophobicContact CG1-CD1 4.03Å
189	D	96.8	Very high	95.3	Very high	12 Å²	12	35.4 Å²	35.4	6%	0.064	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-49.6	129.6	-171.1	-165.4	-51.3	0	0	0	112.8	S67 T140 A165 S166 Y168 I169 G191 I192	S67-D189 WeakPolarHBondContact CB-OD2 3.36Å; S67-D189 PolarHBondContact OG-OD2 3.44Å; T140-D189 WeakPolarHBondContact CB-O 3.36Å; T140-D189 PolarHBondContact OG1-O 3.29Å; A165-D189 PolarHBondContact O-N 3.43Å; S166-D189 VanDerWaalsContact O-CA 3.26Å; S166-D189 WeakPolarHBondContact O-CA 3.29Å; Y168-D189 WeakPolarHBondContact O-CB 3.3Å; Y168-D189 PolarHBondContact O-N 3.41Å; I169-D189 HydrophobicContact CG1-CB 4.22Å; I169-D189 VanDerWaalsContact CG1-OD2 3.29Å; I169-D189 WeakPolarHBondContact CG1-OD2 3.5Å; D189-G191 PolarHBondContact O-N 3.4Å; D189-G191 WeakPolarHBondContact OD1-CA 3.42Å; D189-G191 PolarHBondContact OD1-N 3.23Å; D189-I192 PolarHBondContact O-N 3.16Å
190	G	95.1	Very high	95.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-66.6	-22.2	179.8	0	0	0	0	0	113.9	S138 S166 I188 I192 C193 L194	S138-G190 VanDerWaalsContact O-CA 3.25Å; S138-G190 WeakPolarHBondContact O-CA 3.23Å; S138-G190 WeakPolarHBondContact OG-CA 3.48Å; S138-G190 PolarHBondContact OG-O 2.81Å; S166-G190 PolarHBondContact O-N 3.05Å; I188-G190 PolarHBondContact O-N 3.44Å; G190-I192 PolarHBondContact O-N 2.94Å; G190-I192 VanDerWaalsContact O-N 3.11Å; G190-C193 PolarHBondContact O-N 3.43Å; G190-C193 VanDerWaalsContact O-N 3.08Å; G190-L194 CarbonylContact O-C 3.08Å; G190-L194 VanDerWaalsContact O-C 3.26Å; G190-L194 PolarHBondContact O-N 2.96Å
191	G	93.5	Very high	95.3	Very high	9 Å²	9	49.3 Å²	49.3	9%	0.093	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-58.5	-20.3	176.7	0	0	0	0	0	114.3	D189 N195 G233	D189-G191 PolarHBondContact O-N 3.4Å; D189-G191 WeakPolarHBondContact OD1-CA 3.42Å; D189-G191 PolarHBondContact OD1-N 3.23Å; G191-N195 WeakPolarHBondContact CA-OD1 3.33Å; G191-G233 VanDerWaalsContact O-CA 3.25Å; G191-G233 WeakPolarHBondContact O-CA 3.35Å
192	I	92.6	Very high	95.2	Very high	84 Å²	84	45.2 Å²	45.2	43%	0.431	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-70.4	-43.4	175.4	-61.9	171.5	0	0	0	111	T140 P170 I188 D189 G190 G233	T140-I192 HydrophobicContact CG2-CB 4.43Å; T140-I192 HydrophobicContact CG2-CG2 4.29Å; P170-I192 HydrophobicContact CG-CD1 4.29Å; I188-I192 HydrophobicContact CD1-CD1 3.6Å; I188-I192 HydrophobicContact CG1-CD1 4.03Å; D189-I192 PolarHBondContact O-N 3.16Å; G190-I192 PolarHBondContact O-N 2.94Å; G190-I192 VanDerWaalsContact O-N 3.11Å; I192-G233 WeakPolarHBondContact O-CA 3.3Å
193	C	94	Very high	95.2	Very high	21 Å²	21	44.9 Å²	44.9	14%	0.142	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-37.7	-173	-87.3	0	0	0	0	114.3	T140 L145 G190 K234	T140-C193 HydrophobicContact CG2-CB 4.37Å; T140-C193 VanDerWaalsContact CG2-SG 3.51Å; T140-C193 WeakPolarHBondContact OG1-CB 3.47Å; L145-C193 PolarHBondContact O-SG 3.33Å; L145-C193 VanDerWaalsContact O-SG 3.35Å; G190-C193 PolarHBondContact O-N 3.43Å; G190-C193 VanDerWaalsContact O-N 3.08Å; C193-K234 WeakPolarHBondContact O-CD 3.38Å; C193-K234 WeakPolarHBondContact O-CE 3.29Å; C193-K234 WeakPolarHBondContact O-CG 3.41Å
194	L	95.9	Very high	95.3	Very high	44 Å²	44	39.5 Å²	39.5	23%	0.23	21%	0.206	C	C	.	.			trans	-151.8	88.5	-178.9	-178.6	64.9	0	0	0	109.3	S138 L149 G190 P197 G233 K234	S138-L194 WeakPolarHBondContact CB-O 3.12Å; S138-L194 PolarHBondContact OG-O 3.44Å; L149-L194 HydrophobicContact CD1-CD2 4.48Å; G190-L194 CarbonylContact O-C 3.08Å; G190-L194 VanDerWaalsContact O-C 3.26Å; G190-L194 PolarHBondContact O-N 2.96Å; L194-P197 HydrophobicContact CD2-CB 3.95Å; L194-P197 HydrophobicContact CD2-CG 4.06Å; L194-P197 HydrophobicContact CG-CB 4.29Å; L194-P197 HydrophobicContact CG-CG 4.08Å; L194-G233 CarbonylContact C-O 3.44Å; L194-G233 VanDerWaalsContact CA-O 3.23Å; L194-G233 WeakPolarHBondContact CA-O 3.32Å; L194-K234 HydrophobicContact CD1-CB 4.43Å; L194-K234 HydrophobicContact CD1-CD 4.23Å
195	N	97.2	Very high	95.5	Very high	8 Å²	8	36.8 Å²	36.8	4%	0.043	18%	0.178	C	C	.	.	S	Bend	trans	-73.1	-37	-174.7	-160.8	44.5	0	0	0	112.9	C33 G34 A66 G191 G233 Q235	C33-N195 CarbonylContact C-O 3.53Å; C33-N195 WeakPolarHBondContact CA-O 3.36Å; C33-N195 WeakPolarHBondContact CB-O 3.15Å; G34-N195 WeakPolarHBondContact CA-OD1 3.43Å; G34-N195 PolarHBondContact N-O 3.05Å; G34-N195 VanDerWaalsContact N-O 3.16Å; G34-N195 PolarHBondContact N-OD1 3.41Å; G34-N195 PolarHBondContact O-ND2 2.69Å; G34-N195 VanDerWaalsContact O-ND2 3.16Å; G34-N195 PolarHBondContact O-OD1 2.91Å; A66-N195 WeakPolarHBondContact CB-O 3.41Å; G191-N195 WeakPolarHBondContact CA-OD1 3.33Å; N195-G233 PolarHBondContact N-O 3.11Å; N195-Q235 HydrophobicContact CB-CB 4.24Å; N195-Q235 PolarHBondContact ND2-OE1 3.18Å
196	L	97	Very high	95.6	Very high	11 Å²	11	34.8 Å²	34.8	6%	0.058	16%	0.164	C	C	.	.	S	Bend	trans	-127.5	89.5	179.6	-179.2	63.6	0	0	0	109.2	C33 T206 Q235	C33-L196 HydrophobicContact CB-CB 3.92Å; C33-L196 HydrophobicContact CB-CD1 3.96Å; C33-L196 HydrophobicContact CB-CG 4.44Å; L196-T206 HydrophobicContact CD1-CG2 4.02Å; L196-T206 HydrophobicContact CD2-CG2 3.97Å; L196-T206 HydrophobicContact CG-CG2 4Å; L196-Q235 HydrophobicContact CB-CB 4.2Å; L196-Q235 HydrophobicContact CB-CG 4.02Å; L196-Q235 HydrophobicContact CD2-CG 4.05Å
197	P	96.6	Very high	95.7	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.006	15%	0.148	C	C	.	.			trans	-61.7	136.7	179.5	-23.1	33.4	0	0	0	112.4	S31 A64 L149 L194	S31-P197 WeakPolarHBondContact CB-O 3.26Å; S31-P197 WeakPolarHBondContact OG-CD 3.33Å; S31-P197 PolarHBondContact OG-O 2.84Å; A64-P197 HydrophobicContact CB-CB 3.89Å; A64-P197 HydrophobicContact CB-CG 4.28Å; L149-P197 HydrophobicContact CD1-CB 4.16Å; L149-P197 HydrophobicContact CD1-CG 4.1Å; L194-P197 HydrophobicContact CD2-CB 3.95Å; L194-P197 HydrophobicContact CD2-CG 4.06Å; L194-P197 HydrophobicContact CG-CB 4.29Å; L194-P197 HydrophobicContact CG-CG 4.08Å
198	V	95.4	Very high	95.7	Very high	68 Å²	68	30 Å²	30	41%	0.412	15%	0.146	S	C	.	.			trans	-133.7	137.3	176.9	175.7	0	0	0	0	109.5	T206	V198-T206 HydrophobicContact CG2-CG2 3.7Å
199	F	94.7	Very high	95.7	Very high	18 Å²	18	29.5 Å²	29.5	8%	0.079	14%	0.144	C	C	.	.			trans	-91.6	140.8	178.8	-57.9	-80.7	0	0	0	111	A29 R62 A64 F136 L202 T204	A29-F199 HydrophobicContact CB-CD2 3.44Å; A29-F199 VanDerWaalsContact CB-CD2 3.44Å; A29-F199 HydrophobicContact CB-CE2 3.83Å; A29-F199 HydrophobicContact CB-CG 4.44Å; R62-F199 HydrophobicContact CB-CD2 4.25Å; R62-F199 HydrophobicContact CB-CE1 4.43Å; R62-F199 HydrophobicContact CB-CE2 3.69Å; R62-F199 HydrophobicContact CB-CZ 3.79Å; R62-F199 HydrophobicContact CG-CZ 4.42Å; A64-F199 HydrophobicContact CB-CE2 3.88Å; A64-F199 HydrophobicContact CB-CZ 3.91Å; F136-F199 HydrophobicContact CB-CE1 4.38Å; F136-F199 HydrophobicContact CB-CZ 3.87Å; F136-F199 AromaticContact CD1-CE1 3.69Å; F136-F199 HydrophobicContact CD1-CE1 3.69Å; F136-F199 HydrophobicContact CD1-CZ 4Å; F136-F199 AromaticContact CD2-CE1 3.9Å; F136-F199 HydrophobicContact CD2-CE1 3.9Å; F136-F199 AromaticContact CD2-CZ 3.51Å; F136-F199 HydrophobicContact CD2-CZ 3.51Å; F136-F199 AromaticContact CE1-CE1 3.87Å; F136-F199 HydrophobicContact CE1-CE1 3.87Å; F136-F199 HydrophobicContact CE1-CZ 4.45Å; F136-F199 HydrophobicContact CE2-CE1 4.1Å; F136-F199 HydrophobicContact CE2-CZ 4.05Å; F136-F199 AromaticContact CG-CE1 3.71Å; F136-F199 HydrophobicContact CG-CE1 3.71Å; F136-F199 AromaticContact CG-CZ 3.51Å; F136-F199 HydrophobicContact CG-CZ 3.51Å; F136-F199 HydrophobicContact CZ-CE1 4.07Å; F136-F199 HydrophobicContact CZ-CZ 4.49Å; F199-L202 HydrophobicContact CB-CB 4.31Å; F199-T204 HydrophobicContact CD2-CG2 4.25Å; F199-T204 PolarHBondContact N-OG1 2.61Å; F199-T204 VanDerWaalsContact N-OG1 3.1Å
200	R	91.8	Very high	95.7	Very high	236 Å²	236	29.6 Å²	29.6	89%	0.891	14%	0.144	S	C	*	.	S	Bend	trans	-82.6	-19.6	-177.7	-68.1	-176	179.4	175.7	0.1	113.5	L16	L16-R200 VanDerWaalsContact CD1-O 3.22Å; L16-R200 WeakPolarHBondContact CD1-O 3.4Å
201	D	93.4	Very high	95.6	Very high	88 Å²	88	31 Å²	31	47%	0.471	15%	0.15	S	C	.	.	S	Bend	trans	-106.2	-9.2	-173.3	59.3	-45.3	0	0	0	113.1	R62	R62-D201 IonicContact CZ-OD1 3.87Å; R62-D201 IonicContact CZ-OD2 2.65Å; R62-D201 IonicContact NH1-OD1 3.2Å; R62-D201 PolarHBondContact NH1-OD1 3.18Å; R62-D201 IonicContact NH1-OD2 3.74Å; R62-D201 PolarHBondContact NH1-OD2 2.87Å; R62-D201 IonicContact NH2-OD2 3.01Å; R62-D201 PolarHBondContact NH2-OD2 2.94Å
202	L	94.5	Very high	95.4	Very high	18 Å²	18	30.7 Å²	30.7	9%	0.094	15%	0.147	C	C	.	.	S	Bend	trans	-130.7	142	177.6	-66.7	174.9	0	0	0	110.5	D27 A29 K61 R62 F199 T204	D27-L202 HydrophobicContact CB-CD2 3.69Å; A29-L202 HydrophobicContact CB-CB 4.16Å; A29-L202 HydrophobicContact CB-CD1 4.26Å; K61-L202 HydrophobicContact CB-CD1 4.37Å; R62-L202 HydrophobicContact CB-CD1 4.45Å; R62-L202 HydrophobicContact CG-CD1 3.92Å; F199-L202 HydrophobicContact CB-CB 4.31Å; L202-T204 PolarHBondContact O-N 2.9Å; L202-T204 PolarHBondContact O-OG1 2.82Å
203	R	95.6	Very high	94.9	Very high	1 Å²	1	29.5 Å²	29.5	0%	0.004	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	111.3	169	175.3	50.5	175.1	113.2	5.2	108.7	L16 K17 G19 S20 I22 L28 A29 D216	L16-R203 HydrophobicContact CD2-CB 4.42Å; K17-R203 PolarHBondContact O-NE 2.84Å; K17-R203 VanDerWaalsContact O-NE 3.16Å; G19-R203 VanDerWaalsContact N-NH2 3.15Å; S20-R203 PolarHBondContact O-NE 2.87Å; S20-R203 VanDerWaalsContact O-NE 3.13Å; S20-R203 PolarHBondContact O-NH2 2.82Å; S20-R203 WeakPolarHBondContact OG-CD 3.4Å; S20-R203 PolarHBondContact OG-NE 3.2Å; I22-R203 HydrophobicContact CG2-CG 3.99Å; L28-R203 HydrophobicContact CD2-CB 3.92Å; L28-R203 HydrophobicContact CD2-CG 4.09Å; A29-R203 PolarHBondContact N-O 2.83Å; R203-D216 IonicContact CZ-OD1 3.03Å; R203-D216 IonicContact CZ-OD2 3.58Å; R203-D216 VanDerWaalsContact CZ-OD2 3.24Å; R203-D216 IonicContact NH1-OD1 2.81Å; R203-D216 IonicContact NH1-OD2 3.92Å; R203-D216 PolarHBondContact NH1-OD2 2.94Å; R203-D216 IonicContact NH2-OD1 3.87Å; R203-D216 PolarHBondContact NH2-OD1 3.02Å; R203-D216 IonicContact NH2-OD2 3.38Å; R203-D216 PolarHBondContact NH2-OD2 3.48Å
204	T	97.1	Very high	94.5	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	109.4	-174.8	-52.2	0	0	0	0	110.9	A29 F199 L202 T206	A29-T204 HydrophobicContact CB-CG2 4.05Å; A29-T204 CarbonylContact O-C 3.59Å; A29-T204 VanDerWaalsContact O-CA 3.29Å; A29-T204 WeakPolarHBondContact O-CA 3.48Å; F199-T204 HydrophobicContact CD2-CG2 4.25Å; F199-T204 PolarHBondContact N-OG1 2.61Å; F199-T204 VanDerWaalsContact N-OG1 3.1Å; L202-T204 PolarHBondContact O-N 2.9Å; L202-T204 PolarHBondContact O-OG1 2.82Å; T204-T206 HydrophobicContact CG2-CG2 4.28Å; T204-T206 PolarHBondContact O-N 3.06Å
205	I	98	Very high	94.4	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	118.2	170.8	-60.4	165.9	0	0	0	108.3	I22 L28 A29 I30 S31 V56 I207 D216 F273	I22-I205 HydrophobicContact CD1-CD1 3.87Å; I22-I205 HydrophobicContact CD1-CG1 4.36Å; I22-I205 HydrophobicContact CG2-CD1 4.36Å; I22-I205 HydrophobicContact CG2-CG1 3.9Å; L28-I205 HydrophobicContact CD1-CD1 4.25Å; A29-I205 PolarHBondContact O-N 2.92Å; I30-I205 CarbonylContact C-O 3.57Å; I30-I205 WeakPolarHBondContact CA-O 3.4Å; I30-I205 HydrophobicContact CG1-CB 4.26Å; I30-I205 HydrophobicContact CG1-CG2 4.47Å; S31-I205 PolarHBondContact N-O 3.37Å; V56-I205 HydrophobicContact CG1-CD1 3.51Å; I205-I207 HydrophobicContact CG2-CD1 4Å; I205-D216 WeakPolarHBondContact CA-OD2 3.19Å; I205-F273 HydrophobicContact CD1-CE1 4.37Å; I205-F273 HydrophobicContact CG1-CE1 4.22Å; I205-F273 HydrophobicContact CG1-CZ 4.29Å; I205-F273 HydrophobicContact CG2-CD1 4.47Å; I205-F273 HydrophobicContact CG2-CE1 3.69Å; I205-F273 HydrophobicContact CG2-CZ 4.06Å
206	T	97.8	Very high	94.3	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.6	-175.5	46.1	0	0	0	0	112.8	L196 V198 T204 D214 A215 D216 V217	L196-T206 HydrophobicContact CD1-CG2 4.02Å; L196-T206 HydrophobicContact CD2-CG2 3.97Å; L196-T206 HydrophobicContact CG-CG2 4Å; V198-T206 HydrophobicContact CG2-CG2 3.7Å; T204-T206 HydrophobicContact CG2-CG2 4.28Å; T204-T206 PolarHBondContact O-N 3.06Å; T206-D214 PolarHBondContact OG1-O 3.41Å; T206-A215 VanDerWaalsContact OG1-CA 3.28Å; T206-A215 WeakPolarHBondContact OG1-CA 3.39Å; T206-D216 PolarHBondContact N-OD2 2.9Å; T206-D216 PolarHBondContact O-N 3.46Å; T206-D216 PolarHBondContact OG1-N 3.01Å; T206-D216 PolarHBondContact OG1-OD2 3.47Å; T206-V217 PolarHBondContact O-N 3.12Å
207	I	98.4	Very high	94.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	129.9	-177.2	-55.4	86.5	0	0	0	110.1	I30 S31 F32 C33 Y41 H42 A45 I205 V217 M270	I30-I207 HydrophobicContact CD1-CD1 3.85Å; I30-I207 HydrophobicContact CG1-CD1 3.46Å; I30-I207 VanDerWaalsContact CG1-CD1 3.46Å; S31-I207 WeakPolarHBondContact O-CD1 3.38Å; S31-I207 PolarHBondContact O-N 3.39Å; F32-I207 HydrophobicContact CD1-CB 3.77Å; F32-I207 HydrophobicContact CD1-CD1 4Å; F32-I207 HydrophobicContact CD1-CG1 4.09Å; F32-I207 HydrophobicContact CD1-CG2 4.09Å; F32-I207 HydrophobicContact CE1-CB 4.16Å; F32-I207 HydrophobicContact CE1-CD1 3.8Å; F32-I207 HydrophobicContact CE1-CG1 3.97Å; F32-I207 HydrophobicContact CE1-CG2 4.41Å; F32-I207 HydrophobicContact CG-CD1 4.47Å; F32-I207 HydrophobicContact CZ-CD1 4.09Å; C33-I207 PolarHBondContact N-O 2.96Å; Y41-I207 HydrophobicContact CD1-CG2 4.09Å; Y41-I207 HydrophobicContact CE1-CG2 3.79Å; H42-I207 PolarHBondContact CE1-O 2.81Å; A45-I207 HydrophobicContact CB-CG2 3.96Å; I205-I207 HydrophobicContact CG2-CD1 4Å; I207-V217 WeakPolarHBondContact CA-O 3.12Å; I207-V217 HydrophobicContact CB-CB 4.49Å; I207-V217 HydrophobicContact CG1-CB 4.12Å; I207-V217 HydrophobicContact CG1-CG2 4.39Å; I207-V217 HydrophobicContact CG2-CB 4.34Å; I207-V217 HydrophobicContact CG2-CG1 4.39Å; I207-M270 HydrophobicContact CD1-CE 4.12Å; I207-M270 HydrophobicContact CG1-CE 3.63Å
208	S	97.9	Very high	94.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.153	C	C	.	.			trans	-145.7	126.9	-179.3	172.4	0	0	0	0	111	F210 V217 S218 P219 Q235	S208-F210 PolarHBondContact O-N 3.39Å; S208-F210 WeakPolarHBondContact OG-CB 3.43Å; S208-F210 PolarHBondContact OG-N 3.05Å; S208-F210 VanDerWaalsContact OG-N 3.1Å; S208-F210 PolarHBondContact OG-O 3.04Å; S208-V217 PolarHBondContact N-O 3.34Å; S208-S218 WeakPolarHBondContact O-CA 3.41Å; S208-S218 WeakPolarHBondContact O-CB 3.48Å; S208-P219 WeakPolarHBondContact O-CD 3.49Å; S208-Q235 PolarHBondContact OG-NE2 3.36Å; S208-Q235 VanDerWaalsContact OG-NE2 3.08Å
209	P	97.2	Very high	94.2	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	-72	-5.4	170.4	31.6	-34	0	0	0	112.6	C33 C35 L38 Y41 P219 R246	C33-P209 VanDerWaalsContact SG-CD 3.56Å; C35-P209 HydrophobicContact CB-CG 3.43Å; C35-P209 VanDerWaalsContact CB-CG 3.43Å; L38-P209 HydrophobicContact CB-CB 4.03Å; L38-P209 HydrophobicContact CB-CG 3.91Å; L38-P209 HydrophobicContact CD1-CB 4.21Å; L38-P209 HydrophobicContact CD1-CG 4.29Å; Y41-P209 HydrophobicContact CD1-CB 3.98Å; Y41-P209 HydrophobicContact CD2-CB 4.21Å; Y41-P209 HydrophobicContact CG-CB 3.73Å; P209-P219 WeakPolarHBondContact O-CD 3.41Å; P209-P219 WeakPolarHBondContact O-CG 3.3Å; P209-R246 WeakPolarHBondContact O-CD 3.23Å; P209-R246 PolarHBondContact O-NE 3.32Å
210	F	95.7	Very high	93.9	Very high	13 Å²	13	31.1 Å²	31.1	6%	0.057	16%	0.159	C	C	.	.	S	Bend	trans	-97.8	141	173.4	-49.9	-78.2	0	0	0	110.2	C35 L38 S208 S212 S218 L237 N243 R246 A250	C35-F210 HydrophobicContact CB-CE2 3.76Å; C35-F210 HydrophobicContact CB-CZ 4.08Å; L38-F210 HydrophobicContact CD1-CE1 4.23Å; L38-F210 HydrophobicContact CD1-CZ 4.43Å; S208-F210 PolarHBondContact O-N 3.39Å; S208-F210 WeakPolarHBondContact OG-CB 3.43Å; S208-F210 PolarHBondContact OG-N 3.05Å; S208-F210 VanDerWaalsContact OG-N 3.1Å; S208-F210 PolarHBondContact OG-O 3.04Å; F210-S212 PolarHBondContact O-N 3.41Å; F210-S218 VanDerWaalsContact O-CB 3.29Å; F210-S218 WeakPolarHBondContact O-CB 3.49Å; F210-L237 HydrophobicContact CB-CD1 4.22Å; F210-L237 HydrophobicContact CB-CD2 3.71Å; F210-L237 HydrophobicContact CD2-CD1 4.42Å; F210-L237 HydrophobicContact CD2-CD2 4.48Å; F210-L237 HydrophobicContact CG-CD1 4.15Å; F210-L237 HydrophobicContact CG-CD2 4.32Å; F210-N243 WeakPolarHBondContact CA-OD1 3.11Å; F210-R246 HydrophobicContact CD1-CB 3.7Å; F210-R246 HydrophobicContact CE1-CB 3.73Å; F210-A250 HydrophobicContact CZ-CB 4.34Å
211	H	92.9	Very high	93.5	Very high	29 Å²	29	20.3 Å²	20.3	13%	0.134	12%	0.119	C	C	.	.			trans	-60.3	112.4	170.5	-175.7	178.5	0	0	0	109	P219 D221 Q238 N243	H211-P219 VanDerWaalsContact CA-O 3.3Å; H211-P219 WeakPolarHBondContact CA-O 3.48Å; H211-P219 VanDerWaalsContact CB-O 3.23Å; H211-P219 WeakPolarHBondContact CB-O 3.47Å; H211-D221 WeakPolarHBondContact CB-OD2 3.28Å; H211-D221 IonicContact CG-OD2 3.03Å; H211-D221 WeakPolarHBondContact ND1-CB 3.41Å; H211-D221 PolarHBondContact ND1-N 3.16Å; H211-D221 VanDerWaalsContact ND1-N 3.12Å; H211-D221 IonicContact ND1-OD2 3.46Å; H211-Q238 HydrophobicContact CB-CB 4.2Å; H211-Q238 WeakPolarHBondContact O-CB 3.44Å; H211-Q238 PolarHBondContact O-N 3.03Å; H211-N243 PolarHBondContact N-OD1 3.07Å; H211-N243 PolarHBondContact O-ND2 2.86Å
212	S	89.5	Confident	92.5	Very high	4 Å²	4	22.6 Å²	22.6	3%	0.028	13%	0.131	C	C	.	.			trans	-140.8	132.1	-171.4	177	0	0	0	0	110.7	F210 D214 A215 K236	F210-S212 PolarHBondContact O-N 3.41Å; S212-D214 PolarHBondContact O-N 2.97Å; S212-D214 PolarHBondContact OG-N 3.06Å; S212-A215 PolarHBondContact O-N 2.81Å; S212-K236 WeakPolarHBondContact CB-O 3.43Å; S212-K236 PolarHBondContact OG-O 3.4Å
213	S	82.7	Confident	90.9	Very high	58 Å²	58	32.6 Å²	32.6	41%	0.406	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-16.6	172.4	61.9	0	0	0	0	113.3
214	D	85.2	Confident	89.3	Confident	42 Å²	42	35.5 Å²	35.5	23%	0.225	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-3.5	-177.5	-59.7	-16.9	0	0	0	111.9	T206 S212 K236	T206-D214 PolarHBondContact OG1-O 3.41Å; S212-D214 PolarHBondContact O-N 2.97Å; S212-D214 PolarHBondContact OG-N 3.06Å; D214-K236 VanDerWaalsContact OD2-CB 3.25Å; D214-K236 WeakPolarHBondContact OD2-CB 3.36Å; D214-K236 WeakPolarHBondContact OD2-CG 3.42Å; D214-K236 PolarHBondContact OD2-N 3.17Å
215	A	93.6	Very high	87.4	Confident	14 Å²	14	44.5 Å²	44.5	12%	0.116	22%	0.222	C	C	.	.			trans	-104.6	129.2	-179.1	0	0	0	0	0	111.5	T206 S212	T206-A215 VanDerWaalsContact OG1-CA 3.28Å; T206-A215 WeakPolarHBondContact OG1-CA 3.39Å; S212-A215 PolarHBondContact O-N 2.81Å
216	D	95.9	Very high	86	Confident	30 Å²	30	51.2 Å²	51.2	16%	0.16	25%	0.252	C	S	.	.	S	Bend	trans	-70.4	-38.2	171.9	-67.9	-51.7	0	0	0	112.3	G19 R203 I205 T206 F273	G19-D216 PolarHBondContact N-OD1 3Å; R203-D216 IonicContact CZ-OD1 3.03Å; R203-D216 IonicContact CZ-OD2 3.58Å; R203-D216 VanDerWaalsContact CZ-OD2 3.24Å; R203-D216 IonicContact NH1-OD1 2.81Å; R203-D216 IonicContact NH1-OD2 3.92Å; R203-D216 PolarHBondContact NH1-OD2 2.94Å; R203-D216 IonicContact NH2-OD1 3.87Å; R203-D216 PolarHBondContact NH2-OD1 3.02Å; R203-D216 IonicContact NH2-OD2 3.38Å; R203-D216 PolarHBondContact NH2-OD2 3.48Å; I205-D216 WeakPolarHBondContact CA-OD2 3.19Å; T206-D216 PolarHBondContact N-OD2 2.9Å; T206-D216 PolarHBondContact O-N 3.46Å; T206-D216 PolarHBondContact OG1-N 3.01Å; T206-D216 PolarHBondContact OG1-OD2 3.47Å; D216-F273 HydrophobicContact CB-CD2 3.99Å; D216-F273 HydrophobicContact CB-CE2 3.55Å; D216-F273 HydrophobicContact CB-CZ 4.01Å
217	V	97.2	Very high	84.9	Confident	2 Å²	2	55.9 Å²	55.9	1%	0.012	28%	0.277	C	S	.	.	B	Isolated β-bridge	trans	-118	105.5	179.7	-174.3	0	0	0	0	107.7	Y41 T206 I207 S208 D269 M270 F273	Y41-V217 HydrophobicContact CE1-CG1 4.43Å; T206-V217 PolarHBondContact O-N 3.12Å; I207-V217 WeakPolarHBondContact CA-O 3.12Å; I207-V217 HydrophobicContact CB-CB 4.49Å; I207-V217 HydrophobicContact CG1-CB 4.12Å; I207-V217 HydrophobicContact CG1-CG2 4.39Å; I207-V217 HydrophobicContact CG2-CB 4.34Å; I207-V217 HydrophobicContact CG2-CG1 4.39Å; S208-V217 PolarHBondContact N-O 3.34Å; V217-D269 HydrophobicContact CG1-CB 3.78Å; V217-M270 HydrophobicContact CB-CE 4.43Å; V217-M270 HydrophobicContact CG1-CB 4.28Å; V217-M270 HydrophobicContact CG1-CE 4.43Å; V217-M270 HydrophobicContact CG2-CE 3.81Å; V217-M270 HydrophobicContact CG2-SD 3.93Å; V217-F273 HydrophobicContact CG2-CB 3.69Å; V217-F273 HydrophobicContact CG2-CD1 3.8Å; V217-F273 HydrophobicContact CG2-CD2 4.19Å; V217-F273 HydrophobicContact CG2-CE1 4.49Å; V217-F273 HydrophobicContact CG2-CG 3.62Å
218	S	95.9	Very high	84.2	Confident	16 Å²	16	64 Å²	64	11%	0.112	31%	0.307	C	S	.	.			trans	-154.8	155.6	175.3	62.6	0	0	0	0	111.1	Y41 S208 F210	Y41-S218 WeakPolarHBondContact OH-CA 3.44Å; S208-S218 WeakPolarHBondContact O-CA 3.41Å; S208-S218 WeakPolarHBondContact O-CB 3.48Å; F210-S218 VanDerWaalsContact O-CB 3.29Å; F210-S218 WeakPolarHBondContact O-CB 3.49Å
219	P	93.8	Very high	83.7	Confident	8 Å²	8	70 Å²	70	5%	0.052	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-64.6	140	171.6	27.1	-32.9	0	0	0	109.7	S208 P209 H211	S208-P219 WeakPolarHBondContact O-CD 3.49Å; P209-P219 WeakPolarHBondContact O-CD 3.41Å; P209-P219 WeakPolarHBondContact O-CG 3.3Å; H211-P219 VanDerWaalsContact CA-O 3.3Å; H211-P219 WeakPolarHBondContact CA-O 3.48Å; H211-P219 VanDerWaalsContact CB-O 3.23Å; H211-P219 WeakPolarHBondContact CB-O 3.47Å
220	V	87.1	Confident	83.3	Confident	94 Å²	94	73 Å²	73	57%	0.57	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-96.1	120.6	173.3	-176.6	0	0	0	0	108
221	D	84.1	Confident	83	Confident	9 Å²	9	76.8 Å²	76.8	5%	0.048	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-84.5	120.2	171.9	-63.2	-41.5	0	0	0	109.9	H211 S240 N242 R246	H211-D221 WeakPolarHBondContact CB-OD2 3.28Å; H211-D221 IonicContact CG-OD2 3.03Å; H211-D221 WeakPolarHBondContact ND1-CB 3.41Å; H211-D221 PolarHBondContact ND1-N 3.16Å; H211-D221 VanDerWaalsContact ND1-N 3.12Å; H211-D221 IonicContact ND1-OD2 3.46Å; D221-S240 WeakPolarHBondContact OD2-CB 3.45Å; D221-S240 PolarHBondContact OD2-OG 3.05Å; D221-N242 WeakPolarHBondContact OD1-CB 3.36Å; D221-N242 PolarHBondContact OD1-ND2 3.02Å; D221-R246 IonicContact OD1-CZ 2.83Å; D221-R246 VanDerWaalsContact OD1-CZ 3.23Å; D221-R246 IonicContact OD1-NH1 3.38Å; D221-R246 PolarHBondContact OD1-NH1 3.34Å; D221-R246 IonicContact OD1-NH2 2.68Å; D221-R246 PolarHBondContact OD1-NH2 3.37Å; D221-R246 IonicContact OD2-CZ 3.24Å; D221-R246 IonicContact OD2-NH1 2.71Å; D221-R246 PolarHBondContact OD2-NH1 3.07Å
222	D	73	Confident	82.8	Confident	135 Å²	135	78.2 Å²	78.2	72%	0.722	38%	0.378	S	S	*	.	S	Bend	trans	-64.6	148.3	172.6	-64.5	-35.9	0	0	0	110.9
223	R	59.4	Low	82.7	Confident	228 Å²	228	78.5 Å²	78.5	86%	0.86	38%	0.382	S	S	*	.			trans	72.8	47.9	165.1	-48.7	173.2	-176.6	-177.9	-0.2	116.9	F225	R223-F225 PolarHBondContact O-N 3.04Å
224	L	63.8	Low	83.1	Confident	63 Å²	63	83.1 Å²	83.1	33%	0.33	40%	0.395	S	S	.	.			trans	-86	107.1	167	-64.5	163.3	0	0	0	110	F226 Q238 F239	L224-F226 PolarHBondContact O-N 3.23Å; L224-Q238 HydrophobicContact CD1-CB 4.46Å; L224-Q238 HydrophobicContact CD1-CG 3.21Å; L224-Q238 HydrophobicContact CD2-CG 4.35Å; L224-Q238 HydrophobicContact CG-CG 4.38Å; L224-F239 WeakPolarHBondContact CD2-O 3.26Å
225	F	56.7	Low	83.4	Confident	189 Å²	189	81.3 Å²	81.3	83%	0.829	39%	0.385	S	S	*	.	S	Bend	trans	-66.6	-24.4	174	-73.2	-80.7	0	0	0	112.6	R223	R223-F225 PolarHBondContact O-N 3.04Å
226	F	68.2	Low	83.2	Confident	142 Å²	142	85.2 Å²	85.2	62%	0.623	40%	0.399	S	S	*	.	S	Bend	trans	-135.3	134.5	179.9	-59.2	-77	0	0	0	110	L224 W228	L224-F226 PolarHBondContact O-N 3.23Å; F226-W228 HydrophobicContact CB-CD2 4.43Å; F226-W228 HydrophobicContact CB-CG 4.21Å; F226-W228 PolarHBondContact O-N 3.46Å
227	D	75.7	Confident	82.8	Confident	98 Å²	98	84.1 Å²	84.1	52%	0.524	39%	0.393	S	S	.	.			trans	-83.9	54.1	177.1	-171.2	5.8	0	0	0	111.3	R229 Q238	D227-R229 VanDerWaalsContact CG-NH2 3.34Å; D227-R229 IonicContact OD1-CZ 2.81Å; D227-R229 IonicContact OD1-NE 3.46Å; D227-R229 PolarHBondContact OD1-NE 2.95Å; D227-R229 IonicContact OD1-NH2 3.06Å; D227-R229 PolarHBondContact OD1-NH2 3.28Å; D227-R229 IonicContact OD2-CZ 2.74Å; D227-R229 IonicContact OD2-NE 3.07Å; D227-R229 IonicContact OD2-NH2 2.72Å; D227-R229 PolarHBondContact OD2-NH2 3.14Å; D227-Q238 PolarHBondContact OD1-NE2 2.93Å; D227-Q238 PolarHBondContact OD1-OE1 3.38Å
228	W	83.4	Confident	82.3	Confident	169 Å²	169	84.4 Å²	84.4	64%	0.64	39%	0.394	S	S	*	.			trans	-82.6	139.5	176.6	-72.2	3.1	0	0	0	110.8	F226 Q238 F239	F226-W228 HydrophobicContact CB-CD2 4.43Å; F226-W228 HydrophobicContact CB-CG 4.21Å; F226-W228 PolarHBondContact O-N 3.46Å; W228-Q238 PolarHBondContact O-NE2 3.38Å; W228-Q238 VanDerWaalsContact O-NE2 3.08Å; W228-F239 HydrophobicContact CB-CB 4.05Å; W228-F239 WeakPolarHBondContact O-CB 3.49Å; W228-F239 PolarHBondContact O-N 3.5Å
229	R	86.8	Confident	81.9	Confident	127 Å²	127	88.4 Å²	88.4	48%	0.479	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	146.5	-175.5	-53.4	-179.8	-155.6	136	-4.9	110.1	D227 L237	D227-R229 VanDerWaalsContact CG-NH2 3.34Å; D227-R229 IonicContact OD1-CZ 2.81Å; D227-R229 IonicContact OD1-NE 3.46Å; D227-R229 PolarHBondContact OD1-NE 2.95Å; D227-R229 IonicContact OD1-NH2 3.06Å; D227-R229 PolarHBondContact OD1-NH2 3.28Å; D227-R229 IonicContact OD2-CZ 2.74Å; D227-R229 IonicContact OD2-NE 3.07Å; D227-R229 IonicContact OD2-NH2 2.72Å; D227-R229 PolarHBondContact OD2-NH2 3.14Å; R229-L237 CarbonylContact C-O 3.51Å; R229-L237 WeakPolarHBondContact CA-O 3.4Å
230	F	88.9	Confident	81.5	Confident	63 Å²	63	88.4 Å²	88.4	28%	0.276	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	161.2	170.8	67.6	-81.4	0	0	0	109.5	V232 K236 L237 Q238 F239	F230-V232 HydrophobicContact CD2-CG2 3.79Å; F230-V232 HydrophobicContact CE2-CG2 3.48Å; F230-V232 VanDerWaalsContact CE2-CG2 3.48Å; F230-K236 WeakPolarHBondContact O-CA 3.48Å; F230-L237 HydrophobicContact CD1-CB 4.27Å; F230-L237 HydrophobicContact CE1-CB 3.79Å; F230-L237 HydrophobicContact CE2-CB 4.07Å; F230-L237 HydrophobicContact CE2-CD1 3.95Å; F230-L237 HydrophobicContact CE2-CG 4.48Å; F230-L237 HydrophobicContact CZ-CB 3.68Å; F230-L237 HydrophobicContact CZ-CD1 3.91Å; F230-L237 HydrophobicContact CZ-CG 4.4Å; F230-L237 PolarHBondContact N-O 3Å; F230-L237 PolarHBondContact O-N 3.19Å; F230-Q238 WeakPolarHBondContact CE1-O 3.2Å; F230-F239 HydrophobicContact CD1-CB 4.35Å; F230-F239 HydrophobicContact CD1-CD2 4.29Å
231	T	89.6	Confident	81.5	Confident	93 Å²	93	92.3 Å²	92.3	57%	0.571	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	130.2	-176.4	-59.3	0	0	0	0	110.7	K234 Q235	T231-K234 VanDerWaalsContact CG2-CA 3.48Å; T231-Q235 VanDerWaalsContact CA-O 3.31Å; T231-Q235 WeakPolarHBondContact CA-O 3.32Å
232	V	88.2	Confident	81.8	Confident	58 Å²	58	95.1 Å²	95.1	35%	0.352	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	116.9	170.5	-179.4	0	0	0	0	107.5	F230 K234 Q235 L237	F230-V232 HydrophobicContact CD2-CG2 3.79Å; F230-V232 HydrophobicContact CE2-CG2 3.48Å; F230-V232 VanDerWaalsContact CE2-CG2 3.48Å; V232-K234 VanDerWaalsContact C-N 3.31Å; V232-K234 PolarHBondContact O-N 2.82Å; V232-Q235 PolarHBondContact N-O 2.86Å; V232-Q235 WeakPolarHBondContact O-CB 3.33Å; V232-Q235 PolarHBondContact O-N 3.39Å; V232-L237 HydrophobicContact CB-CD1 4.2Å; V232-L237 HydrophobicContact CG2-CD1 3.86Å
233	G	88.3	Confident	82.7	Confident	11 Å²	11	88.9 Å²	88.9	11%	0.113	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	48.1	-178.6	0	0	0	0	0	113.8	G191 I192 L194 N195 Q235	G191-G233 VanDerWaalsContact O-CA 3.25Å; G191-G233 WeakPolarHBondContact O-CA 3.35Å; I192-G233 WeakPolarHBondContact O-CA 3.3Å; L194-G233 CarbonylContact C-O 3.44Å; L194-G233 VanDerWaalsContact CA-O 3.23Å; L194-G233 WeakPolarHBondContact CA-O 3.32Å; N195-G233 PolarHBondContact N-O 3.11Å; G233-Q235 PolarHBondContact O-N 3.32Å; G233-Q235 VanDerWaalsContact O-N 3.08Å
234	K	91	Very high	84.2	Confident	155 Å²	155	83 Å²	83	67%	0.674	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.6	0.1	-175.6	-56	172.9	-176.9	170.2	0	116.5	C193 L194 T231 V232	C193-K234 WeakPolarHBondContact O-CD 3.38Å; C193-K234 WeakPolarHBondContact O-CE 3.29Å; C193-K234 WeakPolarHBondContact O-CG 3.41Å; L194-K234 HydrophobicContact CD1-CB 4.43Å; L194-K234 HydrophobicContact CD1-CD 4.23Å; T231-K234 VanDerWaalsContact CG2-CA 3.48Å; V232-K234 VanDerWaalsContact C-N 3.31Å; V232-K234 PolarHBondContact O-N 2.82Å
235	Q	90	Very high	85.6	Confident	3 Å²	3	82.5 Å²	82.5	1%	0.014	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	130.5	171.3	-174.1	-174.8	4.2	0	0	110.1	N195 L196 S208 T231 V232 G233 L237	N195-Q235 HydrophobicContact CB-CB 4.24Å; N195-Q235 PolarHBondContact ND2-OE1 3.18Å; L196-Q235 HydrophobicContact CB-CB 4.2Å; L196-Q235 HydrophobicContact CB-CG 4.02Å; L196-Q235 HydrophobicContact CD2-CG 4.05Å; S208-Q235 PolarHBondContact OG-NE2 3.36Å; S208-Q235 VanDerWaalsContact OG-NE2 3.08Å; T231-Q235 VanDerWaalsContact CA-O 3.31Å; T231-Q235 WeakPolarHBondContact CA-O 3.32Å; V232-Q235 PolarHBondContact N-O 2.86Å; V232-Q235 WeakPolarHBondContact O-CB 3.33Å; V232-Q235 PolarHBondContact O-N 3.39Å; G233-Q235 PolarHBondContact O-N 3.32Å; G233-Q235 VanDerWaalsContact O-N 3.08Å; Q235-L237 HydrophobicContact CG-CD2 3.88Å
236	K	90.3	Very high	87.4	Confident	97 Å²	97	74.6 Å²	74.6	42%	0.422	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	119.3	174.7	-62.4	170.6	-173.5	165.4	0	110.4	S212 D214 F230	S212-K236 WeakPolarHBondContact CB-O 3.43Å; S212-K236 PolarHBondContact OG-O 3.4Å; D214-K236 VanDerWaalsContact OD2-CB 3.25Å; D214-K236 WeakPolarHBondContact OD2-CB 3.36Å; D214-K236 WeakPolarHBondContact OD2-CG 3.42Å; D214-K236 PolarHBondContact OD2-N 3.17Å; F230-K236 WeakPolarHBondContact O-CA 3.48Å
237	L	88.3	Confident	88.6	Confident	6 Å²	6	69.2 Å²	69.2	3%	0.031	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	144.7	176.8	-57.5	-173.4	0	0	0	109.9	F210 R229 F230 V232 Q235	F210-L237 HydrophobicContact CB-CD1 4.22Å; F210-L237 HydrophobicContact CB-CD2 3.71Å; F210-L237 HydrophobicContact CD2-CD1 4.42Å; F210-L237 HydrophobicContact CD2-CD2 4.48Å; F210-L237 HydrophobicContact CG-CD1 4.15Å; F210-L237 HydrophobicContact CG-CD2 4.32Å; R229-L237 CarbonylContact C-O 3.51Å; R229-L237 WeakPolarHBondContact CA-O 3.4Å; F230-L237 HydrophobicContact CD1-CB 4.27Å; F230-L237 HydrophobicContact CE1-CB 3.79Å; F230-L237 HydrophobicContact CE2-CB 4.07Å; F230-L237 HydrophobicContact CE2-CD1 3.95Å; F230-L237 HydrophobicContact CE2-CG 4.48Å; F230-L237 HydrophobicContact CZ-CB 3.68Å; F230-L237 HydrophobicContact CZ-CD1 3.91Å; F230-L237 HydrophobicContact CZ-CG 4.4Å; F230-L237 PolarHBondContact N-O 3Å; F230-L237 PolarHBondContact O-N 3.19Å; V232-L237 HydrophobicContact CB-CD1 4.2Å; V232-L237 HydrophobicContact CG2-CD1 3.86Å; Q235-L237 HydrophobicContact CG-CD2 3.88Å
238	Q	86.6	Confident	89.5	Confident	8 Å²	8	70.7 Å²	70.7	4%	0.037	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	133.9	175.9	-158.7	62.3	36.4	0	0	110.2	H211 L224 D227 W228 F230 S240 N243	H211-Q238 HydrophobicContact CB-CB 4.2Å; H211-Q238 WeakPolarHBondContact O-CB 3.44Å; H211-Q238 PolarHBondContact O-N 3.03Å; L224-Q238 HydrophobicContact CD1-CB 4.46Å; L224-Q238 HydrophobicContact CD1-CG 3.21Å; L224-Q238 HydrophobicContact CD2-CG 4.35Å; L224-Q238 HydrophobicContact CG-CG 4.38Å; D227-Q238 PolarHBondContact OD1-NE2 2.93Å; D227-Q238 PolarHBondContact OD1-OE1 3.38Å; W228-Q238 PolarHBondContact O-NE2 3.38Å; W228-Q238 VanDerWaalsContact O-NE2 3.08Å; F230-Q238 WeakPolarHBondContact CE1-O 3.2Å; Q238-S240 PolarHBondContact O-N 3.01Å; Q238-N243 PolarHBondContact O-ND2 2.94Å
239	F	85.8	Confident	90.1	Very high	101 Å²	101	63.9 Å²	63.9	44%	0.443	30%	0.302	S	S	.	.			trans	-72.9	100.9	172.4	-168	-80.2	0	0	0	108.6	L224 W228 F230 F244	L224-F239 WeakPolarHBondContact CD2-O 3.26Å; W228-F239 HydrophobicContact CB-CB 4.05Å; W228-F239 WeakPolarHBondContact O-CB 3.49Å; W228-F239 PolarHBondContact O-N 3.5Å; F230-F239 HydrophobicContact CD1-CB 4.35Å; F230-F239 HydrophobicContact CD1-CD2 4.29Å; F239-F244 HydrophobicContact CD1-CE2 4.09Å; F239-F244 AromaticContact CD2-CE2 3.9Å; F239-F244 HydrophobicContact CD2-CE2 3.9Å; F239-F244 AromaticContact CD2-CZ 3.84Å; F239-F244 HydrophobicContact CD2-CZ 3.84Å; F239-F244 AromaticContact CE1-CE2 3.74Å; F239-F244 HydrophobicContact CE1-CE2 3.74Å; F239-F244 HydrophobicContact CE1-CZ 4.36Å; F239-F244 AromaticContact CE2-CE2 3.57Å; F239-F244 HydrophobicContact CE2-CE2 3.57Å; F239-F244 AromaticContact CE2-CZ 3.34Å; F239-F244 HydrophobicContact CE2-CZ 3.34Å; F239-F244 HydrophobicContact CG-CE2 4.16Å; F239-F244 AromaticContact CZ-CE2 3.47Å; F239-F244 HydrophobicContact CZ-CE2 3.47Å; F239-F244 VanDerWaalsContact CZ-CE2 3.47Å; F239-F244 AromaticContact CZ-CZ 3.63Å; F239-F244 HydrophobicContact CZ-CZ 3.63Å
240	S	86.2	Confident	90.5	Very high	8 Å²	8	58.2 Å²	58.2	6%	0.056	28%	0.282	C	S	.	.			trans	-143.8	148.3	179.6	79	0	0	0	0	110	D221 Q238 N242 N243 F244	D221-S240 WeakPolarHBondContact OD2-CB 3.45Å; D221-S240 PolarHBondContact OD2-OG 3.05Å; Q238-S240 PolarHBondContact O-N 3.01Å; S240-N242 PolarHBondContact O-N 3.08Å; S240-N243 PolarHBondContact O-N 3.17Å; S240-N243 VanDerWaalsContact O-N 3.11Å; S240-N243 WeakPolarHBondContact OG-CB 3.37Å; S240-N243 PolarHBondContact OG-N 3.3Å; S240-F244 WeakPolarHBondContact O-CD2 3.4Å; S240-F244 PolarHBondContact O-N 3.44Å; S240-F244 VanDerWaalsContact O-N 3.09Å
241	Y	87.2	Confident	90.6	Very high	175 Å²	175	57.9 Å²	57.9	69%	0.686	28%	0.283	S	S	*	.	H	α-helix	trans	-53.1	-42.2	173	177.3	-101.1	0	0	0	111.2	N243 F244 I245	Y241-N243 PolarHBondContact O-N 2.94Å; Y241-F244 WeakPolarHBondContact O-CB 3.39Å; Y241-F244 PolarHBondContact O-N 2.8Å; Y241-F244 VanDerWaalsContact O-N 3.15Å; Y241-I245 HydrophobicContact CD1-CG1 4.09Å; Y241-I245 HydrophobicContact CE1-CD1 4.18Å; Y241-I245 HydrophobicContact CE1-CG1 3.66Å; Y241-I245 HydrophobicContact CE2-CD1 4.26Å; Y241-I245 HydrophobicContact CE2-CG1 4.32Å; Y241-I245 WeakPolarHBondContact O-CG1 3.31Å; Y241-I245 PolarHBondContact O-N 2.93Å
242	N	90.6	Very high	90.8	Very high	69 Å²	69	58 Å²	58	37%	0.369	28%	0.28	S	S	.	.	H	α-helix	trans	-63.3	-39	178.6	-64.8	-16.3	0	0	0	112.7	D221 S240 F244 I245 R246	D221-N242 WeakPolarHBondContact OD1-CB 3.36Å; D221-N242 PolarHBondContact OD1-ND2 3.02Å; S240-N242 PolarHBondContact O-N 3.08Å; N242-F244 VanDerWaalsContact C-N 3.35Å; N242-I245 PolarHBondContact O-N 3.49Å; N242-R246 WeakPolarHBondContact O-CB 3.1Å; N242-R246 VanDerWaalsContact O-CG 3.27Å; N242-R246 WeakPolarHBondContact O-CG 3.49Å; N242-R246 PolarHBondContact O-N 3.14Å
243	N	91.5	Very high	91.1	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-68.1	-32.7	174.4	-87.8	-6.6	0	0	0	112.8	F210 H211 Q238 S240 Y241 R246 G247	F210-N243 WeakPolarHBondContact CA-OD1 3.11Å; H211-N243 PolarHBondContact N-OD1 3.07Å; H211-N243 PolarHBondContact O-ND2 2.86Å; Q238-N243 PolarHBondContact O-ND2 2.94Å; S240-N243 PolarHBondContact O-N 3.17Å; S240-N243 VanDerWaalsContact O-N 3.11Å; S240-N243 WeakPolarHBondContact OG-CB 3.37Å; S240-N243 PolarHBondContact OG-N 3.3Å; Y241-N243 PolarHBondContact O-N 2.94Å; N243-R246 PolarHBondContact OD1-NH1 3.14Å; N243-G247 PolarHBondContact O-N 2.83Å
244	F	90.8	Very high	91.5	Very high	103 Å²	103	56 Å²	56	45%	0.452	27%	0.266	S	S	.	.	H	α-helix	trans	-64.5	-44.5	170	-75.6	-72	0	0	0	111.8	F239 S240 Y241 N242 G247 K248	F239-F244 HydrophobicContact CD1-CE2 4.09Å; F239-F244 AromaticContact CD2-CE2 3.9Å; F239-F244 HydrophobicContact CD2-CE2 3.9Å; F239-F244 AromaticContact CD2-CZ 3.84Å; F239-F244 HydrophobicContact CD2-CZ 3.84Å; F239-F244 AromaticContact CE1-CE2 3.74Å; F239-F244 HydrophobicContact CE1-CE2 3.74Å; F239-F244 HydrophobicContact CE1-CZ 4.36Å; F239-F244 AromaticContact CE2-CE2 3.57Å; F239-F244 HydrophobicContact CE2-CE2 3.57Å; F239-F244 AromaticContact CE2-CZ 3.34Å; F239-F244 HydrophobicContact CE2-CZ 3.34Å; F239-F244 HydrophobicContact CG-CE2 4.16Å; F239-F244 AromaticContact CZ-CE2 3.47Å; F239-F244 HydrophobicContact CZ-CE2 3.47Å; F239-F244 VanDerWaalsContact CZ-CE2 3.47Å; F239-F244 AromaticContact CZ-CZ 3.63Å; F239-F244 HydrophobicContact CZ-CZ 3.63Å; S240-F244 WeakPolarHBondContact O-CD2 3.4Å; S240-F244 PolarHBondContact O-N 3.44Å; S240-F244 VanDerWaalsContact O-N 3.09Å; Y241-F244 WeakPolarHBondContact O-CB 3.39Å; Y241-F244 PolarHBondContact O-N 2.8Å; Y241-F244 VanDerWaalsContact O-N 3.15Å; N242-F244 VanDerWaalsContact C-N 3.35Å; F244-G247 PolarHBondContact O-N 3.43Å; F244-K248 PolarHBondContact O-N 3.41Å
245	I	93.4	Very high	91.8	Very high	53 Å²	53	51.1 Å²	51.1	27%	0.272	25%	0.251	S	S	.	.	H	α-helix	trans	-61.4	-47	176	-65.7	-58.9	0	0	0	110.9	Y241 N242 G247 K248 Q249	Y241-I245 HydrophobicContact CD1-CG1 4.09Å; Y241-I245 HydrophobicContact CE1-CD1 4.18Å; Y241-I245 HydrophobicContact CE1-CG1 3.66Å; Y241-I245 HydrophobicContact CE2-CD1 4.26Å; Y241-I245 HydrophobicContact CE2-CG1 4.32Å; Y241-I245 WeakPolarHBondContact O-CG1 3.31Å; Y241-I245 PolarHBondContact O-N 2.93Å; N242-I245 PolarHBondContact O-N 3.49Å; I245-G247 VanDerWaalsContact C-N 3.34Å; I245-G247 PolarHBondContact O-N 3.12Å; I245-K248 WeakPolarHBondContact O-CB 3.35Å; I245-K248 PolarHBondContact O-N 2.62Å; I245-Q249 HydrophobicContact CG2-CG 4.27Å; I245-Q249 WeakPolarHBondContact O-CB 3.15Å; I245-Q249 VanDerWaalsContact O-CG 3.28Å; I245-Q249 WeakPolarHBondContact O-CG 3.16Å; I245-Q249 PolarHBondContact O-N 2.99Å
246	R	95.6	Very high	92.1	Very high	23 Å²	23	53.1 Å²	53.1	9%	0.087	26%	0.262	C	S	.	.	H	α-helix	trans	-58.2	-44	174.1	-73.8	163.4	-173.2	132.8	7.9	112.1	L38 P209 F210 D221 N242 N243 K248 Q249 A250 Y262	L38-R246 HydrophobicContact CD1-CB 3.7Å; L38-R246 HydrophobicContact CD1-CG 4.09Å; L38-R246 WeakPolarHBondContact CD1-O 3.5Å; P209-R246 WeakPolarHBondContact O-CD 3.23Å; P209-R246 PolarHBondContact O-NE 3.32Å; F210-R246 HydrophobicContact CD1-CB 3.7Å; F210-R246 HydrophobicContact CE1-CB 3.73Å; D221-R246 IonicContact OD1-CZ 2.83Å; D221-R246 VanDerWaalsContact OD1-CZ 3.23Å; D221-R246 IonicContact OD1-NH1 3.38Å; D221-R246 PolarHBondContact OD1-NH1 3.34Å; D221-R246 IonicContact OD1-NH2 2.68Å; D221-R246 PolarHBondContact OD1-NH2 3.37Å; D221-R246 IonicContact OD2-CZ 3.24Å; D221-R246 IonicContact OD2-NH1 2.71Å; D221-R246 PolarHBondContact OD2-NH1 3.07Å; N242-R246 WeakPolarHBondContact O-CB 3.1Å; N242-R246 VanDerWaalsContact O-CG 3.27Å; N242-R246 WeakPolarHBondContact O-CG 3.49Å; N242-R246 PolarHBondContact O-N 3.14Å; N243-R246 PolarHBondContact OD1-NH1 3.14Å; R246-K248 VanDerWaalsContact C-N 3.31Å; R246-K248 PolarHBondContact O-N 3.16Å; R246-Q249 CarbonylContact O-C 3.55Å; R246-Q249 PolarHBondContact O-N 3.39Å; R246-Q249 VanDerWaalsContact O-N 3.12Å; R246-A250 WeakPolarHBondContact O-CB 3.27Å; R246-A250 PolarHBondContact O-N 3.23Å; R246-Y262 HydrophobicContact CG-CE1 4.15Å; R246-Y262 WeakPolarHBondContact CG-OH 3.47Å
247	G	93.5	Very high	92.4	Very high	30 Å²	30	55.2 Å²	55.2	31%	0.309	27%	0.273	S	S	.	.	H	α-helix	trans	-60.5	-41.2	177.9	0	0	0	0	0	112.2	N243 F244 I245	N243-G247 PolarHBondContact O-N 2.83Å; F244-G247 PolarHBondContact O-N 3.43Å; I245-G247 VanDerWaalsContact C-N 3.34Å; I245-G247 PolarHBondContact O-N 3.12Å
248	K	93.4	Very high	92.9	Very high	129 Å²	129	57.4 Å²	57.4	56%	0.561	28%	0.284	S	S	*	.	H	α-helix	trans	-64.3	-46.3	171.5	-179	-173.2	173	-174.1	0	111.2	F244 I245 R246 A250 L251 I252	F244-K248 PolarHBondContact O-N 3.41Å; I245-K248 WeakPolarHBondContact O-CB 3.35Å; I245-K248 PolarHBondContact O-N 2.62Å; R246-K248 VanDerWaalsContact C-N 3.31Å; R246-K248 PolarHBondContact O-N 3.16Å; K248-A250 VanDerWaalsContact C-N 3.27Å; K248-A250 PolarHBondContact O-N 3.28Å; K248-L251 PolarHBondContact O-N 3.43Å; K248-L251 VanDerWaalsContact O-N 3.09Å; K248-I252 HydrophobicContact CG-CD1 4.3Å; K248-I252 PolarHBondContact O-N 3.29Å
249	Q	95.8	Very high	93.4	Very high	25 Å²	25	57 Å²	57	12%	0.117	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-26.2	-177.2	-73.8	174.2	-17.6	0	0	113.5	L38 I245 R246 L251 I252 P254 Y262	L38-Q249 HydrophobicContact CD2-CB 3.96Å; I245-Q249 HydrophobicContact CG2-CG 4.27Å; I245-Q249 WeakPolarHBondContact O-CB 3.15Å; I245-Q249 VanDerWaalsContact O-CG 3.28Å; I245-Q249 WeakPolarHBondContact O-CG 3.16Å; I245-Q249 PolarHBondContact O-N 2.99Å; R246-Q249 CarbonylContact O-C 3.55Å; R246-Q249 PolarHBondContact O-N 3.39Å; R246-Q249 VanDerWaalsContact O-N 3.12Å; Q249-L251 VanDerWaalsContact C-N 3.26Å; Q249-L251 PolarHBondContact O-N 2.83Å; Q249-I252 VanDerWaalsContact CA-O 3.31Å; Q249-I252 WeakPolarHBondContact CA-O 3.13Å; Q249-P254 HydrophobicContact CB-CG 4.1Å; Q249-P254 HydrophobicContact CG-CB 4.01Å; Q249-P254 HydrophobicContact CG-CG 3.9Å; Q249-Y262 VanDerWaalsContact OE1-CE2 3.32Å; Q249-Y262 PolarHBondContact OE1-OH 3.43Å
250	A	94.8	Very high	94	Very high	8 Å²	8	57.4 Å²	57.4	7%	0.066	28%	0.281	C	S	.	.	H	α-helix	trans	-61.1	-34.9	170.8	0	0	0	0	0	112.3	C35 G36 F37 L38 F210 R246 K248	C35-A250 WeakPolarHBondContact O-CA 3.02Å; C35-A250 WeakPolarHBondContact O-CB 3.34Å; G36-A250 WeakPolarHBondContact CA-O 3.44Å; F37-A250 PolarHBondContact N-O 2.86Å; L38-A250 HydrophobicContact CD1-CB 4.45Å; L38-A250 HydrophobicContact CG-CB 4.26Å; F210-A250 HydrophobicContact CZ-CB 4.34Å; R246-A250 WeakPolarHBondContact O-CB 3.27Å; R246-A250 PolarHBondContact O-N 3.23Å; K248-A250 VanDerWaalsContact C-N 3.27Å; K248-A250 PolarHBondContact O-N 3.28Å
251	L	92.5	Very high	94.5	Very high	56 Å²	56	62.1 Å²	62.1	29%	0.293	30%	0.302	S	S	.	.	H	α-helix	trans	-98.1	-33.2	-179.1	-61.3	176.4	0	0	0	113.1	L104 I169 F172 K248 Q249	L104-L251 WeakPolarHBondContact CD1-O 3.25Å; I169-L251 HydrophobicContact CD1-CD2 3.8Å; I169-L251 HydrophobicContact CG2-CD2 4.24Å; F172-L251 HydrophobicContact CD2-CD2 4.4Å; F172-L251 HydrophobicContact CE1-CB 4.46Å; F172-L251 HydrophobicContact CE2-CD1 4.13Å; F172-L251 HydrophobicContact CZ-CD1 4.13Å; K248-L251 PolarHBondContact O-N 3.43Å; K248-L251 VanDerWaalsContact O-N 3.09Å; Q249-L251 VanDerWaalsContact C-N 3.26Å; Q249-L251 PolarHBondContact O-N 2.83Å
252	I	93.5	Very high	95.1	Very high	97 Å²	97	55.2 Å²	55.2	50%	0.497	28%	0.275	S	S	.	.	S	Bend	trans	-121.5	105.6	-177	-57	176	0	0	0	107.6	K248 Q249	K248-I252 HydrophobicContact CG-CD1 4.3Å; K248-I252 PolarHBondContact O-N 3.29Å; Q249-I252 VanDerWaalsContact CA-O 3.31Å; Q249-I252 WeakPolarHBondContact CA-O 3.13Å
253	P	94.7	Very high	95.4	Very high	11 Å²	11	53.2 Å²	53.2	7%	0.071	26%	0.264	C	S	.	.			trans	-61.6	128.6	-170.3	20.5	-28.1	0	0	0	111.1	F37 A94 V97 R98	F37-P253 HydrophobicContact CB-CB 4.36Å; F37-P253 HydrophobicContact CD1-CB 3.99Å; F37-P253 HydrophobicContact CD2-CB 3.82Å; F37-P253 HydrophobicContact CD2-CG 4.02Å; F37-P253 HydrophobicContact CE1-CB 4.23Å; F37-P253 HydrophobicContact CE1-CG 4.34Å; F37-P253 HydrophobicContact CE2-CB 4.05Å; F37-P253 HydrophobicContact CE2-CG 3.77Å; F37-P253 HydrophobicContact CG-CB 3.79Å; F37-P253 HydrophobicContact CG-CG 4.42Å; F37-P253 HydrophobicContact CZ-CB 4.26Å; F37-P253 HydrophobicContact CZ-CG 3.95Å; A94-P253 HydrophobicContact CB-CB 3.64Å; A94-P253 HydrophobicContact CB-CG 4.32Å; V97-P253 HydrophobicContact CB-CG 4.1Å; V97-P253 HydrophobicContact CG1-CG 3.71Å; R98-P253 HydrophobicContact CG-CB 4.5Å; R98-P253 HydrophobicContact CG-CG 3.98Å
254	P	95.8	Very high	95.7	Very high	16 Å²	16	59 Å²	59	10%	0.104	29%	0.291	C	S	.	.			trans	-71.9	-173.5	170.9	31.2	-33.6	0	0	0	111.2	R98 Q249 I258 L259	R98-P254 PolarHBondContact NH1-O 2.96Å; Q249-P254 HydrophobicContact CB-CG 4.1Å; Q249-P254 HydrophobicContact CG-CB 4.01Å; Q249-P254 HydrophobicContact CG-CG 3.9Å; P254-I258 HydrophobicContact CB-CB 3.94Å; P254-I258 HydrophobicContact CB-CD1 4.02Å; P254-I258 HydrophobicContact CB-CG2 3.76Å; P254-I258 HydrophobicContact CG-CB 4.12Å; P254-I258 HydrophobicContact CG-CG2 3.65Å; P254-L259 HydrophobicContact CG-CD2 3.73Å; P254-L259 HydrophobicContact CG-CG 3.96Å
255	S	97	Very high	96.1	Very high	52 Å²	52	59 Å²	59	36%	0.364	29%	0.288	S	S	.	.			trans	-62.1	159.5	174.1	60.1	0	0	0	0	111.8	E257 I258 L259	S255-E257 PolarHBondContact O-N 3.15Å; S255-I258 PolarHBondContact O-N 3.09Å; S255-I258 WeakPolarHBondContact OG-CG1 3.19Å; S255-L259 WeakPolarHBondContact O-CG 3.41Å; S255-L259 PolarHBondContact O-N 3.43Å
256	D	96.9	Very high	96.3	Very high	45 Å²	45	56.5 Å²	56.5	24%	0.241	28%	0.275	C	S	.	.	H	α-helix	trans	-62.5	-32.1	178.3	-68.5	-11.5	0	0	0	112.7	L91 R98 L259 R260	L91-D256 HydrophobicContact CD2-CB 4.43Å; R98-D256 IonicContact CZ-OD1 3.19Å; R98-D256 IonicContact NH1-OD1 2.83Å; R98-D256 PolarHBondContact NH1-OD1 2.73Å; R98-D256 VanDerWaalsContact NH2-CG 3.29Å; R98-D256 IonicContact NH2-OD1 3.55Å; R98-D256 PolarHBondContact NH2-OD1 3.37Å; R98-D256 IonicContact NH2-OD2 3.62Å; R98-D256 PolarHBondContact NH2-OD2 3.37Å; D256-L259 PolarHBondContact O-N 3.11Å; D256-R260 WeakPolarHBondContact O-CB 3.38Å; D256-R260 VanDerWaalsContact O-CG 3.25Å; D256-R260 WeakPolarHBondContact O-CG 2.89Å; D256-R260 PolarHBondContact O-N 2.9Å
257	E	97.6	Very high	96.4	Very high	141 Å²	141	57.7 Å²	57.7	66%	0.659	28%	0.281	S	S	*	.	H	α-helix	trans	-56.7	-53.7	173.1	-175.9	175.8	-163.5	0	0	111	S255 L259 R260 E261	S255-E257 PolarHBondContact O-N 3.15Å; E257-L259 VanDerWaalsContact C-N 3.32Å; E257-L259 PolarHBondContact O-N 3.27Å; E257-R260 PolarHBondContact O-N 2.6Å; E257-R260 VanDerWaalsContact O-N 3.16Å; E257-E261 WeakPolarHBondContact O-CG 3.43Å; E257-E261 PolarHBondContact O-N 2.84Å
258	I	97.3	Very high	96.7	Very high	52 Å²	52	59.7 Å²	59.7	27%	0.267	28%	0.284	S	S	.	.	H	α-helix	trans	-63.2	-39.2	178.2	-66	170.8	0	0	0	111.1	P254 S255 R260 E261 Y262	P254-I258 HydrophobicContact CB-CB 3.94Å; P254-I258 HydrophobicContact CB-CD1 4.02Å; P254-I258 HydrophobicContact CB-CG2 3.76Å; P254-I258 HydrophobicContact CG-CB 4.12Å; P254-I258 HydrophobicContact CG-CG2 3.65Å; S255-I258 PolarHBondContact O-N 3.09Å; S255-I258 WeakPolarHBondContact OG-CG1 3.19Å; I258-R260 VanDerWaalsContact C-N 3.32Å; I258-R260 PolarHBondContact O-N 3.18Å; I258-E261 WeakPolarHBondContact O-CB 3.43Å; I258-E261 PolarHBondContact O-N 3.45Å; I258-Y262 HydrophobicContact CG2-CD2 4.01Å; I258-Y262 HydrophobicContact CG2-CE2 3.62Å; I258-Y262 WeakPolarHBondContact O-CD2 3.25Å; I258-Y262 PolarHBondContact O-N 3.34Å; I258-Y262 VanDerWaalsContact O-N 3.07Å
259	L	98	Very high	96.9	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.7	-37.7	176.9	-74.9	-179.3	0	0	0	112.3	F37 L40 L91 A94 P254 S255 D256 E257 Y262 L263	F37-L259 HydrophobicContact CB-CD2 4.44Å; L40-L259 HydrophobicContact CD1-CB 3.59Å; L40-L259 HydrophobicContact CD1-CD1 4.38Å; L40-L259 HydrophobicContact CD1-CD2 4.1Å; L40-L259 HydrophobicContact CD1-CG 4.23Å; L91-L259 HydrophobicContact CD2-CB 3.71Å; L91-L259 HydrophobicContact CD2-CD1 4.1Å; A94-L259 HydrophobicContact CB-CD1 3.42Å; A94-L259 VanDerWaalsContact CB-CD1 3.42Å; P254-L259 HydrophobicContact CG-CD2 3.73Å; P254-L259 HydrophobicContact CG-CG 3.96Å; S255-L259 WeakPolarHBondContact O-CG 3.41Å; S255-L259 PolarHBondContact O-N 3.43Å; D256-L259 PolarHBondContact O-N 3.11Å; E257-L259 VanDerWaalsContact C-N 3.32Å; E257-L259 PolarHBondContact O-N 3.27Å; L259-Y262 PolarHBondContact O-N 2.97Å; L259-L263 PolarHBondContact O-N 3.42Å; L259-L263 VanDerWaalsContact O-N 3.16Å
260	R	98	Very high	97	Very high	108 Å²	108	53 Å²	53	41%	0.408	26%	0.255	S	S	.	.	H	α-helix	trans	-69.4	-37	174.1	-73	-179.6	-166.7	-56.5	-4.4	112.2	L91 D256 E257 I258 Y262 L263 E264	L91-R260 HydrophobicContact CD2-CG 4.38Å; D256-R260 WeakPolarHBondContact O-CB 3.38Å; D256-R260 VanDerWaalsContact O-CG 3.25Å; D256-R260 WeakPolarHBondContact O-CG 2.89Å; D256-R260 PolarHBondContact O-N 2.9Å; E257-R260 PolarHBondContact O-N 2.6Å; E257-R260 VanDerWaalsContact O-N 3.16Å; I258-R260 VanDerWaalsContact C-N 3.32Å; I258-R260 PolarHBondContact O-N 3.18Å; R260-Y262 VanDerWaalsContact C-N 3.28Å; R260-Y262 PolarHBondContact O-N 3.25Å; R260-L263 WeakPolarHBondContact O-CB 3.3Å; R260-L263 PolarHBondContact O-N 3.37Å; R260-L263 VanDerWaalsContact O-N 3.14Å; R260-E264 WeakPolarHBondContact O-CG 3.44Å; R260-E264 PolarHBondContact O-N 3.4Å
261	E	97.6	Very high	97.1	Very high	108 Å²	108	54.5 Å²	54.5	51%	0.505	26%	0.261	S	S	.	.	H	α-helix	trans	-58.8	-41	171.1	-69.9	175.3	-178.9	0	0	111.4	E257 I258 L263 E264 R265	E257-E261 WeakPolarHBondContact O-CG 3.43Å; E257-E261 PolarHBondContact O-N 2.84Å; I258-E261 WeakPolarHBondContact O-CB 3.43Å; I258-E261 PolarHBondContact O-N 3.45Å; E261-L263 PolarHBondContact O-N 3.17Å; E261-E264 PolarHBondContact O-N 3.24Å; E261-R265 WeakPolarHBondContact O-CB 3.26Å; E261-R265 PolarHBondContact O-N 2.9Å
262	Y	98.1	Very high	97.3	Very high	29 Å²	29	56.4 Å²	56.4	11%	0.114	27%	0.271	C	S	.	.	H	α-helix	trans	-62.5	-41.7	174.4	-79.3	-66.4	0	0	0	112.5	L38 Y41 R246 Q249 I258 L259 R260 R265 G266	L38-Y262 HydrophobicContact CD1-CE1 4.37Å; L38-Y262 HydrophobicContact CD2-CD1 4.32Å; L38-Y262 HydrophobicContact CD2-CD2 3.6Å; L38-Y262 HydrophobicContact CD2-CE1 4.16Å; L38-Y262 HydrophobicContact CD2-CE2 3.4Å; L38-Y262 VanDerWaalsContact CD2-CE2 3.4Å; L38-Y262 HydrophobicContact CD2-CG 4.07Å; Y41-Y262 WeakPolarHBondContact CA-O 3.5Å; Y41-Y262 HydrophobicContact CD2-CD1 4.45Å; R246-Y262 HydrophobicContact CG-CE1 4.15Å; R246-Y262 WeakPolarHBondContact CG-OH 3.47Å; Q249-Y262 VanDerWaalsContact OE1-CE2 3.32Å; Q249-Y262 PolarHBondContact OE1-OH 3.43Å; I258-Y262 HydrophobicContact CG2-CD2 4.01Å; I258-Y262 HydrophobicContact CG2-CE2 3.62Å; I258-Y262 WeakPolarHBondContact O-CD2 3.25Å; I258-Y262 PolarHBondContact O-N 3.34Å; I258-Y262 VanDerWaalsContact O-N 3.07Å; L259-Y262 PolarHBondContact O-N 2.97Å; R260-Y262 VanDerWaalsContact C-N 3.28Å; R260-Y262 PolarHBondContact O-N 3.25Å; Y262-R265 PolarHBondContact O-N 3.22Å; Y262-G266 PolarHBondContact O-N 3Å
263	L	98.3	Very high	97.5	Very high	27 Å²	27	52.4 Å²	52.4	14%	0.141	25%	0.25	C	C	.	.	H	α-helix	trans	-59	-51.1	175.6	179.1	65.7	0	0	0	111.4	L40 C43 G44 A87 L259 R260 E261 G266 F267	L40-L263 HydrophobicContact CB-CB 4.27Å; L40-L263 HydrophobicContact CD2-CB 4.32Å; L40-L263 HydrophobicContact CD2-CD1 4.14Å; L40-L263 HydrophobicContact CD2-CD2 4.42Å; L40-L263 WeakPolarHBondContact O-CA 3.13Å; L40-L263 VanDerWaalsContact O-CD1 3.31Å; L40-L263 WeakPolarHBondContact O-CD1 3.35Å; C43-L263 HydrophobicContact CB-CD1 3.78Å; G44-L263 VanDerWaalsContact CA-O 3.3Å; G44-L263 WeakPolarHBondContact CA-O 3.36Å; A87-L263 HydrophobicContact CB-CD1 4.19Å; A87-L263 HydrophobicContact CB-CD2 4.39Å; L259-L263 PolarHBondContact O-N 3.42Å; L259-L263 VanDerWaalsContact O-N 3.16Å; R260-L263 WeakPolarHBondContact O-CB 3.3Å; R260-L263 PolarHBondContact O-N 3.37Å; R260-L263 VanDerWaalsContact O-N 3.14Å; E261-L263 PolarHBondContact O-N 3.17Å; L263-G266 PolarHBondContact O-N 3.38Å; L263-F267 PolarHBondContact O-N 3.31Å
264	E	98.1	Very high	97.6	Very high	126 Å²	126	51.9 Å²	51.9	59%	0.589	25%	0.247	S	C	*	.	H	α-helix	trans	-63.8	-42.8	178.3	-70.2	178.4	-175.4	0	0	111.7	R260 E261 G266 F267 I268	R260-E264 WeakPolarHBondContact O-CG 3.44Å; R260-E264 PolarHBondContact O-N 3.4Å; E261-E264 PolarHBondContact O-N 3.24Å; E264-G266 VanDerWaalsContact C-N 3.34Å; E264-G266 PolarHBondContact O-N 2.96Å; E264-F267 WeakPolarHBondContact O-CB 3.25Å; E264-F267 PolarHBondContact O-N 3.16Å; E264-F267 VanDerWaalsContact O-N 3.16Å; E264-I268 WeakPolarHBondContact O-CG1 3.35Å; E264-I268 PolarHBondContact O-N 3.47Å
265	R	97.6	Very high	97.7	Very high	104 Å²	104	56.3 Å²	56.3	39%	0.392	26%	0.264	S	S	.	.	H	α-helix	trans	-62	-42.5	179.6	-173.9	69.5	-163.5	-153.6	7.1	111.9	Y41 E261 Y262 F267 I268 D269	Y41-R265 HydrophobicContact CD2-CB 4.4Å; Y41-R265 HydrophobicContact CD2-CG 4.42Å; Y41-R265 HydrophobicContact CE2-CB 4.3Å; Y41-R265 HydrophobicContact CE2-CG 3.9Å; E261-R265 WeakPolarHBondContact O-CB 3.26Å; E261-R265 PolarHBondContact O-N 2.9Å; Y262-R265 PolarHBondContact O-N 3.22Å; R265-F267 VanDerWaalsContact C-N 3.28Å; R265-F267 PolarHBondContact O-N 2.86Å; R265-I268 PolarHBondContact O-N 2.8Å; R265-D269 WeakPolarHBondContact CG-OD2 3.47Å; R265-D269 IonicContact CZ-OD1 2.74Å; R265-D269 VanDerWaalsContact CZ-OD1 3.24Å; R265-D269 IonicContact CZ-OD2 2.73Å; R265-D269 VanDerWaalsContact NE-CG 3.31Å; R265-D269 IonicContact NE-OD1 3.85Å; R265-D269 PolarHBondContact NE-OD1 3.09Å; R265-D269 IonicContact NE-OD2 3.97Å; R265-D269 PolarHBondContact NE-OD2 3.22Å; R265-D269 IonicContact NH2-OD1 3.77Å; R265-D269 PolarHBondContact NH2-OD1 3.43Å; R265-D269 IonicContact NH2-OD2 3.54Å; R265-D269 WeakPolarHBondContact O-CB 3.46Å; R265-D269 PolarHBondContact O-N 3.33Å
266	G	98.5	Very high	97.6	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.4	-39.3	175.5	0	0	0	0	0	112.7	Y41 A45 Y262 L263 E264 M270	Y41-G266 WeakPolarHBondContact O-CA 3.49Å; A45-G266 WeakPolarHBondContact CA-O 3.27Å; A45-G266 PolarHBondContact N-O 3.07Å; Y262-G266 PolarHBondContact O-N 3Å; L263-G266 PolarHBondContact O-N 3.38Å; E264-G266 VanDerWaalsContact C-N 3.34Å; E264-G266 PolarHBondContact O-N 2.96Å; G266-M270 WeakPolarHBondContact O-CB 3.31Å; G266-M270 PolarHBondContact O-N 2.74Å
267	F	98.4	Very high	97.5	Very high	47 Å²	47	60.7 Å²	60.7	21%	0.206	28%	0.275	C	S	.	.	H	α-helix	trans	-65.2	-47.4	174.4	-174.1	-81.2	0	0	0	111.8	G44 R47 C48 H52 L263 E264 R265 M270 M271	G44-F267 WeakPolarHBondContact O-CA 3.25Å; R47-F267 HydrophobicContact CB-CD2 4.3Å; R47-F267 HydrophobicContact CG-CD2 4.14Å; R47-F267 HydrophobicContact CG-CE2 4.14Å; C48-F267 HydrophobicContact CB-CD2 3.59Å; C48-F267 HydrophobicContact CB-CE2 3.82Å; C48-F267 HydrophobicContact CB-CG 3.97Å; C48-F267 HydrophobicContact CB-CZ 4.37Å; H52-F267 AromaticContact CD2-CZ 3.72Å; H52-F267 AromaticContact NE2-CZ 3.77Å; L263-F267 PolarHBondContact O-N 3.31Å; E264-F267 WeakPolarHBondContact O-CB 3.25Å; E264-F267 PolarHBondContact O-N 3.16Å; E264-F267 VanDerWaalsContact O-N 3.16Å; R265-F267 VanDerWaalsContact C-N 3.28Å; R265-F267 PolarHBondContact O-N 2.86Å; F267-M270 PolarHBondContact O-N 3.46Å; F267-M271 HydrophobicContact CD1-CE 4.06Å; F267-M271 HydrophobicContact CE1-CE 3.9Å; F267-M271 WeakPolarHBondContact O-CB 3.42Å; F267-M271 PolarHBondContact O-N 3.33Å
268	I	98	Very high	97.4	Very high	73 Å²	73	61.1 Å²	61.1	37%	0.374	28%	0.282	S	S	.	.	H	α-helix	trans	-64.7	-48.4	-178.2	-68.9	167.2	0	0	0	111.6	E264 R265 M270 M271 I272	E264-I268 WeakPolarHBondContact O-CG1 3.35Å; E264-I268 PolarHBondContact O-N 3.47Å; R265-I268 PolarHBondContact O-N 2.8Å; I268-M270 VanDerWaalsContact C-N 3.3Å; I268-M270 PolarHBondContact O-N 3.03Å; I268-M271 HydrophobicContact CG1-CE 4.38Å; I268-M271 WeakPolarHBondContact O-CB 3.44Å; I268-M271 PolarHBondContact O-N 3.36Å; I268-I272 HydrophobicContact CG2-CD1 3.81Å; I268-I272 HydrophobicContact CG2-CG1 4.44Å; I268-I272 WeakPolarHBondContact O-CG1 3.43Å; I268-I272 PolarHBondContact O-N 3.46Å
269	D	98	Very high	97.3	Very high	13 Å²	13	59.6 Å²	59.6	7%	0.07	28%	0.275	C	S	.	.	H	α-helix	trans	-63.5	-38.8	-178.6	-71.9	-25.2	0	0	0	110.9	Y41 V217 R265 I272 F273	Y41-D269 WeakPolarHBondContact CE2-OD2 3.42Å; Y41-D269 VanDerWaalsContact OH-CB 3.24Å; Y41-D269 WeakPolarHBondContact OH-CB 3.11Å; Y41-D269 PolarHBondContact OH-OD2 2.85Å; V217-D269 HydrophobicContact CG1-CB 3.78Å; R265-D269 WeakPolarHBondContact CG-OD2 3.47Å; R265-D269 IonicContact CZ-OD1 2.74Å; R265-D269 VanDerWaalsContact CZ-OD1 3.24Å; R265-D269 IonicContact CZ-OD2 2.73Å; R265-D269 VanDerWaalsContact NE-CG 3.31Å; R265-D269 IonicContact NE-OD1 3.85Å; R265-D269 PolarHBondContact NE-OD1 3.09Å; R265-D269 IonicContact NE-OD2 3.97Å; R265-D269 PolarHBondContact NE-OD2 3.22Å; R265-D269 IonicContact NH2-OD1 3.77Å; R265-D269 PolarHBondContact NH2-OD1 3.43Å; R265-D269 IonicContact NH2-OD2 3.54Å; R265-D269 WeakPolarHBondContact O-CB 3.46Å; R265-D269 PolarHBondContact O-N 3.33Å; D269-I272 PolarHBondContact O-N 2.95Å; D269-F273 WeakPolarHBondContact O-CB 3.28Å; D269-F273 PolarHBondContact O-N 3.44Å
270	M	98.3	Very high	97.2	Very high	0 Å²	0	62 Å²	62	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.7	-44.1	174.1	-179	58.3	76.8	0	0	111.8	A45 C48 M49 I207 V217 G266 F267 I268 I272 F273 L274	A45-M270 HydrophobicContact CB-CB 4.14Å; A45-M270 HydrophobicContact CB-CE 3.95Å; C48-M270 HydrophobicContact CB-CB 3.82Å; C48-M270 HydrophobicContact CB-CG 3.73Å; M49-M270 HydrophobicContact CG-CE 3.78Å; M49-M270 HydrophobicContact CG-CG 3.94Å; M49-M270 HydrophobicContact CG-SD 3.87Å; M49-M270 HydrophobicContact SD-CE 3.96Å; M49-M270 HydrophobicContact SD-CG 4.06Å; M49-M270 HydrophobicContact SD-SD 3.46Å; I207-M270 HydrophobicContact CD1-CE 4.12Å; I207-M270 HydrophobicContact CG1-CE 3.63Å; V217-M270 HydrophobicContact CB-CE 4.43Å; V217-M270 HydrophobicContact CG1-CB 4.28Å; V217-M270 HydrophobicContact CG1-CE 4.43Å; V217-M270 HydrophobicContact CG2-CE 3.81Å; V217-M270 HydrophobicContact CG2-SD 3.93Å; G266-M270 WeakPolarHBondContact O-CB 3.31Å; G266-M270 PolarHBondContact O-N 2.74Å; F267-M270 PolarHBondContact O-N 3.46Å; I268-M270 VanDerWaalsContact C-N 3.3Å; I268-M270 PolarHBondContact O-N 3.03Å; M270-I272 VanDerWaalsContact C-N 3.33Å; M270-I272 PolarHBondContact O-N 3.28Å; M270-F273 WeakPolarHBondContact O-CB 3.28Å; M270-F273 PolarHBondContact O-N 2.91Å; M270-F273 VanDerWaalsContact O-N 3.16Å; M270-F273 HydrophobicContact SD-CD1 3.94Å; M270-L274 HydrophobicContact CG-CD1 4.3Å; M270-L274 HydrophobicContact CG-CG 4.45Å; M270-L274 WeakPolarHBondContact O-CG 3.41Å; M270-L274 PolarHBondContact O-N 3.4Å; M270-L274 HydrophobicContact SD-CG 4.31Å
271	M	97.8	Very high	97.1	Very high	39 Å²	39	59.2 Å²	59.2	19%	0.192	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-43.1	175.8	168	172	37.8	0	0	111.9	C48 F267 I268 F273 L274 K275 F280	C48-M271 PolarHBondContact SG-N 2.96Å; C48-M271 VanDerWaalsContact SG-N 3.39Å; F267-M271 HydrophobicContact CD1-CE 4.06Å; F267-M271 HydrophobicContact CE1-CE 3.9Å; F267-M271 WeakPolarHBondContact O-CB 3.42Å; F267-M271 PolarHBondContact O-N 3.33Å; I268-M271 HydrophobicContact CG1-CE 4.38Å; I268-M271 WeakPolarHBondContact O-CB 3.44Å; I268-M271 PolarHBondContact O-N 3.36Å; M271-F273 VanDerWaalsContact C-N 3.32Å; M271-F273 PolarHBondContact O-N 2.92Å; M271-L274 PolarHBondContact O-N 2.68Å; M271-K275 HydrophobicContact CG-CD 4.22Å; M271-K275 WeakPolarHBondContact O-CB 3.48Å; M271-K275 WeakPolarHBondContact O-CG 3.29Å; M271-K275 PolarHBondContact O-N 2.94Å; M271-F280 HydrophobicContact CB-CE2 4.46Å; M271-F280 HydrophobicContact CG-CD2 4.13Å; M271-F280 HydrophobicContact CG-CE2 3.66Å; M271-F280 HydrophobicContact SD-CE2 4.05Å; M271-F280 HydrophobicContact SD-CZ 4.4Å
272	I	96.8	Very high	96.7	Very high	96 Å²	96	60.9 Å²	60.9	49%	0.492	28%	0.279	S	S	.	.	H	α-helix	trans	-60.6	-44.4	175.4	-69.4	167.1	0	0	0	110.1	I268 D269 M270 K275 K276	I268-I272 HydrophobicContact CG2-CD1 3.81Å; I268-I272 HydrophobicContact CG2-CG1 4.44Å; I268-I272 WeakPolarHBondContact O-CG1 3.43Å; I268-I272 PolarHBondContact O-N 3.46Å; D269-I272 PolarHBondContact O-N 2.95Å; M270-I272 VanDerWaalsContact C-N 3.33Å; M270-I272 PolarHBondContact O-N 3.28Å; I272-K275 PolarHBondContact O-N 2.83Å; I272-K276 VanDerWaalsContact O-CB 3.32Å; I272-K276 WeakPolarHBondContact O-CB 3.47Å; I272-K276 PolarHBondContact O-N 3.41Å
273	F	97.1	Very high	96	Very high	14 Å²	14	64.3 Å²	64.3	6%	0.061	30%	0.299	C	S	.	.	H	α-helix	trans	-61.9	-44.7	177.6	171.4	-101.3	0	0	0	112.8	I22 I205 D216 V217 D269 M270 M271 K276 N277	I22-F273 HydrophobicContact CD1-CD1 4.49Å; I22-F273 HydrophobicContact CD1-CE1 3.5Å; I22-F273 HydrophobicContact CD1-CZ 3.79Å; I22-F273 HydrophobicContact CG1-CE1 4.4Å; I22-F273 HydrophobicContact CG1-CZ 4.23Å; I22-F273 HydrophobicContact CG2-CZ 4.2Å; I205-F273 HydrophobicContact CD1-CE1 4.37Å; I205-F273 HydrophobicContact CG1-CE1 4.22Å; I205-F273 HydrophobicContact CG1-CZ 4.29Å; I205-F273 HydrophobicContact CG2-CD1 4.47Å; I205-F273 HydrophobicContact CG2-CE1 3.69Å; I205-F273 HydrophobicContact CG2-CZ 4.06Å; D216-F273 HydrophobicContact CB-CD2 3.99Å; D216-F273 HydrophobicContact CB-CE2 3.55Å; D216-F273 HydrophobicContact CB-CZ 4.01Å; V217-F273 HydrophobicContact CG2-CB 3.69Å; V217-F273 HydrophobicContact CG2-CD1 3.8Å; V217-F273 HydrophobicContact CG2-CD2 4.19Å; V217-F273 HydrophobicContact CG2-CE1 4.49Å; V217-F273 HydrophobicContact CG2-CG 3.62Å; D269-F273 WeakPolarHBondContact O-CB 3.28Å; D269-F273 PolarHBondContact O-N 3.44Å; M270-F273 WeakPolarHBondContact O-CB 3.28Å; M270-F273 PolarHBondContact O-N 2.91Å; M270-F273 VanDerWaalsContact O-N 3.16Å; M270-F273 HydrophobicContact SD-CD1 3.94Å; M271-F273 VanDerWaalsContact C-N 3.32Å; M271-F273 PolarHBondContact O-N 2.92Å; F273-K276 PolarHBondContact O-N 3.47Å; F273-N277 WeakPolarHBondContact CD2-ND2 3.41Å; F273-N277 WeakPolarHBondContact CE2-ND2 3.3Å; F273-N277 PolarHBondContact O-N 2.98Å; F273-N277 PolarHBondContact O-ND2 3.38Å
274	L	97.5	Very high	94.5	Very high	0 Å²	0	72.8 Å²	72.8	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-61.7	-44.4	176.4	-68.8	174.1	0	0	0	111.6	M49 H52 V56 M270 M271 N277 D278 V279 F280	M49-L274 HydrophobicContact SD-CD1 4.32Å; M49-L274 HydrophobicContact SD-CD2 3.93Å; M49-L274 HydrophobicContact SD-CG 4.46Å; H52-L274 HydrophobicContact CB-CD1 4.12Å; V56-L274 HydrophobicContact CG2-CD2 4.2Å; M270-L274 HydrophobicContact CG-CD1 4.3Å; M270-L274 HydrophobicContact CG-CG 4.45Å; M270-L274 WeakPolarHBondContact O-CG 3.41Å; M270-L274 PolarHBondContact O-N 3.4Å; M270-L274 HydrophobicContact SD-CG 4.31Å; M271-L274 PolarHBondContact O-N 2.68Å; L274-N277 PolarHBondContact O-N 2.93Å; L274-D278 PolarHBondContact O-N 2.78Å; L274-V279 HydrophobicContact CB-CG2 4.48Å; L274-V279 HydrophobicContact CD2-CG2 3.86Å; L274-V279 PolarHBondContact O-N 3.31Å; L274-V279 VanDerWaalsContact O-N 3.1Å; L274-F280 HydrophobicContact CB-CB 4.1Å; L274-F280 HydrophobicContact CB-CD2 4.23Å
275	K	96.5	Very high	92.8	Very high	109 Å²	109	70.7 Å²	70.7	47%	0.474	35%	0.35	S	S	.	.	H	α-helix	trans	-63.2	-43.9	176.4	-74.3	178.4	177.8	177.5	0	112.1	M271 I272 N277 D278 F280	M271-K275 HydrophobicContact CG-CD 4.22Å; M271-K275 WeakPolarHBondContact O-CB 3.48Å; M271-K275 WeakPolarHBondContact O-CG 3.29Å; M271-K275 PolarHBondContact O-N 2.94Å; I272-K275 PolarHBondContact O-N 2.83Å; K275-N277 PolarHBondContact O-N 3.05Å; K275-D278 PolarHBondContact O-N 3.21Å; K275-D278 VanDerWaalsContact O-N 3.12Å; K275-F280 HydrophobicContact CB-CB 4.48Å; K275-F280 HydrophobicContact CG-CB 3.7Å; K275-F280 HydrophobicContact CG-CD1 4.26Å; K275-F280 HydrophobicContact CG-CD2 3.87Å; K275-F280 HydrophobicContact CG-CG 3.67Å
276	K	95.2	Very high	91.1	Very high	173 Å²	173	68.8 Å²	68.8	75%	0.752	35%	0.352	S	S	*	.	H	α-helix	trans	-61.6	-24.7	177.6	-178.5	179.9	175.3	-174.2	0	113	I272 F273	I272-K276 VanDerWaalsContact O-CB 3.32Å; I272-K276 WeakPolarHBondContact O-CB 3.47Å; I272-K276 PolarHBondContact O-N 3.41Å; F273-K276 PolarHBondContact O-N 3.47Å
277	N	95.4	Very high	88.6	Confident	16 Å²	16	77.6 Å²	77.6	9%	0.086	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	8.1	179.3	-77.1	-88.3	0	0	0	113.5	S21 I22 F273 L274 K275 V279	S21-N277 WeakPolarHBondContact CA-OD1 3.22Å; I22-N277 HydrophobicContact CD1-CB 4.22Å; I22-N277 HydrophobicContact CG1-CB 3.6Å; I22-N277 PolarHBondContact N-OD1 3.36Å; F273-N277 WeakPolarHBondContact CD2-ND2 3.41Å; F273-N277 WeakPolarHBondContact CE2-ND2 3.3Å; F273-N277 PolarHBondContact O-N 2.98Å; F273-N277 PolarHBondContact O-ND2 3.38Å; L274-N277 PolarHBondContact O-N 2.93Å; K275-N277 PolarHBondContact O-N 3.05Å; N277-V279 HydrophobicContact CB-CG2 3.89Å; N277-V279 PolarHBondContact O-N 3.08Å
278	D	94.8	Very high	86.2	Confident	150 Å²	150	84 Å²	84	80%	0.802	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.6	34.5	-179.5	-55.6	-52.8	0	0	0	113.8	L274 K275	L274-D278 PolarHBondContact O-N 2.78Å; K275-D278 PolarHBondContact O-N 3.21Å; K275-D278 VanDerWaalsContact O-N 3.12Å
279	V	95.4	Very high	85.6	Confident	19 Å²	19	84.6 Å²	84.6	12%	0.115	44%	0.439	C	S	.	.			trans	-125.8	17.7	-179.7	-66	0	0	0	0	112.7	I22 A23 V56 L274 N277	I22-V279 HydrophobicContact CD1-CG2 3.71Å; I22-V279 HydrophobicContact CG1-CG2 4.06Å; A23-V279 HydrophobicContact CB-CG1 4.48Å; V56-V279 HydrophobicContact CG2-CB 3.81Å; V56-V279 HydrophobicContact CG2-CG1 4.45Å; V56-V279 HydrophobicContact CG2-CG2 3.78Å; L274-V279 HydrophobicContact CB-CG2 4.48Å; L274-V279 HydrophobicContact CD2-CG2 3.86Å; L274-V279 PolarHBondContact O-N 3.31Å; L274-V279 VanDerWaalsContact O-N 3.1Å; N277-V279 HydrophobicContact CB-CG2 3.89Å; N277-V279 PolarHBondContact O-N 3.08Å
280	F	96.6	Very high	85	Confident	52 Å²	52	88.4 Å²	88.4	23%	0.228	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-78.5	122.8	176.8	178.3	-91.5	0	0	0	111.2	H52 M271 L274 K275 R282	H52-F280 HydrophobicContact CB-CD2 3.83Å; H52-F280 HydrophobicContact CB-CE2 3.55Å; H52-F280 HydrophobicContact CB-CZ 4.23Å; H52-F280 AromaticContact CD2-CE2 3.9Å; H52-F280 AromaticContact CE1-CZ 3.79Å; H52-F280 AromaticContact CG-CE2 3.42Å; H52-F280 VanDerWaalsContact CG-CE2 3.42Å; H52-F280 AromaticContact CG-CZ 3.76Å; H52-F280 AromaticContact ND1-CE2 3.64Å; H52-F280 AromaticContact ND1-CZ 3.44Å; H52-F280 WeakPolarHBondContact ND1-CZ 3.48Å; M271-F280 HydrophobicContact CB-CE2 4.46Å; M271-F280 HydrophobicContact CG-CD2 4.13Å; M271-F280 HydrophobicContact CG-CE2 3.66Å; M271-F280 HydrophobicContact SD-CE2 4.05Å; M271-F280 HydrophobicContact SD-CZ 4.4Å; L274-F280 HydrophobicContact CB-CB 4.1Å; L274-F280 HydrophobicContact CB-CD2 4.23Å; K275-F280 HydrophobicContact CB-CB 4.48Å; K275-F280 HydrophobicContact CG-CB 3.7Å; K275-F280 HydrophobicContact CG-CD1 4.26Å; K275-F280 HydrophobicContact CG-CD2 3.87Å; K275-F280 HydrophobicContact CG-CG 3.67Å; F280-R282 HydrophobicContact CD1-CG 4.32Å; F280-R282 HydrophobicContact CE1-CG 3.95Å
281	E	95.1	Very high	84.3	Confident	49 Å²	49	93.3 Å²	93.3	23%	0.229	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-94.4	123.7	176.2	-67	161.3	-170.7	0	0	110.3	H52 S54 S55	H52-E281 PolarHBondContact ND1-O 3.22Å; H52-E281 WeakPolarHBondContact O-CB 3.17Å; H52-E281 PolarHBondContact O-N 2.91Å; S54-E281 WeakPolarHBondContact CB-OE2 3.41Å; S54-E281 PolarHBondContact N-OE2 2.65Å; S54-E281 PolarHBondContact OG-OE2 3.02Å; S55-E281 WeakPolarHBondContact CA-OE1 3.19Å; S55-E281 WeakPolarHBondContact CB-OE1 3.41Å; S55-E281 PolarHBondContact N-OE1 3.23Å; S55-E281 PolarHBondContact OG-OE1 3.35Å
282	R	89.3	Confident	83.5	Confident	142 Å²	142	96.5 Å²	96.5	54%	0.536	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-75.6	147.2	171.6	-70.2	-174.9	-176.3	-154.8	6	109.6	F280 E287 V288	F280-R282 HydrophobicContact CD1-CG 4.32Å; F280-R282 HydrophobicContact CE1-CG 3.95Å; R282-E287 PolarHBondContact NH1-O 3.05Å; R282-V288 VanDerWaalsContact NH1-CA 3.33Å; R282-V288 PolarHBondContact NH1-OXT 3.43Å; R282-V288 PolarHBondContact NH2-OXT 3.34Å
283	L	84.3	Confident	82.6	Confident	102 Å²	102	96.5 Å²	96.5	53%	0.534	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-61.8	139.1	170.6	-71.4	172.4	0	0	0	109.4	V51 G285 S286	V51-L283 HydrophobicContact CG1-CD2 3.66Å; V51-L283 HydrophobicContact CG1-CG 4.28Å; L283-G285 PolarHBondContact O-N 3.24Å; L283-G285 VanDerWaalsContact O-N 3.13Å; L283-S286 PolarHBondContact O-N 2.97Å; L283-S286 VanDerWaalsContact O-N 3.14Å; L283-S286 PolarHBondContact O-OG 3.1Å
284	E	66.5	Low	81.7	Confident	205 Å²	205	102 Å²	102	96%	0.958	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.7	122.2	172.1	-70.5	-173.3	166.3	0	0	109.5
285	G	60.8	Low	80.5	Confident	82 Å²	82	109.3 Å²	109.3	85%	0.845	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.5	1.8	179.2	0	0	0	0	0	116.8	L283	L283-G285 PolarHBondContact O-N 3.24Å; L283-G285 VanDerWaalsContact O-N 3.13Å
286	S	62.6	Low	79.3	Confident	63 Å²	63	109.3 Å²	109.3	44%	0.441	58%	0.577	S	S	.	*			trans	-76.3	127.5	168.4	66.7	0	0	0	0	110.9	L283	L283-S286 PolarHBondContact O-N 2.97Å; L283-S286 VanDerWaalsContact O-N 3.14Å; L283-S286 PolarHBondContact O-OG 3.1Å
287	E	46.6	Very low	78	Confident	185 Å²	185	104 Å²	104	86%	0.864	56%	0.562	S	S	*	*			trans	-60.2	157.5	177.7	-65.7	-172.5	162.4	0	0	112.8	R282	R282-E287 PolarHBondContact NH1-O 3.05Å
288	V	48.1	Very low	76.4	Confident	183 Å²	183	112 Å²	112	100%	1.109	61%	0.606	S	S	*	*			trans	-64.1	0	-175.7	176.5	0	0	0	0	112.1	R282	R282-V288 VanDerWaalsContact NH1-CA 3.33Å; R282-V288 PolarHBondContact NH1-OXT 3.43Å; R282-V288 PolarHBondContact NH2-OXT 3.34Å

Retrieved 288 of 288 residues in 515.8 ms (Link to these results)

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