A0A087Y7L6_POEFO Loading...

Phosphatidylinositol N-acetylglucosaminyltransferase subunit A

Catalytic subunit of the glycosylphosphatidylinositol-N-acetylglucosaminyltransferase (GPI-GnT) complex that catalyzes the transfer of N-acetylglucosamine from UDP-N-acetylglucosamine to phosphatidylinositol and participates in the first step of GPI biosynthesis.

AlphaFold DB , UniProt , Accession A0A087Y7L6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 475 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.5	Very low	28.6	Very low	251 Å²	251	168.2 Å²	168.2	100%	1.236	88%	0.884	S	S	*	*				0	97.6	0	-78.9	156.9	86.1	0	0	108.2
2	G	29.1	Very low	28.5	Very low	77 Å²	77	165.3 Å²	165.3	79%	0.794	88%	0.879	S	S	*	*			trans	-133.9	133.9	174.2	0	0	0	0	0	108.5
3	Q	27.7	Very low	28.5	Very low	202 Å²	202	162.2 Å²	162.2	94%	0.944	87%	0.873	S	S	*	*			trans	-149.1	131.9	165.3	-108.4	-179.9	10.1	0	0	110.8
4	R	29.3	Very low	28.1	Very low	235 Å²	235	157.9 Å²	157.9	89%	0.887	86%	0.862	S	S	*	*			trans	-67.3	160.7	172.7	-71.5	166	156.7	174.6	-7.5	112.6
5	R	30	Very low	28.6	Very low	222 Å²	222	154.9 Å²	154.9	84%	0.838	86%	0.857	S	S	*	*			trans	152.7	146.2	132.8	-85	172.4	172.4	-177	0.2	108.4
6	K	28.6	Very low	28.4	Very low	181 Å²	181	155.7 Å²	155.7	79%	0.787	85%	0.853	S	S	*	*			cis	-163.2	148.2	8.8	-124.4	172.5	-178.3	-170.8	0	108
7	V	30.2	Very low	28.5	Very low	144 Å²	144	154.6 Å²	154.6	87%	0.873	85%	0.852	S	S	*	*			trans	-76.1	143.6	168.1	173.5	0	0	0	0	109.6
8	G	24.8	Very low	28.4	Very low	77 Å²	77	155.7 Å²	155.7	79%	0.794	85%	0.85	S	S	*	*			trans	-133.5	124.5	167.4	0	0	0	0	0	110.2
9	S	25	Very low	28.4	Very low	112 Å²	112	153.5 Å²	153.5	78%	0.783	85%	0.847	S	S	*	*			trans	-89.8	151.2	-171.5	54.9	0	0	0	0	114.1
10	M	26	Very low	28.4	Very low	179 Å²	179	149.3 Å²	149.3	88%	0.882	84%	0.841	S	S	*	*			trans	2.7	133.3	151.9	-71	170.5	174.2	0	0	119.9
11	N	24.1	Very low	28.4	Very low	170 Å²	170	149.3 Å²	149.3	91%	0.909	84%	0.839	S	S	*	*			trans	-141.3	118.6	137.7	-90.7	-19.5	0	0	0	108.5
12	T	27.8	Very low	28.1	Very low	134 Å²	134	141.4 Å²	141.4	82%	0.822	81%	0.813	S	S	*	*			trans	-95.9	145.6	154.5	35.7	0	0	0	0	107.2
13	P	28.4	Very low	28.3	Very low	124 Å²	124	142.2 Å²	142.2	81%	0.805	81%	0.807	S	S	*	*				-143.9	178.5	75.1	38.3	-18.1	0	0	0	110.8
14	S	23.1	Very low	28.7	Very low	103 Å²	103	141.2 Å²	141.2	72%	0.72	80%	0.799	S	S	*	*			cis	-162.2	148.6	22.1	39.7	0	0	0	0	107.6	Q16	S14-Q16 PolarHBondContact O-N 3.34Å
15	S	35.5	Very low	29.4	Very low	112 Å²	112	136 Å²	136	78%	0.783	79%	0.793	S	S	*	*			trans	-54.4	119.3	170.2	52.2	0	0	0	0	113.1
16	Q	25.3	Very low	30.4	Very low	168 Å²	168	133.6 Å²	133.6	79%	0.785	79%	0.791	S	S	*	*			trans	-127.8	101.7	149	-75.6	-171.7	-9.1	0	0	107.8	S14 E18	S14-Q16 PolarHBondContact O-N 3.34Å; Q16-E18 VanDerWaalsContact C-N 3.32Å; Q16-E18 PolarHBondContact O-N 2.59Å
17	T	30.2	Very low	32.2	Very low	137 Å²	137	126.4 Å²	126.4	84%	0.84	76%	0.764	S	S	*	*			trans	-63.8	91.6	161.4	36.4	0	0	0	0	108.4	S19	T17-S19 VanDerWaalsContact C-N 3.35Å; T17-S19 PolarHBondContact O-N 3.22Å
18	E	26.9	Very low	34.7	Very low	174 Å²	174	125.6 Å²	125.6	81%	0.813	75%	0.745	S	S	*	*			trans	-80.4	93	156.1	-76.4	-169.6	161.2	0	0	107.5	Q16 G20	Q16-E18 VanDerWaalsContact C-N 3.32Å; Q16-E18 PolarHBondContact O-N 2.59Å; E18-G20 PolarHBondContact O-N 3.28Å
19	S	28.6	Very low	37.9	Very low	114 Å²	114	127.5 Å²	127.5	80%	0.797	73%	0.732	S	S	*	*			trans	-61.9	84.6	158.2	52.6	0	0	0	0	107.9	T17 D21	T17-S19 VanDerWaalsContact C-N 3.35Å; T17-S19 PolarHBondContact O-N 3.22Å; S19-D21 PolarHBondContact O-N 3.32Å
20	G	27.4	Very low	41.1	Very low	70 Å²	70	122.2 Å²	122.2	72%	0.722	69%	0.694	S	S	*	*			trans	-62.8	101	167.4	0	0	0	0	0	108.2	E18 A22	E18-G20 PolarHBondContact O-N 3.28Å; G20-A22 PolarHBondContact O-N 3.16Å
21	D	28	Very low	44.5	Very low	149 Å²	149	115.6 Å²	115.6	80%	0.797	66%	0.662	S	S	*	*			trans	-46.6	111.5	166.1	-170	14.9	0	0	0	107.5	S19 S23	S19-D21 PolarHBondContact O-N 3.32Å; D21-S23 PolarHBondContact O-N 3.48Å
22	A	33.1	Very low	47.9	Very low	85 Å²	85	107.5 Å²	107.5	70%	0.702	62%	0.619	S	S	*	*			trans	-63.8	90.9	174.3	0	0	0	0	0	106	G20 K24	G20-A22 PolarHBondContact O-N 3.16Å; A22-K24 PolarHBondContact O-N 3.19Å
23	S	34.5	Very low	51.3	Low	94 Å²	94	101.1 Å²	101.1	66%	0.657	58%	0.58	S	S	*	*			trans	-48.7	110.6	177.3	55.1	0	0	0	0	107	D21 V25	D21-S23 PolarHBondContact O-N 3.48Å; S23-V25 PolarHBondContact O-N 2.98Å
24	K	36.3	Very low	54.6	Low	182 Å²	182	95.2 Å²	95.2	79%	0.791	54%	0.542	S	S	*	.			trans	-58.4	96.4	166.2	-79.8	174.3	177.7	170.1	0	104.7	A22 H26	A22-K24 PolarHBondContact O-N 3.19Å; K24-H26 PolarHBondContact O-N 3.23Å
25	V	44.1	Very low	58.1	Low	125 Å²	125	90.3 Å²	90.3	76%	0.758	51%	0.508	S	S	*	.			trans	-57.9	99.3	167.4	178.2	0	0	0	0	104.2	S23 S27	S23-V25 PolarHBondContact O-N 2.98Å; V25-S27 VanDerWaalsContact C-N 3.29Å; V25-S27 PolarHBondContact O-N 3.19Å
26	H	51.6	Low	60.9	Low	172 Å²	172	85 Å²	85	80%	0.796	47%	0.471	S	S	*	.			trans	-63.3	100.5	174.7	-85.9	-69.1	0	0	0	105.8	K24 R28	K24-H26 PolarHBondContact O-N 3.23Å; H26-R28 PolarHBondContact O-N 2.95Å
27	S	64.7	Low	64	Low	30 Å²	30	77 Å²	77	21%	0.21	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-52.9	126.1	176	162.5	0	0	0	0	108.9	V25 K29 E393	V25-S27 VanDerWaalsContact C-N 3.29Å; V25-S27 PolarHBondContact O-N 3.19Å; S27-K29 PolarHBondContact O-N 3.22Å; S27-E393 PolarHBondContact OG-OE1 3.08Å
28	R	83.6	Confident	66.9	Low	127 Å²	127	72 Å²	72	48%	0.479	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-60.8	130.8	-178.9	-180	174.4	176.5	-179.9	-3.3	108.5	H26 H30 H62 A400	H26-R28 PolarHBondContact O-N 2.95Å; R28-H30 PolarHBondContact O-CD2 3.37Å; R28-H30 PolarHBondContact O-NE2 3.35Å; R28-H62 PolarHBondContact O-CE1 3.21Å; R28-A400 VanDerWaalsContact NH1-CB 3.26Å; R28-A400 PolarHBondContact NH1-O 3.02Å
29	K	90.9	Very high	70	Confident	117 Å²	117	63.7 Å²	63.7	51%	0.509	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-79.7	137.9	172.9	-58.1	-51	179.9	-165.1	0	109.4	S27 K60	S27-K29 PolarHBondContact O-N 3.22Å; K29-K60 PolarHBondContact NZ-O 3.33Å
30	H	94.1	Very high	72.9	Confident	1 Å²	1	60 Å²	60	1%	0.005	33%	0.33	C	S	.	.			trans	-123.9	147.6	-173.2	-63.9	-72.3	0	0	0	109.1	R28 I32 H62 K63 D397	R28-H30 PolarHBondContact O-CD2 3.37Å; R28-H30 PolarHBondContact O-NE2 3.35Å; H30-I32 HydrophobicContact CB-CD1 4.05Å; H30-I32 HydrophobicContact CB-CG1 3.84Å; H30-H62 AromaticContact CD2-CE1 3.74Å; H30-H62 AromaticContact CD2-ND1 3.76Å; H30-H62 PolarHBondContact N-ND1 3.1Å; H30-K63 PolarHBondContact O-N 2.95Å; H30-D397 IonicContact CD2-OD1 2.57Å; H30-D397 IonicContact CE1-OD1 3.02Å; H30-D397 IonicContact NE2-OD1 3.33Å; H30-D397 PolarHBondContact NE2-OD1 3.24Å
31	N	95.6	Very high	75.6	Confident	39 Å²	39	59.1 Å²	59.1	21%	0.209	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	106.3	171.6	-63.5	-14	0	0	0	107.5	K63 R118 I119 T120 V121	N31-K63 WeakPolarHBondContact CA-O 3.42Å; N31-K63 HydrophobicContact CB-CB 4.45Å; N31-K63 HydrophobicContact CB-CD 4.38Å; N31-K63 WeakPolarHBondContact OD1-CB 3.2Å; N31-R118 WeakPolarHBondContact CB-O 3.39Å; N31-R118 PolarHBondContact ND2-O 3.35Å; N31-I119 HydrophobicContact CB-CD1 4.47Å; N31-I119 WeakPolarHBondContact O-CA 3.45Å; N31-T120 HydrophobicContact CB-CG2 4.46Å; N31-T120 PolarHBondContact N-OG1 2.75Å; N31-T120 VanDerWaalsContact N-OG1 3.12Å; N31-T120 PolarHBondContact O-N 3.27Å; N31-T120 PolarHBondContact O-OG1 3.15Å; N31-V121 PolarHBondContact O-N 3.25Å; N31-V121 VanDerWaalsContact O-N 3.14Å
32	I	97.3	Very high	78.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.8	-166	-57.1	154.6	0	0	0	109.1	H30 M34 L57 H62 K63 V64 V65 V121 H123 Y396	H30-I32 HydrophobicContact CB-CD1 4.05Å; H30-I32 HydrophobicContact CB-CG1 3.84Å; I32-M34 HydrophobicContact CG2-CE 3.92Å; I32-M34 HydrophobicContact CG2-CG 4.49Å; I32-M34 HydrophobicContact CG2-SD 3.84Å; I32-L57 HydrophobicContact CD1-CD1 4.28Å; I32-H62 HydrophobicContact CD1-CB 3.97Å; I32-K63 PolarHBondContact N-O 2.9Å; I32-V64 HydrophobicContact CD1-CG2 4.34Å; I32-V64 WeakPolarHBondContact O-CA 3.46Å; I32-V65 PolarHBondContact O-N 3.48Å; I32-V121 WeakPolarHBondContact CA-O 3.41Å; I32-V121 HydrophobicContact CG1-CB 4.4Å; I32-H123 HydrophobicContact CG2-CB 4.16Å; I32-Y396 HydrophobicContact CD1-CD2 3.69Å; I32-Y396 HydrophobicContact CD1-CE2 3.39Å; I32-Y396 HydrophobicContact CG1-CD2 4.4Å; I32-Y396 HydrophobicContact CG1-CE2 4.18Å
33	C	98	Very high	80.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	110.2	167.1	-170.5	0	0	0	0	109	V65 F114 I119 V121 H123	C33-V65 CarbonylContact C-O 3.6Å; C33-V65 WeakPolarHBondContact CA-O 3.38Å; C33-V65 HydrophobicContact CB-CG2 4Å; C33-F114 HydrophobicContact CB-CD1 4.31Å; C33-F114 HydrophobicContact CB-CE1 4.1Å; C33-I119 HydrophobicContact CB-CD1 3.84Å; C33-I119 HydrophobicContact CB-CG1 3.91Å; C33-I119 HydrophobicContact CB-CG2 3.82Å; C33-V121 PolarHBondContact N-O 2.97Å; C33-H123 PolarHBondContact O-N 3.31Å
34	M	98.1	Very high	82.3	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	126.7	170.1	-53.9	-63.8	-168.9	0	0	108.7	I32 I50 L53 L57 V64 V65 I66 A67 H123 H125	I32-M34 HydrophobicContact CG2-CE 3.92Å; I32-M34 HydrophobicContact CG2-CG 4.49Å; I32-M34 HydrophobicContact CG2-SD 3.84Å; M34-I50 HydrophobicContact CB-CG2 3.96Å; M34-I50 HydrophobicContact CG-CG2 4.38Å; M34-L53 HydrophobicContact CE-CD2 4.26Å; M34-L53 HydrophobicContact CE-CG 4.25Å; M34-L57 HydrophobicContact CE-CD1 3.33Å; M34-V64 HydrophobicContact CE-CG1 4.08Å; M34-V64 HydrophobicContact CG-CG1 3.84Å; M34-V65 PolarHBondContact N-O 2.82Å; M34-I66 HydrophobicContact CB-CG1 4.16Å; M34-I66 CarbonylContact O-C 3.51Å; M34-I66 VanDerWaalsContact O-CA 3.3Å; M34-I66 WeakPolarHBondContact O-CA 3.38Å; M34-A67 PolarHBondContact O-N 2.62Å; M34-H123 CarbonylContact C-O 3.56Å; M34-H123 VanDerWaalsContact CA-O 3.3Å; M34-H123 WeakPolarHBondContact CA-O 3.31Å; M34-H123 HydrophobicContact SD-CB 3.68Å; M34-H123 PolarHBondContact SD-ND1 2.91Å; M34-H123 VanDerWaalsContact SD-ND1 3.39Å; M34-H125 VanDerWaalsContact SD-CE1 3.55Å
35	V	97	Very high	84.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	126.1	-176.9	-169.3	0	0	0	0	111	A67 V122 H123 A124 H125 M131 A135	V35-A67 HydrophobicContact CG2-CB 4.34Å; V35-V122 HydrophobicContact CG2-CG1 3.88Å; V35-H123 PolarHBondContact N-O 3.43Å; V35-A124 WeakPolarHBondContact O-CA 3.36Å; V35-H125 PolarHBondContact O-N 3.31Å; V35-M131 HydrophobicContact CG1-CE 3.89Å; V35-M131 HydrophobicContact CG1-CG 3.86Å; V35-M131 HydrophobicContact CG1-SD 4.43Å; V35-A135 HydrophobicContact CB-CB 4.04Å; V35-A135 HydrophobicContact CG1-CB 3.64Å; V35-A135 HydrophobicContact CG2-CB 3.94Å
36	S	94.4	Very high	86.6	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.007	22%	0.215	C	C	.	.			trans	-160.5	149	168.2	-158.5	0	0	0	0	111.2	F38 A67 T68 H125	S36-F38 PolarHBondContact O-N 2.86Å; S36-F38 PolarHBondContact OG-N 2.98Å; S36-A67 PolarHBondContact N-O 2.89Å; S36-T68 WeakPolarHBondContact O-CA 3.3Å; S36-T68 WeakPolarHBondContact O-CB 3.24Å; S36-T68 PolarHBondContact O-OG1 3.5Å; S36-H125 PolarHBondContact OG-O 3.26Å; S36-H125 VanDerWaalsContact OG-O 3.06Å
37	D	90.6	Very high	88.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	-61.7	-33.9	165.1	-74.8	-79.6	0	0	0	111	F39 T68 H69 Y71 Q97 T99 S129 A130 M131	D37-F39 PolarHBondContact O-N 3.46Å; D37-T68 PolarHBondContact O-OG1 3.16Å; D37-H69 PolarHBondContact O-CD2 3.4Å; D37-H69 VanDerWaalsContact O-CD2 3.27Å; D37-H69 PolarHBondContact O-NE2 3.03Å; D37-H69 IonicContact OD1-CD2 2.66Å; D37-Y71 PolarHBondContact O-OH 3.17Å; D37-Q97 WeakPolarHBondContact CB-O 3.38Å; D37-T99 WeakPolarHBondContact OD1-CG2 3.44Å; D37-T99 PolarHBondContact OD1-N 3.33Å; D37-T99 PolarHBondContact OD1-OG1 2.95Å; D37-S129 PolarHBondContact N-OG 3.06Å; D37-S129 WeakPolarHBondContact OD2-CA 3.43Å; D37-S129 VanDerWaalsContact OD2-CB 3.25Å; D37-S129 WeakPolarHBondContact OD2-CB 3.44Å; D37-S129 PolarHBondContact OD2-OG 2.86Å; D37-A130 PolarHBondContact OD2-N 3.49Å; D37-M131 VanDerWaalsContact OD2-CB 3.27Å; D37-M131 WeakPolarHBondContact OD2-CB 3.21Å; D37-M131 PolarHBondContact OD2-N 2.88Å
38	F	90.1	Very high	89.6	Confident	30 Å²	30	33 Å²	33	13%	0.132	18%	0.175	C	C	.	.			trans	-92.9	106.9	-175.1	-46.8	-61.5	0	0	0	110.3	S36 E47 F128	S36-F38 PolarHBondContact O-N 2.86Å; S36-F38 PolarHBondContact OG-N 2.98Å; F38-E47 HydrophobicContact CB-CG 4.19Å; F38-F128 HydrophobicContact CE2-CB 3.87Å; F38-F128 HydrophobicContact CZ-CB 4.02Å
39	F	92.6	Very high	90	Very high	1 Å²	1	27.2 Å²	27.2	0%	0.004	15%	0.154	C	C	.	.			trans	-154.4	177.9	171.5	-160.9	-115.7	0	0	0	110.8	D37 N42 I50 Y51 I66 T68 Y71 L80 L84 V86	D37-F39 PolarHBondContact O-N 3.46Å; F39-N42 PolarHBondContact O-N 3.36Å; F39-I50 HydrophobicContact CD2-CB 4.32Å; F39-I50 HydrophobicContact CD2-CG2 4.08Å; F39-I50 HydrophobicContact CE2-CB 4.25Å; F39-I50 HydrophobicContact CE2-CG2 3.93Å; F39-Y51 HydrophobicContact CZ-CD2 4.45Å; F39-I66 HydrophobicContact CD1-CD1 4.4Å; F39-I66 HydrophobicContact CD1-CG2 3.98Å; F39-I66 HydrophobicContact CD2-CD1 4.22Å; F39-I66 HydrophobicContact CD2-CG2 4.37Å; F39-I66 HydrophobicContact CE1-CD1 3.66Å; F39-I66 HydrophobicContact CE1-CG2 4.2Å; F39-I66 HydrophobicContact CE2-CD1 3.48Å; F39-I66 VanDerWaalsContact CE2-CD1 3.48Å; F39-I66 HydrophobicContact CG-CG2 4.08Å; F39-I66 HydrophobicContact CZ-CD1 3.16Å; F39-T68 HydrophobicContact CB-CG2 4.12Å; F39-T68 HydrophobicContact CD1-CG2 4.46Å; F39-Y71 PolarHBondContact N-OH 3.41Å; F39-Y71 PolarHBondContact O-OH 3.48Å; F39-L80 HydrophobicContact CE1-CD1 3.68Å; F39-L80 HydrophobicContact CZ-CD1 3.87Å; F39-L84 HydrophobicContact CZ-CD2 4.43Å; F39-V86 HydrophobicContact CD1-CG1 3.9Å; F39-V86 HydrophobicContact CE1-CG1 3.96Å; F39-V86 HydrophobicContact CE1-CG2 3.79Å
40	Y	89.4	Confident	90.2	Very high	36 Å²	36	21.7 Å²	21.7	14%	0.141	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	136	179.8	-64.8	-36.2	0	0	0	112	N42 M43 E47 Y51 L80 Y88	Y40-N42 WeakPolarHBondContact CD1-O 3.37Å; Y40-M43 HydrophobicContact CD1-SD 3.63Å; Y40-M43 HydrophobicContact CE1-CE 3.96Å; Y40-M43 HydrophobicContact CE1-SD 3.34Å; Y40-M43 WeakPolarHBondContact CE1-SD 3.32Å; Y40-E47 HydrophobicContact CD1-CB 4.44Å; Y40-E47 HydrophobicContact CE1-CB 4.25Å; Y40-Y51 HydrophobicContact CD2-CD2 4.46Å; Y40-Y51 HydrophobicContact CE2-CD1 4.46Å; Y40-Y51 AromaticContact CE2-CD2 3.73Å; Y40-Y51 HydrophobicContact CE2-CD2 3.73Å; Y40-Y51 HydrophobicContact CE2-CE2 4.33Å; Y40-Y51 AromaticContact CE2-CG 3.79Å; Y40-Y51 HydrophobicContact CE2-CG 3.79Å; Y40-L80 HydrophobicContact CD2-CD1 3.91Å; Y40-Y88 WeakPolarHBondContact O-CE1 3.27Å; Y40-Y88 PolarHBondContact O-OH 2.67Å
41	P	84.6	Confident	90.2	Very high	52 Å²	52	23.2 Å²	23.2	34%	0.338	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	cis	-88.8	-7	26.4	33.6	-28.9	0	0	0	115.5	Y71	P41-Y71 VanDerWaalsContact CD-CD2 3.48Å; P41-Y71 HydrophobicContact CG-CD1 4.22Å; P41-Y71 HydrophobicContact CG-CG 4.05Å
42	N	81.6	Confident	90.1	Very high	54 Å²	54	23.4 Å²	23.4	29%	0.289	14%	0.136	S	C	.	.	S	Bend	trans	-66.5	138.2	176.5	-70.8	-15.5	0	0	0	110.3	F39 Y40 Y71 Q97	F39-N42 PolarHBondContact O-N 3.36Å; Y40-N42 WeakPolarHBondContact CD1-O 3.37Å; N42-Y71 WeakPolarHBondContact ND2-CE1 3.36Å; N42-Q97 WeakPolarHBondContact ND2-CG 3.45Å
43	M	74.9	Confident	90.1	Very high	110 Å²	110	23.5 Å²	23.5	54%	0.542	14%	0.136	S	C	.	.			trans	-105	130.8	179.6	-63	-60.9	-66.9	0	0	109.5	Y40 H290	Y40-M43 HydrophobicContact CD1-SD 3.63Å; Y40-M43 HydrophobicContact CE1-CE 3.96Å; Y40-M43 HydrophobicContact CE1-SD 3.34Å; Y40-M43 WeakPolarHBondContact CE1-SD 3.32Å; M43-H290 HydrophobicContact CE-CB 4.27Å
44	G	78.4	Confident	90	Very high	29 Å²	29	23.5 Å²	23.5	30%	0.299	14%	0.136	S	C	.	.	S	Bend	trans	-176.5	177.2	178.9	0	0	0	0	0	112	E47 S48	G44-E47 WeakPolarHBondContact CA-OE2 3.25Å; G44-E47 PolarHBondContact N-OE2 3.26Å; G44-S48 WeakPolarHBondContact O-CB 3.43Å; G44-S48 PolarHBondContact O-N 3.46Å; G44-S48 PolarHBondContact O-OG 2.82Å
45	G	82.6	Confident	89.8	Confident	39 Å²	39	23.8 Å²	23.8	40%	0.402	14%	0.137	S	C	.	.	H	α-helix	trans	-69.5	-33.6	-175.5	0	0	0	0	0	113.6	H49	G45-H49 VanDerWaalsContact O-CB 3.3Å; G45-H49 WeakPolarHBondContact O-CB 3.09Å; G45-H49 PolarHBondContact O-N 3.49Å
46	V	87.6	Confident	89.6	Confident	24 Å²	24	24.5 Å²	24.5	15%	0.145	14%	0.142	C	C	.	.	H	α-helix	trans	-72.2	-43.6	178.6	176.3	0	0	0	0	109.9	H49 I50 H125 H151	V46-H49 WeakPolarHBondContact O-CB 3.48Å; V46-H49 PolarHBondContact O-N 3.09Å; V46-I50 HydrophobicContact CG1-CD1 3.84Å; V46-I50 HydrophobicContact CG1-CG1 4.41Å; V46-I50 WeakPolarHBondContact O-CG1 3.38Å; V46-I50 PolarHBondContact O-N 3.39Å; V46-H125 HydrophobicContact CG1-CB 4.48Å; V46-H151 HydrophobicContact CG2-CB 3.81Å
47	E	90.4	Very high	89.6	Confident	19 Å²	19	24.5 Å²	24.5	9%	0.089	14%	0.142	C	C	.	.	H	α-helix	trans	-62.1	-47.5	179.5	-59.5	90.6	152.3	0	0	110.9	F38 Y40 G44 H49 I50 Y51	F38-E47 HydrophobicContact CB-CG 4.19Å; Y40-E47 HydrophobicContact CD1-CB 4.44Å; Y40-E47 HydrophobicContact CE1-CB 4.25Å; G44-E47 WeakPolarHBondContact CA-OE2 3.25Å; G44-E47 PolarHBondContact N-OE2 3.26Å; E47-H49 VanDerWaalsContact C-N 3.34Å; E47-H49 PolarHBondContact O-N 3.46Å; E47-I50 PolarHBondContact O-N 3.39Å; E47-Y51 WeakPolarHBondContact O-CB 3.46Å; E47-Y51 PolarHBondContact O-N 2.77Å
48	S	88.8	Confident	89.7	Confident	13 Å²	13	25 Å²	25	9%	0.091	14%	0.144	C	C	.	.	H	α-helix	trans	-62.5	-39.3	174	-67.4	0	0	0	0	112	G44 Y51 Q52	G44-S48 WeakPolarHBondContact O-CB 3.43Å; G44-S48 PolarHBondContact O-N 3.46Å; G44-S48 PolarHBondContact O-OG 2.82Å; S48-Y51 PolarHBondContact O-N 2.78Å; S48-Q52 WeakPolarHBondContact O-CB 3.35Å; S48-Q52 VanDerWaalsContact O-CG 3.24Å; S48-Q52 WeakPolarHBondContact O-CG 3.4Å; S48-Q52 PolarHBondContact O-N 3.39Å
49	H	92.8	Very high	89.8	Confident	5 Å²	5	29.3 Å²	29.3	2%	0.023	17%	0.165	C	C	.	.	H	α-helix	trans	-61.2	-52.8	175.9	177.6	104.5	0	0	0	112	G45 V46 E47 Y51 Q52 L53 H151 N205 W385	G45-H49 VanDerWaalsContact O-CB 3.3Å; G45-H49 WeakPolarHBondContact O-CB 3.09Å; G45-H49 PolarHBondContact O-N 3.49Å; V46-H49 WeakPolarHBondContact O-CB 3.48Å; V46-H49 PolarHBondContact O-N 3.09Å; E47-H49 VanDerWaalsContact C-N 3.34Å; E47-H49 PolarHBondContact O-N 3.46Å; H49-Y51 VanDerWaalsContact C-N 3.27Å; H49-Y51 PolarHBondContact O-N 3.26Å; H49-Q52 PolarHBondContact O-N 2.89Å; H49-L53 WeakPolarHBondContact O-CB 3.43Å; H49-L53 PolarHBondContact O-N 2.93Å; H49-H151 AromaticContact CD2-CE1 3.53Å; H49-H151 AromaticContact CD2-NE2 3.8Å; H49-H151 AromaticContact CE1-CE1 3.84Å; H49-H151 AromaticContact CG-CE1 3.59Å; H49-H151 AromaticContact ND1-CE1 3.76Å; H49-H151 AromaticContact NE2-CE1 3.71Å; H49-N205 PolarHBondContact CE1-OD1 3.21Å; H49-N205 PolarHBondContact ND1-OD1 3.42Å; H49-W385 HydrophobicContact CB-CH2 3.95Å; H49-W385 AromaticContact CG-CH2 3.93Å; H49-W385 AromaticContact ND1-CH2 3.6Å; H49-W385 AromaticContact ND1-CZ3 3.61Å
50	I	95.2	Very high	89.7	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-58.1	-44.6	179.7	-66.6	166.7	0	0	0	109.8	M34 F39 V46 E47 S54 I66 H125	M34-I50 HydrophobicContact CB-CG2 3.96Å; M34-I50 HydrophobicContact CG-CG2 4.38Å; F39-I50 HydrophobicContact CD2-CB 4.32Å; F39-I50 HydrophobicContact CD2-CG2 4.08Å; F39-I50 HydrophobicContact CE2-CB 4.25Å; F39-I50 HydrophobicContact CE2-CG2 3.93Å; V46-I50 HydrophobicContact CG1-CD1 3.84Å; V46-I50 HydrophobicContact CG1-CG1 4.41Å; V46-I50 WeakPolarHBondContact O-CG1 3.38Å; V46-I50 PolarHBondContact O-N 3.39Å; E47-I50 PolarHBondContact O-N 3.39Å; I50-S54 VanDerWaalsContact O-CB 3.23Å; I50-S54 WeakPolarHBondContact O-CB 3.48Å; I50-S54 PolarHBondContact O-N 2.96Å; I50-S54 PolarHBondContact O-OG 3.26Å; I50-I66 HydrophobicContact CG2-CD1 3.81Å; I50-I66 HydrophobicContact CG2-CG1 4.39Å; I50-H125 HydrophobicContact CD1-CB 3.83Å; I50-H125 HydrophobicContact CG1-CB 4.13Å
51	Y	94.4	Very high	89.7	Confident	33 Å²	33	31.2 Å²	31.2	13%	0.129	18%	0.179	C	C	.	.	H	α-helix	trans	-61	-58.1	178.5	176.9	-99.7	0	0	0	111.5	F39 Y40 E47 S48 H49 L53 S54 Q55 L80 T81 L84	F39-Y51 HydrophobicContact CZ-CD2 4.45Å; Y40-Y51 HydrophobicContact CD2-CD2 4.46Å; Y40-Y51 HydrophobicContact CE2-CD1 4.46Å; Y40-Y51 AromaticContact CE2-CD2 3.73Å; Y40-Y51 HydrophobicContact CE2-CD2 3.73Å; Y40-Y51 HydrophobicContact CE2-CE2 4.33Å; Y40-Y51 AromaticContact CE2-CG 3.79Å; Y40-Y51 HydrophobicContact CE2-CG 3.79Å; E47-Y51 WeakPolarHBondContact O-CB 3.46Å; E47-Y51 PolarHBondContact O-N 2.77Å; S48-Y51 PolarHBondContact O-N 2.78Å; H49-Y51 VanDerWaalsContact C-N 3.27Å; H49-Y51 PolarHBondContact O-N 3.26Å; Y51-L53 PolarHBondContact O-N 3.19Å; Y51-S54 WeakPolarHBondContact O-CB 3.35Å; Y51-S54 PolarHBondContact O-N 3.22Å; Y51-S54 VanDerWaalsContact O-N 3.13Å; Y51-Q55 HydrophobicContact CD1-CG 4.27Å; Y51-Q55 HydrophobicContact CE1-CG 3.92Å; Y51-Q55 HydrophobicContact CE2-CG 4.25Å; Y51-Q55 VanDerWaalsContact CE2-NE2 3.33Å; Y51-Q55 WeakPolarHBondContact O-CG 3.4Å; Y51-Q55 PolarHBondContact O-N 2.94Å; Y51-L80 HydrophobicContact CD2-CD1 4.34Å; Y51-L80 HydrophobicContact CE2-CB 4.43Å; Y51-L80 HydrophobicContact CE2-CD1 4.4Å; Y51-T81 WeakPolarHBondContact OH-CB 3.48Å; Y51-T81 PolarHBondContact OH-OG1 2.84Å; Y51-L84 HydrophobicContact CD2-CD2 3.59Å; Y51-L84 HydrophobicContact CE2-CD2 3.97Å
52	Q	93.9	Very high	90.1	Very high	44 Å²	44	29 Å²	29	21%	0.206	16%	0.164	C	C	.	.	H	α-helix	trans	-64.7	-41.1	-173.9	-65.9	-68.9	7.8	0	0	112.6	S48 H49 S54 Q55 C56 W385	S48-Q52 WeakPolarHBondContact O-CB 3.35Å; S48-Q52 VanDerWaalsContact O-CG 3.24Å; S48-Q52 WeakPolarHBondContact O-CG 3.4Å; S48-Q52 PolarHBondContact O-N 3.39Å; H49-Q52 PolarHBondContact O-N 2.89Å; Q52-S54 VanDerWaalsContact C-N 3.32Å; Q52-S54 PolarHBondContact O-N 3.26Å; Q52-Q55 WeakPolarHBondContact O-CB 3.22Å; Q52-Q55 PolarHBondContact O-N 2.88Å; Q52-C56 PolarHBondContact O-N 3.27Å; Q52-C56 VanDerWaalsContact O-N 3.12Å; Q52-W385 HydrophobicContact CB-CD2 3.45Å; Q52-W385 VanDerWaalsContact CB-CD2 3.45Å; Q52-W385 HydrophobicContact CB-CE3 3.87Å; Q52-W385 HydrophobicContact CB-CG 3.9Å; Q52-W385 HydrophobicContact CB-CH2 4.18Å; Q52-W385 HydrophobicContact CB-CZ2 3.73Å; Q52-W385 HydrophobicContact CB-CZ3 4.22Å; Q52-W385 HydrophobicContact CG-CD2 4.31Å; Q52-W385 HydrophobicContact CG-CZ2 4.02Å
53	L	95.8	Very high	90.7	Very high	1 Å²	1	27.9 Å²	27.9	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-43.4	173.6	178.2	58	0	0	0	111.3	M34 H49 Y51 Q55 C56 L57 W385 V388 A389 T392	M34-L53 HydrophobicContact CE-CD2 4.26Å; M34-L53 HydrophobicContact CE-CG 4.25Å; H49-L53 WeakPolarHBondContact O-CB 3.43Å; H49-L53 PolarHBondContact O-N 2.93Å; Y51-L53 PolarHBondContact O-N 3.19Å; L53-Q55 VanDerWaalsContact C-N 3.32Å; L53-Q55 PolarHBondContact O-N 3.18Å; L53-C56 PolarHBondContact O-N 3.04Å; L53-L57 HydrophobicContact CD1-CD1 3.96Å; L53-L57 HydrophobicContact CD1-CG 4.13Å; L53-L57 HydrophobicContact CG-CD1 3.84Å; L53-L57 HydrophobicContact CG-CG 4.47Å; L53-L57 WeakPolarHBondContact O-CB 3.38Å; L53-L57 VanDerWaalsContact O-CG 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.43Å; L53-L57 PolarHBondContact O-N 3.3Å; L53-W385 HydrophobicContact CB-CZ3 4.44Å; L53-V388 HydrophobicContact CD1-CG1 4.23Å; L53-A389 HydrophobicContact CD1-CB 4.02Å; L53-T392 HydrophobicContact CD2-CG2 4.38Å
54	S	95.9	Very high	91.7	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61.9	-40.1	177.3	-60.2	0	0	0	0	112	I50 Y51 Q52 L57 I58	I50-S54 VanDerWaalsContact O-CB 3.23Å; I50-S54 WeakPolarHBondContact O-CB 3.48Å; I50-S54 PolarHBondContact O-N 2.96Å; I50-S54 PolarHBondContact O-OG 3.26Å; Y51-S54 WeakPolarHBondContact O-CB 3.35Å; Y51-S54 PolarHBondContact O-N 3.22Å; Y51-S54 VanDerWaalsContact O-N 3.13Å; Q52-S54 VanDerWaalsContact C-N 3.32Å; Q52-S54 PolarHBondContact O-N 3.26Å; S54-L57 PolarHBondContact O-N 3Å; S54-I58 WeakPolarHBondContact O-CB 3.37Å; S54-I58 VanDerWaalsContact O-CG1 3.25Å; S54-I58 WeakPolarHBondContact O-CG1 3.39Å; S54-I58 PolarHBondContact O-N 2.77Å
55	Q	93.9	Very high	92.6	Very high	7 Å²	7	21.7 Å²	21.7	3%	0.033	12%	0.119	C	C	.	.	H	α-helix	trans	-59.7	-50.9	176.5	-64.9	-59.4	-38.2	0	0	111.3	Y51 Q52 L53 L57 I58 E59 T81 N82	Y51-Q55 HydrophobicContact CD1-CG 4.27Å; Y51-Q55 HydrophobicContact CE1-CG 3.92Å; Y51-Q55 HydrophobicContact CE2-CG 4.25Å; Y51-Q55 VanDerWaalsContact CE2-NE2 3.33Å; Y51-Q55 WeakPolarHBondContact O-CG 3.4Å; Y51-Q55 PolarHBondContact O-N 2.94Å; Q52-Q55 WeakPolarHBondContact O-CB 3.22Å; Q52-Q55 PolarHBondContact O-N 2.88Å; L53-Q55 VanDerWaalsContact C-N 3.32Å; L53-Q55 PolarHBondContact O-N 3.18Å; Q55-L57 VanDerWaalsContact C-N 3.33Å; Q55-L57 PolarHBondContact O-N 3.01Å; Q55-I58 PolarHBondContact O-N 3.24Å; Q55-E59 WeakPolarHBondContact O-CG 3.39Å; Q55-E59 PolarHBondContact O-N 3.27Å; Q55-T81 PolarHBondContact NE2-O 2.63Å; Q55-N82 PolarHBondContact OE1-ND2 3.28Å
56	C	94.4	Very high	93.2	Very high	16 Å²	16	19.9 Å²	19.9	11%	0.108	10%	0.1	C	C	.	.	H	α-helix	trans	-63.9	-35.8	179.1	-69.3	0	0	0	0	113.1	Q52 L53 E59 K60 W385 A389	Q52-C56 PolarHBondContact O-N 3.27Å; Q52-C56 VanDerWaalsContact O-N 3.12Å; L53-C56 PolarHBondContact O-N 3.04Å; C56-E59 PolarHBondContact O-N 2.87Å; C56-K60 WeakPolarHBondContact O-CG 3.35Å; C56-K60 PolarHBondContact O-N 2.83Å; C56-K60 VanDerWaalsContact O-N 3.07Å; C56-W385 VanDerWaalsContact SG-CB 3.56Å; C56-A389 HydrophobicContact CB-CB 3.55Å
57	L	94.5	Very high	93.7	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-69.1	-38.1	176.2	-71.1	168.5	0	0	0	112.2	I32 M34 L53 S54 Q55 K60 G61 H62 V64 A389 Y396	I32-L57 HydrophobicContact CD1-CD1 4.28Å; M34-L57 HydrophobicContact CE-CD1 3.33Å; L53-L57 HydrophobicContact CD1-CD1 3.96Å; L53-L57 HydrophobicContact CD1-CG 4.13Å; L53-L57 HydrophobicContact CG-CD1 3.84Å; L53-L57 HydrophobicContact CG-CG 4.47Å; L53-L57 WeakPolarHBondContact O-CB 3.38Å; L53-L57 VanDerWaalsContact O-CG 3.28Å; L53-L57 WeakPolarHBondContact O-CG 3.43Å; L53-L57 PolarHBondContact O-N 3.3Å; S54-L57 PolarHBondContact O-N 3Å; Q55-L57 VanDerWaalsContact C-N 3.33Å; Q55-L57 PolarHBondContact O-N 3.01Å; L57-K60 PolarHBondContact O-N 3.47Å; L57-G61 PolarHBondContact O-N 3.32Å; L57-H62 WeakPolarHBondContact O-CB 3.33Å; L57-H62 PolarHBondContact O-CD2 3.4Å; L57-H62 VanDerWaalsContact O-CD2 3.3Å; L57-H62 PolarHBondContact O-N 3.5Å; L57-V64 HydrophobicContact CB-CG2 3.73Å; L57-A389 HydrophobicContact CD2-CB 4.41Å; L57-Y396 HydrophobicContact CD1-CE2 3.89Å; L57-Y396 HydrophobicContact CD2-CE2 4.01Å
58	I	92.9	Very high	93.9	Very high	10 Å²	10	17.9 Å²	17.9	5%	0.051	9%	0.089	C	C	.	.	H	α-helix	trans	-63.3	-43.3	173.2	-70.8	167.9	0	0	0	110.6	S54 Q55 K60 G61 V64 L84 P458	S54-I58 WeakPolarHBondContact O-CB 3.37Å; S54-I58 VanDerWaalsContact O-CG1 3.25Å; S54-I58 WeakPolarHBondContact O-CG1 3.39Å; S54-I58 PolarHBondContact O-N 2.77Å; Q55-I58 PolarHBondContact O-N 3.24Å; I58-K60 VanDerWaalsContact C-N 3.27Å; I58-K60 PolarHBondContact O-N 3.22Å; I58-G61 WeakPolarHBondContact O-CA 3.37Å; I58-G61 PolarHBondContact O-N 3.26Å; I58-V64 HydrophobicContact CD1-CB 4.18Å; I58-V64 HydrophobicContact CG1-CB 3.82Å; I58-V64 HydrophobicContact CG1-CG2 3.86Å; I58-L84 HydrophobicContact CD1-CB 4.1Å; I58-L84 HydrophobicContact CD1-CD1 3.84Å; I58-P458 WeakPolarHBondContact O-CD 3.42Å
59	E	90.8	Very high	94.1	Very high	121 Å²	121	17.2 Å²	17.2	57%	0.565	9%	0.085	S	C	*	.	H	α-helix	trans	-60.1	-37.7	176.2	-73.9	177.9	176.4	0	0	112.4	Q55 C56 G61	Q55-E59 WeakPolarHBondContact O-CG 3.39Å; Q55-E59 PolarHBondContact O-N 3.27Å; C56-E59 PolarHBondContact O-N 2.87Å; E59-G61 PolarHBondContact O-N 3.5Å
60	K	90.8	Very high	93.9	Very high	61 Å²	61	17.8 Å²	17.8	27%	0.265	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-4.1	173.3	-71.4	171.2	63.5	84.9	0	113.3	K29 C56 L57 I58 A389 E393	K29-K60 PolarHBondContact NZ-O 3.33Å; C56-K60 WeakPolarHBondContact O-CG 3.35Å; C56-K60 PolarHBondContact O-N 2.83Å; C56-K60 VanDerWaalsContact O-N 3.07Å; L57-K60 PolarHBondContact O-N 3.47Å; I58-K60 VanDerWaalsContact C-N 3.27Å; I58-K60 PolarHBondContact O-N 3.22Å; K60-A389 HydrophobicContact CD-CB 4.29Å; K60-E393 WeakPolarHBondContact CE-OE1 3.46Å; K60-E393 WeakPolarHBondContact CE-OE2 3.45Å; K60-E393 IonicContact NZ-OE1 2.86Å; K60-E393 PolarHBondContact NZ-OE1 3.31Å; K60-E393 IonicContact NZ-OE2 2.79Å; K60-E393 PolarHBondContact NZ-OE2 2.91Å
61	G	90.5	Very high	93.5	Very high	17 Å²	17	18.5 Å²	18.5	18%	0.175	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	13.2	174.4	0	0	0	0	0	115.1	L57 I58 E59	L57-G61 PolarHBondContact O-N 3.32Å; I58-G61 WeakPolarHBondContact O-CA 3.37Å; I58-G61 PolarHBondContact O-N 3.26Å; E59-G61 PolarHBondContact O-N 3.5Å
62	H	92.9	Very high	93	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.019	13%	0.127	C	C	.	.			trans	-75.5	152.1	166.8	-55.7	-77.3	0	0	0	110.1	R28 H30 I32 L57 V64 E393	R28-H62 PolarHBondContact O-CE1 3.21Å; H30-H62 AromaticContact CD2-CE1 3.74Å; H30-H62 AromaticContact CD2-ND1 3.76Å; H30-H62 PolarHBondContact N-ND1 3.1Å; I32-H62 HydrophobicContact CD1-CB 3.97Å; L57-H62 WeakPolarHBondContact O-CB 3.33Å; L57-H62 PolarHBondContact O-CD2 3.4Å; L57-H62 VanDerWaalsContact O-CD2 3.3Å; L57-H62 PolarHBondContact O-N 3.5Å; H62-V64 HydrophobicContact CB-CG2 4.28Å; H62-E393 IonicContact CE1-OE1 2.76Å; H62-E393 IonicContact NE2-OE1 3.39Å; H62-E393 PolarHBondContact NE2-OE1 3.29Å
63	K	93.6	Very high	92.5	Very high	31 Å²	31	25.2 Å²	25.2	14%	0.135	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	122.3	167.6	176.6	179.2	-179.8	168.5	0	108.1	H30 N31 I32 E117 D454	H30-K63 PolarHBondContact O-N 2.95Å; N31-K63 WeakPolarHBondContact CA-O 3.42Å; N31-K63 HydrophobicContact CB-CB 4.45Å; N31-K63 HydrophobicContact CB-CD 4.38Å; N31-K63 WeakPolarHBondContact OD1-CB 3.2Å; I32-K63 PolarHBondContact N-O 2.9Å; K63-E117 WeakPolarHBondContact CE-O 3.46Å; K63-E117 WeakPolarHBondContact CE-OE2 3.47Å; K63-E117 PolarHBondContact NZ-O 3.02Å; K63-E117 IonicContact NZ-OE2 3.34Å; K63-E117 PolarHBondContact NZ-OE2 2.89Å; K63-D454 VanDerWaalsContact CD-OD1 3.22Å; K63-D454 WeakPolarHBondContact CD-OD1 3.14Å; K63-D454 WeakPolarHBondContact CE-OD1 3.38Å; K63-D454 IonicContact NZ-OD1 3.55Å; K63-D454 PolarHBondContact NZ-OD1 2.89Å
64	V	95.6	Very high	92.1	Very high	6 Å²	6	28.5 Å²	28.5	4%	0.036	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	127.9	-179.9	-169.7	0	0	0	0	110.2	I32 M34 L57 I58 H62 L84	I32-V64 HydrophobicContact CD1-CG2 4.34Å; I32-V64 WeakPolarHBondContact O-CA 3.46Å; M34-V64 HydrophobicContact CE-CG1 4.08Å; M34-V64 HydrophobicContact CG-CG1 3.84Å; L57-V64 HydrophobicContact CB-CG2 3.73Å; I58-V64 HydrophobicContact CD1-CB 4.18Å; I58-V64 HydrophobicContact CG1-CB 3.82Å; I58-V64 HydrophobicContact CG1-CG2 3.86Å; H62-V64 HydrophobicContact CB-CG2 4.28Å; V64-L84 HydrophobicContact CG1-CD1 4.4Å
65	V	96.6	Very high	92	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.018	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	156.3	170.6	-55.4	0	0	0	0	109.6	I32 C33 M34 K85 Y87 E117 I119	I32-V65 PolarHBondContact O-N 3.48Å; C33-V65 CarbonylContact C-O 3.6Å; C33-V65 WeakPolarHBondContact CA-O 3.38Å; C33-V65 HydrophobicContact CB-CG2 4Å; M34-V65 PolarHBondContact N-O 2.82Å; V65-K85 CarbonylContact C-O 3.57Å; V65-K85 WeakPolarHBondContact CA-O 3.49Å; V65-K85 HydrophobicContact CG1-CB 4.2Å; V65-K85 HydrophobicContact CG1-CD 4.37Å; V65-Y87 HydrophobicContact CB-CD2 4.46Å; V65-Y87 HydrophobicContact CB-CE2 4.32Å; V65-Y87 HydrophobicContact CG1-CE2 4.49Å; V65-E117 HydrophobicContact CG1-CG 4.13Å; V65-E117 HydrophobicContact CG2-CG 4.3Å; V65-I119 HydrophobicContact CG2-CD1 3.82Å
66	I	97.1	Very high	91.9	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	136	176.4	-58.4	-176.4	0	0	0	108.9	M34 F39 I50 L84 K85 V86 Y87	M34-I66 HydrophobicContact CB-CG1 4.16Å; M34-I66 CarbonylContact O-C 3.51Å; M34-I66 VanDerWaalsContact O-CA 3.3Å; M34-I66 WeakPolarHBondContact O-CA 3.38Å; F39-I66 HydrophobicContact CD1-CD1 4.4Å; F39-I66 HydrophobicContact CD1-CG2 3.98Å; F39-I66 HydrophobicContact CD2-CD1 4.22Å; F39-I66 HydrophobicContact CD2-CG2 4.37Å; F39-I66 HydrophobicContact CE1-CD1 3.66Å; F39-I66 HydrophobicContact CE1-CG2 4.2Å; F39-I66 HydrophobicContact CE2-CD1 3.48Å; F39-I66 VanDerWaalsContact CE2-CD1 3.48Å; F39-I66 HydrophobicContact CG-CG2 4.08Å; F39-I66 HydrophobicContact CZ-CD1 3.16Å; I50-I66 HydrophobicContact CG2-CD1 3.81Å; I50-I66 HydrophobicContact CG2-CG1 4.39Å; I66-L84 HydrophobicContact CD1-CD1 3.9Å; I66-L84 HydrophobicContact CD1-CD2 3.67Å; I66-L84 HydrophobicContact CD1-CG 3.96Å; I66-L84 HydrophobicContact CG1-CD1 3.94Å; I66-L84 HydrophobicContact CG1-CG 4.4Å; I66-K85 PolarHBondContact N-O 2.94Å; I66-V86 HydrophobicContact CB-CB 4.48Å; I66-V86 HydrophobicContact CB-CG1 4.14Å; I66-V86 HydrophobicContact CB-CG2 4.29Å; I66-V86 HydrophobicContact CG2-CG1 4.17Å; I66-V86 CarbonylContact O-C 3.56Å; I66-V86 WeakPolarHBondContact O-CA 3.43Å; I66-Y87 PolarHBondContact O-N 3.03Å
67	A	96.6	Very high	91.8	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	126.9	167	0	0	0	0	0	109.7	M34 V35 S36 L110 M131	M34-A67 PolarHBondContact O-N 2.62Å; V35-A67 HydrophobicContact CG2-CB 4.34Å; S36-A67 PolarHBondContact N-O 2.89Å; A67-L110 HydrophobicContact CB-CD2 4.4Å; A67-M131 HydrophobicContact CB-CE 3.7Å; A67-M131 WeakPolarHBondContact O-CE 3.46Å
68	T	95.3	Very high	91.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	171.2	177.5	-168	0	0	0	0	110.2	S36 D37 F39 Y71 V86 Y87 Y88 L89	S36-T68 WeakPolarHBondContact O-CA 3.3Å; S36-T68 WeakPolarHBondContact O-CB 3.24Å; S36-T68 PolarHBondContact O-OG1 3.5Å; D37-T68 PolarHBondContact O-OG1 3.16Å; F39-T68 HydrophobicContact CB-CG2 4.12Å; F39-T68 HydrophobicContact CD1-CG2 4.46Å; T68-Y71 HydrophobicContact CG2-CE2 4.44Å; T68-V86 HydrophobicContact CG2-CG1 4.11Å; T68-Y87 PolarHBondContact N-O 2.99Å; T68-Y88 HydrophobicContact CG2-CD1 3.57Å; T68-Y88 HydrophobicContact CG2-CE1 3.63Å; T68-Y88 HydrophobicContact CG2-CG 4.3Å; T68-L89 PolarHBondContact O-N 3.24Å
69	H	91.9	Very high	91.6	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	158.5	175.4	73.6	77.2	0	0	0	111.3	D37 Y71 Y88 L89 L91 V93 Q97 T99	D37-H69 PolarHBondContact O-CD2 3.4Å; D37-H69 VanDerWaalsContact O-CD2 3.27Å; D37-H69 PolarHBondContact O-NE2 3.03Å; D37-H69 IonicContact OD1-CD2 2.66Å; H69-Y71 AromaticContact CE1-CD1 3.72Å; H69-Y71 AromaticContact CE1-CE1 3.32Å; H69-Y71 WeakPolarHBondContact CE1-CE1 3.35Å; H69-Y71 AromaticContact CE1-CE2 3.77Å; H69-Y71 AromaticContact CE1-CZ 3.37Å; H69-Y71 AromaticContact NE2-CE1 3.75Å; H69-Y71 AromaticContact NE2-CZ 3.49Å; H69-Y71 PolarHBondContact NE2-OH 3.27Å; H69-Y71 VanDerWaalsContact O-CD2 3.26Å; H69-Y71 WeakPolarHBondContact O-CD2 3.46Å; H69-Y71 WeakPolarHBondContact O-CE2 3.4Å; H69-Y88 WeakPolarHBondContact O-CD1 3.38Å; H69-L89 CarbonylContact C-O 3.41Å; H69-L89 WeakPolarHBondContact CA-O 3.34Å; H69-L91 HydrophobicContact CB-CB 4.33Å; H69-V93 VanDerWaalsContact CE1-CG2 3.41Å; H69-V93 WeakPolarHBondContact CE1-CG2 3.34Å; H69-V93 VanDerWaalsContact ND1-CG2 3.3Å; H69-V93 WeakPolarHBondContact ND1-CG2 3.44Å; H69-Q97 PolarHBondContact CE1-OE1 3.48Å; H69-Q97 PolarHBondContact NE2-O 3.12Å; H69-Q97 VanDerWaalsContact NE2-O 3.15Å; H69-T99 HydrophobicContact CB-CG2 3.81Å
70	A	90.1	Very high	91.6	Very high	17 Å²	17	44.7 Å²	44.7	14%	0.14	24%	0.243	C	C	.	.			trans	-68.1	140.3	175.8	0	0	0	0	0	111.5	R74 K75 L89	A70-R74 WeakPolarHBondContact CA-O 3.5Å; A70-K75 HydrophobicContact CB-CG 4.04Å; A70-L89 WeakPolarHBondContact CB-O 3.22Å; A70-L89 PolarHBondContact N-O 3.29Å
71	Y	86.6	Confident	91.3	Very high	15 Å²	15	46 Å²	46	6%	0.059	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-117.5	100.1	178.4	-73.4	-88.5	0	0	0	109.9	D37 F39 P41 N42 T68 H69 S73 R74 Y88 Q97	D37-Y71 PolarHBondContact O-OH 3.17Å; F39-Y71 PolarHBondContact N-OH 3.41Å; F39-Y71 PolarHBondContact O-OH 3.48Å; P41-Y71 VanDerWaalsContact CD-CD2 3.48Å; P41-Y71 HydrophobicContact CG-CD1 4.22Å; P41-Y71 HydrophobicContact CG-CG 4.05Å; N42-Y71 WeakPolarHBondContact ND2-CE1 3.36Å; T68-Y71 HydrophobicContact CG2-CE2 4.44Å; H69-Y71 AromaticContact CE1-CD1 3.72Å; H69-Y71 AromaticContact CE1-CE1 3.32Å; H69-Y71 WeakPolarHBondContact CE1-CE1 3.35Å; H69-Y71 AromaticContact CE1-CE2 3.77Å; H69-Y71 AromaticContact CE1-CZ 3.37Å; H69-Y71 AromaticContact NE2-CE1 3.75Å; H69-Y71 AromaticContact NE2-CZ 3.49Å; H69-Y71 PolarHBondContact NE2-OH 3.27Å; H69-Y71 VanDerWaalsContact O-CD2 3.26Å; H69-Y71 WeakPolarHBondContact O-CD2 3.46Å; H69-Y71 WeakPolarHBondContact O-CE2 3.4Å; Y71-S73 CarbonylContact O-C 3.47Å; Y71-S73 PolarHBondContact O-N 3.31Å; Y71-R74 PolarHBondContact N-O 3.24Å; Y71-R74 PolarHBondContact O-N 3.16Å; Y71-Y88 AromaticContact CD2-CD1 3.97Å; Y71-Y88 HydrophobicContact CD2-CD1 3.97Å; Y71-Y88 AromaticContact CD2-CE1 3.79Å; Y71-Y88 HydrophobicContact CD2-CE1 3.79Å; Y71-Y88 HydrophobicContact CE2-CE1 4.3Å; Y71-Q97 HydrophobicContact CE1-CG 4.49Å
72	S	82.9	Confident	90.8	Very high	119 Å²	119	49.9 Å²	49.9	83%	0.832	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	37.9	-93.1	178	-103.3	0	0	0	0	114.2	K75	S72-K75 WeakPolarHBondContact O-CE 3.35Å
73	S	84.2	Confident	90.4	Very high	100 Å²	100	49.9 Å²	49.9	70%	0.699	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-14.9	179.1	59.1	0	0	0	0	115.9	Y71 R78	Y71-S73 CarbonylContact O-C 3.47Å; Y71-S73 PolarHBondContact O-N 3.31Å; S73-R78 PolarHBondContact O-NH2 3.1Å; S73-R78 VanDerWaalsContact O-NH2 3.07Å
74	R	87.6	Confident	90.3	Very high	70 Å²	70	48.4 Å²	48.4	26%	0.264	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-96.5	101.4	175.2	-59.5	-164.9	-179	-163.6	2.1	110.6	A70 Y71 Y88	A70-R74 WeakPolarHBondContact CA-O 3.5Å; Y71-R74 PolarHBondContact N-O 3.24Å; Y71-R74 PolarHBondContact O-N 3.16Å; R74-Y88 HydrophobicContact CB-CD1 4.11Å; R74-Y88 HydrophobicContact CB-CE1 4.03Å; R74-Y88 HydrophobicContact CB-CE2 4.44Å; R74-Y88 HydrophobicContact CB-CG 4.36Å; R74-Y88 PolarHBondContact NH1-OH 2.85Å
75	K	92.4	Very high	90.2	Very high	142 Å²	142	49 Å²	49	62%	0.617	27%	0.269	S	S	*	.			trans	-132.6	159.1	178.2	-57	-173.1	175	174.5	0	110.2	A70 S72	A70-K75 HydrophobicContact CB-CG 4.04Å; S72-K75 WeakPolarHBondContact O-CE 3.35Å
76	G	92.6	Very high	90.1	Very high	40 Å²	40	48.9 Å²	48.9	41%	0.412	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	73	-147.1	174.2	0	0	0	0	0	113	Y88	G76-Y88 PolarHBondContact N-O 3.13Å; G76-Y88 VanDerWaalsContact N-O 3.08Å; G76-Y88 WeakPolarHBondContact O-CB 3.42Å; G76-Y88 PolarHBondContact O-N 3.35Å
77	V	93.1	Very high	90	Very high	72 Å²	72	49.7 Å²	49.7	44%	0.436	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	130.1	-177.9	-175.7	0	0	0	0	109.9	Y79 K85 V86 Y87	V77-Y79 HydrophobicContact CG1-CE2 4.08Å; V77-K85 HydrophobicContact CG1-CD 4.26Å; V77-K85 VanDerWaalsContact CG1-CE 3.44Å; V77-K85 HydrophobicContact CG1-CG 3.83Å; V77-V86 WeakPolarHBondContact CA-O 3.41Å; V77-Y87 HydrophobicContact CG2-CD1 3.69Å; V77-Y87 HydrophobicContact CG2-CE1 3.54Å
78	R	92.3	Very high	90	Very high	106 Å²	106	49.9 Å²	49.9	40%	0.4	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	156.6	173.3	-64.3	-172.5	168.9	-119.5	4.9	110.7	S73 V86 Y88	S73-R78 PolarHBondContact O-NH2 3.1Å; S73-R78 VanDerWaalsContact O-NH2 3.07Å; R78-V86 PolarHBondContact N-O 3.31Å; R78-V86 PolarHBondContact O-N 3.13Å; R78-Y88 HydrophobicContact CB-CD2 4.28Å; R78-Y88 HydrophobicContact CB-CE2 3.93Å; R78-Y88 HydrophobicContact CG-CD2 4.07Å; R78-Y88 HydrophobicContact CG-CE2 4.01Å
79	Y	91.1	Very high	89.8	Confident	92 Å²	92	50.4 Å²	50.4	36%	0.361	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	129.1	175	-68	-95.4	0	0	0	108.9	V77 L84 K85 A455 T456 W462	V77-Y79 HydrophobicContact CG1-CE2 4.08Å; Y79-L84 WeakPolarHBondContact CA-O 3.28Å; Y79-K85 HydrophobicContact CD1-CB 4.15Å; Y79-K85 HydrophobicContact CD1-CG 4.34Å; Y79-K85 HydrophobicContact CE1-CB 3.9Å; Y79-K85 HydrophobicContact CE1-CD 4.02Å; Y79-K85 HydrophobicContact CE1-CG 3.83Å; Y79-K85 WeakPolarHBondContact OH-CE 3.48Å; Y79-A455 HydrophobicContact CE1-CB 4.07Å; Y79-T456 HydrophobicContact CD1-CG2 4.41Å; Y79-W462 AromaticContact CD1-CH2 3.75Å; Y79-W462 HydrophobicContact CD1-CH2 3.75Å; Y79-W462 HydrophobicContact CD1-CZ2 4.42Å; Y79-W462 HydrophobicContact CD1-CZ3 4.27Å; Y79-W462 HydrophobicContact CD2-CH2 4.25Å; Y79-W462 HydrophobicContact CE1-CH2 4.28Å; Y79-W462 AromaticContact CG-CH2 3.73Å; Y79-W462 HydrophobicContact CG-CH2 3.73Å; Y79-W462 HydrophobicContact CG-CZ3 4.47Å
80	L	89.9	Confident	89.7	Confident	41 Å²	41	55 Å²	55	22%	0.215	31%	0.305	C	S	.	.			trans	-100.3	-176.5	171.8	-58.2	-179.7	0	0	0	109.9	F39 Y40 Y51 G83 L84 V86	F39-L80 HydrophobicContact CE1-CD1 3.68Å; F39-L80 HydrophobicContact CZ-CD1 3.87Å; Y40-L80 HydrophobicContact CD2-CD1 3.91Å; Y51-L80 HydrophobicContact CD2-CD1 4.34Å; Y51-L80 HydrophobicContact CE2-CB 4.43Å; Y51-L80 HydrophobicContact CE2-CD1 4.4Å; L80-G83 WeakPolarHBondContact O-CA 3.36Å; L80-G83 PolarHBondContact O-N 3.16Å; L80-L84 HydrophobicContact CB-CB 4.27Å; L80-L84 HydrophobicContact CD1-CD2 4.36Å; L80-L84 PolarHBondContact N-O 3.18Å; L80-L84 PolarHBondContact O-N 3.33Å; L80-V86 HydrophobicContact CD1-CG2 3.78Å; L80-V86 HydrophobicContact CG-CG2 3.91Å
81	T	84.5	Confident	89.5	Confident	88 Å²	88	54.8 Å²	54.8	54%	0.54	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-52.1	147	-179.8	-38.4	0	0	0	0	112.3	Y51 Q55 G83 L84	Y51-T81 WeakPolarHBondContact OH-CB 3.48Å; Y51-T81 PolarHBondContact OH-OG1 2.84Å; Q55-T81 PolarHBondContact NE2-O 2.63Å; T81-G83 PolarHBondContact O-N 3.21Å; T81-L84 PolarHBondContact O-N 3.39Å
82	N	80.9	Confident	89.1	Confident	99 Å²	99	61.2 Å²	61.2	53%	0.529	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	52.3	18.8	-170.7	-52.4	-39.7	0	0	0	114.2	Q55	Q55-N82 PolarHBondContact OE1-ND2 3.28Å
83	G	82.8	Confident	88.7	Confident	4 Å²	4	57.9 Å²	57.9	4%	0.041	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	81.9	19.8	172	0	0	0	0	0	115	L80 T81 K85 T456	L80-G83 WeakPolarHBondContact O-CA 3.36Å; L80-G83 PolarHBondContact O-N 3.16Å; T81-G83 PolarHBondContact O-N 3.21Å; G83-K85 PolarHBondContact O-N 3.05Å; G83-K85 VanDerWaalsContact O-N 3.12Å; G83-T456 VanDerWaalsContact O-CB 3.31Å; G83-T456 WeakPolarHBondContact O-CB 3.08Å; G83-T456 WeakPolarHBondContact O-CG2 3.26Å; G83-T456 PolarHBondContact O-OG1 3.03Å
84	L	91.5	Very high	88.1	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.303	C	S	.	.			trans	-60.8	114.2	173.5	176.2	62.7	0	0	0	110.1	F39 Y51 I58 V64 I66 Y79 L80 T81	F39-L84 HydrophobicContact CZ-CD2 4.43Å; Y51-L84 HydrophobicContact CD2-CD2 3.59Å; Y51-L84 HydrophobicContact CE2-CD2 3.97Å; I58-L84 HydrophobicContact CD1-CB 4.1Å; I58-L84 HydrophobicContact CD1-CD1 3.84Å; V64-L84 HydrophobicContact CG1-CD1 4.4Å; I66-L84 HydrophobicContact CD1-CD1 3.9Å; I66-L84 HydrophobicContact CD1-CD2 3.67Å; I66-L84 HydrophobicContact CD1-CG 3.96Å; I66-L84 HydrophobicContact CG1-CD1 3.94Å; I66-L84 HydrophobicContact CG1-CG 4.4Å; Y79-L84 WeakPolarHBondContact CA-O 3.28Å; L80-L84 HydrophobicContact CB-CB 4.27Å; L80-L84 HydrophobicContact CD1-CD2 4.36Å; L80-L84 PolarHBondContact N-O 3.18Å; L80-L84 PolarHBondContact O-N 3.33Å; T81-L84 PolarHBondContact O-N 3.39Å
85	K	93.8	Very high	87	Confident	19 Å²	19	64.8 Å²	64.8	8%	0.083	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	132.4	-177.4	-171.2	179.1	-173.2	-179.5	0	110.6	V65 I66 V77 Y79 G83 Y87 E117	V65-K85 CarbonylContact C-O 3.57Å; V65-K85 WeakPolarHBondContact CA-O 3.49Å; V65-K85 HydrophobicContact CG1-CB 4.2Å; V65-K85 HydrophobicContact CG1-CD 4.37Å; I66-K85 PolarHBondContact N-O 2.94Å; V77-K85 HydrophobicContact CG1-CD 4.26Å; V77-K85 VanDerWaalsContact CG1-CE 3.44Å; V77-K85 HydrophobicContact CG1-CG 3.83Å; Y79-K85 HydrophobicContact CD1-CB 4.15Å; Y79-K85 HydrophobicContact CD1-CG 4.34Å; Y79-K85 HydrophobicContact CE1-CB 3.9Å; Y79-K85 HydrophobicContact CE1-CD 4.02Å; Y79-K85 HydrophobicContact CE1-CG 3.83Å; Y79-K85 WeakPolarHBondContact OH-CE 3.48Å; G83-K85 PolarHBondContact O-N 3.05Å; G83-K85 VanDerWaalsContact O-N 3.12Å; K85-Y87 HydrophobicContact CD-CE2 4.06Å; K85-Y87 VanDerWaalsContact CE-OH 3.28Å; K85-Y87 WeakPolarHBondContact CE-OH 3.32Å; K85-Y87 HydrophobicContact CG-CE2 4.27Å; K85-Y87 PolarHBondContact NZ-OH 3.43Å; K85-E117 WeakPolarHBondContact CD-OE1 3.18Å; K85-E117 VanDerWaalsContact CE-OE1 3.3Å; K85-E117 WeakPolarHBondContact CE-OE1 3.49Å; K85-E117 IonicContact NZ-OE1 3.78Å; K85-E117 PolarHBondContact NZ-OE1 2.88Å
86	V	95.2	Very high	85.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	124.2	-175.1	-170	0	0	0	0	109.8	F39 I66 T68 V77 R78 L80 Y88	F39-V86 HydrophobicContact CD1-CG1 3.9Å; F39-V86 HydrophobicContact CE1-CG1 3.96Å; F39-V86 HydrophobicContact CE1-CG2 3.79Å; I66-V86 HydrophobicContact CB-CB 4.48Å; I66-V86 HydrophobicContact CB-CG1 4.14Å; I66-V86 HydrophobicContact CB-CG2 4.29Å; I66-V86 HydrophobicContact CG2-CG1 4.17Å; I66-V86 CarbonylContact O-C 3.56Å; I66-V86 WeakPolarHBondContact O-CA 3.43Å; T68-V86 HydrophobicContact CG2-CG1 4.11Å; V77-V86 WeakPolarHBondContact CA-O 3.41Å; R78-V86 PolarHBondContact N-O 3.31Å; R78-V86 PolarHBondContact O-N 3.13Å; L80-V86 HydrophobicContact CD1-CG2 3.78Å; L80-V86 HydrophobicContact CG-CG2 3.91Å; V86-Y88 HydrophobicContact CB-CD2 4.4Å; V86-Y88 HydrophobicContact CB-CE2 3.89Å; V86-Y88 HydrophobicContact CG1-CD2 3.96Å; V86-Y88 HydrophobicContact CG1-CE1 4.34Å; V86-Y88 HydrophobicContact CG1-CE2 3.49Å; V86-Y88 VanDerWaalsContact CG1-CE2 3.49Å
87	Y	95.6	Very high	84.6	Confident	19 Å²	19	65.4 Å²	65.4	8%	0.075	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	109.1	172.8	-72.4	-88.5	0	0	0	109.6	V65 I66 T68 V77 K85 V113 E117	V65-Y87 HydrophobicContact CB-CD2 4.46Å; V65-Y87 HydrophobicContact CB-CE2 4.32Å; V65-Y87 HydrophobicContact CG1-CE2 4.49Å; I66-Y87 PolarHBondContact O-N 3.03Å; T68-Y87 PolarHBondContact N-O 2.99Å; V77-Y87 HydrophobicContact CG2-CD1 3.69Å; V77-Y87 HydrophobicContact CG2-CE1 3.54Å; K85-Y87 HydrophobicContact CD-CE2 4.06Å; K85-Y87 VanDerWaalsContact CE-OH 3.28Å; K85-Y87 WeakPolarHBondContact CE-OH 3.32Å; K85-Y87 HydrophobicContact CG-CE2 4.27Å; K85-Y87 PolarHBondContact NZ-OH 3.43Å; Y87-V113 HydrophobicContact CD1-CG2 3.72Å; Y87-V113 HydrophobicContact CD2-CG1 3.81Å; Y87-V113 HydrophobicContact CD2-CG2 4.27Å; Y87-V113 HydrophobicContact CE1-CG2 4.08Å; Y87-V113 HydrophobicContact CE2-CG1 3.9Å; Y87-V113 HydrophobicContact CG-CG1 4.21Å; Y87-V113 HydrophobicContact CG-CG2 3.82Å; Y87-E117 HydrophobicContact CE2-CG 3.97Å; Y87-E117 WeakPolarHBondContact CE2-OE1 3.29Å; Y87-E117 VanDerWaalsContact CZ-OE1 3.3Å; Y87-E117 PolarHBondContact OH-OE1 3.29Å
88	Y	95.1	Very high	83.2	Confident	4 Å²	4	63 Å²	63	2%	0.016	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	91.5	171.8	-69.7	-82.9	0	0	0	109.4	Y40 T68 H69 Y71 R74 G76 R78 V86	Y40-Y88 WeakPolarHBondContact O-CE1 3.27Å; Y40-Y88 PolarHBondContact O-OH 2.67Å; T68-Y88 HydrophobicContact CG2-CD1 3.57Å; T68-Y88 HydrophobicContact CG2-CE1 3.63Å; T68-Y88 HydrophobicContact CG2-CG 4.3Å; H69-Y88 WeakPolarHBondContact O-CD1 3.38Å; Y71-Y88 AromaticContact CD2-CD1 3.97Å; Y71-Y88 HydrophobicContact CD2-CD1 3.97Å; Y71-Y88 AromaticContact CD2-CE1 3.79Å; Y71-Y88 HydrophobicContact CD2-CE1 3.79Å; Y71-Y88 HydrophobicContact CE2-CE1 4.3Å; R74-Y88 HydrophobicContact CB-CD1 4.11Å; R74-Y88 HydrophobicContact CB-CE1 4.03Å; R74-Y88 HydrophobicContact CB-CE2 4.44Å; R74-Y88 HydrophobicContact CB-CG 4.36Å; R74-Y88 PolarHBondContact NH1-OH 2.85Å; G76-Y88 PolarHBondContact N-O 3.13Å; G76-Y88 VanDerWaalsContact N-O 3.08Å; G76-Y88 WeakPolarHBondContact O-CB 3.42Å; G76-Y88 PolarHBondContact O-N 3.35Å; R78-Y88 HydrophobicContact CB-CD2 4.28Å; R78-Y88 HydrophobicContact CB-CE2 3.93Å; R78-Y88 HydrophobicContact CG-CD2 4.07Å; R78-Y88 HydrophobicContact CG-CE2 4.01Å; V86-Y88 HydrophobicContact CB-CD2 4.4Å; V86-Y88 HydrophobicContact CB-CE2 3.89Å; V86-Y88 HydrophobicContact CG1-CD2 3.96Å; V86-Y88 HydrophobicContact CG1-CE1 4.34Å; V86-Y88 HydrophobicContact CG1-CE2 3.49Å; V86-Y88 VanDerWaalsContact CG1-CE2 3.49Å
89	L	92.7	Very high	82.1	Confident	11 Å²	11	58.5 Å²	58.5	6%	0.058	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	139	-174.4	-57.3	-175.3	0	0	0	111.2	T68 H69 A70 L91 L109 L110 V113 M131	T68-L89 PolarHBondContact O-N 3.24Å; H69-L89 CarbonylContact C-O 3.41Å; H69-L89 WeakPolarHBondContact CA-O 3.34Å; A70-L89 WeakPolarHBondContact CB-O 3.22Å; A70-L89 PolarHBondContact N-O 3.29Å; L89-L91 HydrophobicContact CB-CD1 4.13Å; L89-L91 HydrophobicContact CB-CG 3.94Å; L89-L91 HydrophobicContact CD1-CD1 4.26Å; L89-L91 PolarHBondContact O-N 3.16Å; L89-L109 HydrophobicContact CB-CD1 4.46Å; L89-L109 HydrophobicContact CD1-CB 4.22Å; L89-L109 HydrophobicContact CD2-CB 4.39Å; L89-L110 HydrophobicContact CD1-CD2 3.97Å; L89-L110 HydrophobicContact CD1-CG 4.38Å; L89-V113 HydrophobicContact CD2-CG2 4.21Å; L89-M131 HydrophobicContact CD1-CE 3.67Å; L89-M131 HydrophobicContact CG-CE 4.37Å
90	P	89.4	Confident	80.8	Confident	97 Å²	97	55.6 Å²	55.6	63%	0.63	29%	0.289	S	S	*	.			trans	-75.6	52.5	-179.5	34.5	-38.4	0	0	0	112.5	L109	P90-L109 HydrophobicContact CG-CD1 4.15Å
91	L	84.8	Confident	79.5	Confident	13 Å²	13	56.6 Å²	56.6	7%	0.068	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-86.6	140.8	176.8	-60.4	175.4	0	0	0	110.1	H69 L89 V93 T99 L109 M131	H69-L91 HydrophobicContact CB-CB 4.33Å; L89-L91 HydrophobicContact CB-CD1 4.13Å; L89-L91 HydrophobicContact CB-CG 3.94Å; L89-L91 HydrophobicContact CD1-CD1 4.26Å; L89-L91 PolarHBondContact O-N 3.16Å; L91-V93 PolarHBondContact O-N 2.84Å; L91-T99 HydrophobicContact CB-CG2 3.71Å; L91-T99 HydrophobicContact CD1-CG2 4.49Å; L91-L109 HydrophobicContact CD2-CD1 3.9Å; L91-M131 HydrophobicContact CD1-CE 4.37Å; L91-M131 HydrophobicContact CD1-CG 4.29Å; L91-M131 HydrophobicContact CD1-SD 3.95Å
92	Q	78.3	Confident	78.4	Confident	149 Å²	149	55 Å²	55	70%	0.696	29%	0.288	S	S	*	.	P	Polyproline II helix	trans	-74.9	121.8	-179.4	-175.3	173.2	-21.5	0	0	111.2	T99	Q92-T99 WeakPolarHBondContact O-CA 3.11Å; Q92-T99 WeakPolarHBondContact O-CB 3.4Å
93	V	74.4	Confident	77.4	Confident	49 Å²	49	51.6 Å²	51.6	30%	0.297	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	131.4	173.4	178.5	0	0	0	0	109.3	H69 L91	H69-V93 VanDerWaalsContact CE1-CG2 3.41Å; H69-V93 WeakPolarHBondContact CE1-CG2 3.34Å; H69-V93 VanDerWaalsContact ND1-CG2 3.3Å; H69-V93 WeakPolarHBondContact ND1-CG2 3.44Å; L91-V93 PolarHBondContact O-N 2.84Å
94	M	71.4	Confident	76.9	Confident	126 Å²	126	54.2 Å²	54.2	62%	0.621	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.2	-54.2	-179.5	-68.7	-69.7	-76.1	0	0	111.8	S98 A100	M94-S98 PolarHBondContact N-O 2.81Å; M94-A100 HydrophobicContact CG-CB 3.5Å; M94-A100 VanDerWaalsContact CG-CB 3.5Å; M94-A100 HydrophobicContact SD-CB 4.33Å
95	Y	64.5	Low	76.3	Confident	190 Å²	190	59.8 Å²	59.8	75%	0.745	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.5	133	-174.1	-176.8	-99.8	0	0	0	111.4	Q97 S98	Y95-Q97 VanDerWaalsContact C-N 3.28Å; Y95-Q97 PolarHBondContact O-N 2.83Å; Y95-S98 PolarHBondContact N-O 3.19Å; Y95-S98 WeakPolarHBondContact O-CB 3.36Å; Y95-S98 PolarHBondContact O-N 3.06Å
96	N	63.8	Low	76	Confident	121 Å²	121	59 Å²	59	65%	0.647	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	47	45.9	174.4	-165.5	47.8	0	0	0	114.2	S98	N96-S98 PolarHBondContact O-N 3.29Å
97	Q	70.6	Confident	75.9	Confident	73 Å²	73	59 Å²	59	34%	0.341	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.6	29.8	-178.7	-50.2	-65.6	-36.4	0	0	113.4	D37 N42 H69 Y71 Y95	D37-Q97 WeakPolarHBondContact CB-O 3.38Å; N42-Q97 WeakPolarHBondContact ND2-CG 3.45Å; H69-Q97 PolarHBondContact CE1-OE1 3.48Å; H69-Q97 PolarHBondContact NE2-O 3.12Å; H69-Q97 VanDerWaalsContact NE2-O 3.15Å; Y71-Q97 HydrophobicContact CE1-CG 4.49Å; Y95-Q97 VanDerWaalsContact C-N 3.28Å; Y95-Q97 PolarHBondContact O-N 2.83Å
98	S	64.6	Low	75.7	Confident	22 Å²	22	60 Å²	60	15%	0.154	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	133.3	169.7	-167	0	0	0	0	109	M94 Y95 N96 F128 A130	M94-S98 PolarHBondContact N-O 2.81Å; Y95-S98 PolarHBondContact N-O 3.19Å; Y95-S98 WeakPolarHBondContact O-CB 3.36Å; Y95-S98 PolarHBondContact O-N 3.06Å; N96-S98 PolarHBondContact O-N 3.29Å; S98-F128 PolarHBondContact OG-O 2.62Å; S98-F128 VanDerWaalsContact OG-O 3.05Å; S98-A130 PolarHBondContact OG-N 2.77Å
99	T	68.6	Low	75.6	Confident	11 Å²	11	62.4 Å²	62.4	7%	0.067	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	164.6	175.8	60.1	0	0	0	0	111.6	D37 H69 L91 Q92 A130	D37-T99 WeakPolarHBondContact OD1-CG2 3.44Å; D37-T99 PolarHBondContact OD1-N 3.33Å; D37-T99 PolarHBondContact OD1-OG1 2.95Å; H69-T99 HydrophobicContact CB-CG2 3.81Å; L91-T99 HydrophobicContact CB-CG2 3.71Å; L91-T99 HydrophobicContact CD1-CG2 4.49Å; Q92-T99 WeakPolarHBondContact O-CA 3.11Å; Q92-T99 WeakPolarHBondContact O-CB 3.4Å; T99-A130 WeakPolarHBondContact O-CB 3.41Å
100	A	65.4	Low	75.7	Confident	31 Å²	31	61.9 Å²	61.9	26%	0.256	32%	0.323	S	S	.	.			trans	-66.2	136.5	165.2	0	0	0	0	0	109.9	M94 T102	M94-A100 HydrophobicContact CG-CB 3.5Å; M94-A100 VanDerWaalsContact CG-CB 3.5Å; M94-A100 HydrophobicContact SD-CB 4.33Å; A100-T102 HydrophobicContact CB-CG2 3.82Å; A100-T102 PolarHBondContact O-N 2.82Å; A100-T102 VanDerWaalsContact O-N 3.09Å
101	T	61.1	Low	76	Confident	63 Å²	63	57.6 Å²	57.6	39%	0.387	29%	0.294	S	S	.	.			trans	-63.7	109.4	161.2	-53.3	0	0	0	0	106.9	D134	T101-D134 WeakPolarHBondContact CG2-OD1 3.34Å
102	T	61.1	Low	76.5	Confident	55 Å²	55	59.3 Å²	59.3	34%	0.337	31%	0.307	S	S	.	.			trans	-113.8	-1.9	-175.5	48.7	0	0	0	0	112.5	A100 F104 H105 D134	A100-T102 HydrophobicContact CB-CG2 3.82Å; A100-T102 PolarHBondContact O-N 2.82Å; A100-T102 VanDerWaalsContact O-N 3.09Å; T102-F104 PolarHBondContact O-N 2.95Å; T102-H105 HydrophobicContact CG2-CB 4.27Å; T102-H105 WeakPolarHBondContact OG1-CB 3.39Å; T102-D134 PolarHBondContact N-OD2 2.93Å
103	C	61.7	Low	77.3	Confident	27 Å²	27	52.5 Å²	52.5	18%	0.182	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	-7.4	178.7	-65.7	0	0	0	0	116.6	H138	C103-H138 PolarHBondContact O-CE1 3.22Å
104	F	71.8	Confident	78.3	Confident	59 Å²	59	50.4 Å²	50.4	26%	0.259	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.3	-38.1	-169.7	-55.7	-67.1	0	0	0	112.2	T102 S106 L107 P108 C429 L432 D433 F436	T102-F104 PolarHBondContact O-N 2.95Å; F104-S106 PolarHBondContact O-N 2.79Å; F104-L107 WeakPolarHBondContact O-CB 3.35Å; F104-L107 PolarHBondContact O-N 2.64Å; F104-L107 VanDerWaalsContact O-N 3.15Å; F104-P108 WeakPolarHBondContact O-CD 3.13Å; F104-C429 HydrophobicContact CZ-CB 4.34Å; F104-L432 HydrophobicContact CE1-CB 3.73Å; F104-L432 HydrophobicContact CZ-CB 3.79Å; F104-L432 HydrophobicContact CZ-CD1 4.23Å; F104-D433 HydrophobicContact CD1-CB 4.28Å; F104-D433 HydrophobicContact CE1-CB 3.93Å; F104-F436 HydrophobicContact CB-CD1 4.44Å; F104-F436 WeakPolarHBondContact O-CE1 3.47Å
105	H	78.6	Confident	79.5	Confident	117 Å²	117	45.9 Å²	45.9	54%	0.542	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-29.7	-174.9	-175.9	83.4	0	0	0	112.7	T102 P108	T102-H105 HydrophobicContact CG2-CB 4.27Å; T102-H105 WeakPolarHBondContact OG1-CB 3.39Å; H105-P108 WeakPolarHBondContact O-CD 2.95Å
106	S	88.1	Confident	80.9	Confident	1 Å²	1	40 Å²	40	1%	0.007	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-18.3	178.5	56.9	0	0	0	0	113.3	F104 L109 L110 D134 H138	F104-S106 PolarHBondContact O-N 2.79Å; S106-L109 PolarHBondContact O-N 3.1Å; S106-L110 WeakPolarHBondContact O-CB 3.39Å; S106-L110 WeakPolarHBondContact O-CG 3.3Å; S106-L110 PolarHBondContact O-N 2.75Å; S106-D134 PolarHBondContact OG-OD2 3.01Å; S106-D134 VanDerWaalsContact OG-OD2 3.1Å; S106-H138 PolarHBondContact OG-NE2 2.97Å
107	L	92.1	Very high	82.3	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-55.7	-49.4	-177.4	180	65.4	0	0	0	113.8	F104 L109 L110 R111 H138 L142 D433 F436 L437 L440	F104-L107 WeakPolarHBondContact O-CB 3.35Å; F104-L107 PolarHBondContact O-N 2.64Å; F104-L107 VanDerWaalsContact O-N 3.15Å; L107-L109 VanDerWaalsContact C-N 3.31Å; L107-L109 PolarHBondContact O-N 2.91Å; L107-L110 PolarHBondContact O-N 2.73Å; L107-R111 WeakPolarHBondContact O-CB 3.01Å; L107-R111 PolarHBondContact O-N 2.77Å; L107-H138 HydrophobicContact CD1-CB 3.76Å; L107-L142 HydrophobicContact CD1-CD1 4.39Å; L107-D433 WeakPolarHBondContact CD2-OD1 3.39Å; L107-F436 HydrophobicContact CB-CD1 4.33Å; L107-F436 HydrophobicContact CB-CE1 4.29Å; L107-F436 HydrophobicContact CD2-CB 4.39Å; L107-F436 HydrophobicContact CD2-CD1 3.57Å; L107-F436 HydrophobicContact CD2-CE1 4.21Å; L107-F436 HydrophobicContact CD2-CG 4.25Å; L107-F436 HydrophobicContact CG-CD1 4.47Å; L107-L437 HydrophobicContact CD2-CB 4.28Å; L107-L440 HydrophobicContact CD2-CD1 3.78Å; L107-L440 HydrophobicContact CG-CD1 3.91Å
108	P	92.8	Very high	83.5	Confident	40 Å²	40	38.4 Å²	38.4	26%	0.26	20%	0.2	S	C	.	.	H	α-helix	trans	-60.7	-42.1	-176.3	-21.9	33.2	0	0	0	112	F104 H105 C112 F436 L440	F104-P108 WeakPolarHBondContact O-CD 3.13Å; H105-P108 WeakPolarHBondContact O-CD 2.95Å; P108-C112 PolarHBondContact O-N 3.47Å; P108-C112 VanDerWaalsContact O-N 3.07Å; P108-C112 PolarHBondContact O-SG 2.88Å; P108-F436 HydrophobicContact CG-CE1 3.91Å; P108-F436 HydrophobicContact CG-CZ 3.85Å; P108-L440 HydrophobicContact CB-CD1 4.24Å; P108-L440 HydrophobicContact CB-CD2 4.22Å; P108-L440 HydrophobicContact CG-CD1 4Å; P108-L440 HydrophobicContact CG-CD2 4.14Å
109	L	92.9	Very high	85	Confident	55 Å²	55	37.8 Å²	37.8	29%	0.288	20%	0.195	S	C	.	.	H	α-helix	trans	-71.8	-45.3	-179.1	-66.5	173.9	0	0	0	111.7	L89 P90 L91 S106 L107 C112 V113	L89-L109 HydrophobicContact CB-CD1 4.46Å; L89-L109 HydrophobicContact CD1-CB 4.22Å; L89-L109 HydrophobicContact CD2-CB 4.39Å; P90-L109 HydrophobicContact CG-CD1 4.15Å; L91-L109 HydrophobicContact CD2-CD1 3.9Å; S106-L109 PolarHBondContact O-N 3.1Å; L107-L109 VanDerWaalsContact C-N 3.31Å; L107-L109 PolarHBondContact O-N 2.91Å; L109-C112 WeakPolarHBondContact O-CB 3.47Å; L109-C112 PolarHBondContact O-N 3.35Å; L109-V113 PolarHBondContact O-N 3Å; L109-V113 VanDerWaalsContact O-N 3.08Å
110	L	94.6	Very high	86.2	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-65.6	-42.1	178.1	-73.5	171.3	0	0	0	111.6	A67 L89 S106 L107 C112 V113 F114 M131 A135	A67-L110 HydrophobicContact CB-CD2 4.4Å; L89-L110 HydrophobicContact CD1-CD2 3.97Å; L89-L110 HydrophobicContact CD1-CG 4.38Å; S106-L110 WeakPolarHBondContact O-CB 3.39Å; S106-L110 WeakPolarHBondContact O-CG 3.3Å; S106-L110 PolarHBondContact O-N 2.75Å; L107-L110 PolarHBondContact O-N 2.73Å; L110-C112 VanDerWaalsContact C-N 3.29Å; L110-C112 PolarHBondContact O-N 2.9Å; L110-V113 PolarHBondContact O-N 3.09Å; L110-V113 VanDerWaalsContact O-N 3.16Å; L110-F114 HydrophobicContact CB-CE1 4.5Å; L110-F114 HydrophobicContact CB-CE2 4.02Å; L110-F114 HydrophobicContact CB-CZ 3.99Å; L110-F114 HydrophobicContact CD2-CE1 4.15Å; L110-F114 HydrophobicContact CD2-CZ 3.95Å; L110-F114 HydrophobicContact CG-CZ 4.43Å; L110-F114 WeakPolarHBondContact O-CB 3.46Å; L110-F114 WeakPolarHBondContact O-CD1 3.38Å; L110-F114 WeakPolarHBondContact O-CD2 3.44Å; L110-F114 WeakPolarHBondContact O-CG 3.44Å; L110-F114 PolarHBondContact O-N 2.97Å; L110-M131 HydrophobicContact CD2-CE 4.18Å; L110-A135 HydrophobicContact CD1-CB 3.99Å; L110-A135 HydrophobicContact CD2-CB 4.48Å
111	R	95.1	Very high	87.8	Confident	7 Å²	7	38 Å²	38	3%	0.026	19%	0.193	C	C	.	.	H	α-helix	trans	-55.6	-46.2	171.5	174.9	-179.4	168.7	-107.1	3.4	110.9	L107 V113 F114 V115 L142 A444 D446	L107-R111 WeakPolarHBondContact O-CB 3.01Å; L107-R111 PolarHBondContact O-N 2.77Å; R111-V113 VanDerWaalsContact C-N 3.32Å; R111-V113 PolarHBondContact O-N 2.98Å; R111-F114 PolarHBondContact O-N 3.46Å; R111-V115 HydrophobicContact CG-CG2 3.99Å; R111-V115 WeakPolarHBondContact O-CB 3.38Å; R111-V115 WeakPolarHBondContact O-CG2 3.43Å; R111-V115 PolarHBondContact O-N 3.07Å; R111-L142 HydrophobicContact CB-CD1 4.29Å; R111-L142 HydrophobicContact CG-CD2 4.2Å; R111-A444 PolarHBondContact NH1-O 2.89Å; R111-A444 PolarHBondContact NH2-O 3.18Å; R111-D446 IonicContact CZ-OD1 2.68Å; R111-D446 VanDerWaalsContact CZ-OD1 3.25Å; R111-D446 IonicContact NE-OD1 2.61Å; R111-D446 PolarHBondContact NE-OD1 2.91Å; R111-D446 IonicContact NH2-OD1 3.57Å; R111-D446 PolarHBondContact NH2-OD1 3.12Å
112	C	94.2	Very high	89.5	Confident	50 Å²	50	35 Å²	35	34%	0.338	18%	0.175	S	C	.	.	H	α-helix	trans	-56.4	-47.4	177.5	-76.6	0	0	0	0	111.7	P108 L109 L110 R116 M449	P108-C112 PolarHBondContact O-N 3.47Å; P108-C112 VanDerWaalsContact O-N 3.07Å; P108-C112 PolarHBondContact O-SG 2.88Å; L109-C112 WeakPolarHBondContact O-CB 3.47Å; L109-C112 PolarHBondContact O-N 3.35Å; L110-C112 VanDerWaalsContact C-N 3.29Å; L110-C112 PolarHBondContact O-N 2.9Å; C112-R116 VanDerWaalsContact O-CB 3.22Å; C112-R116 WeakPolarHBondContact O-CB 3.23Å; C112-R116 VanDerWaalsContact O-CD 3.23Å; C112-R116 WeakPolarHBondContact O-CD 3.48Å; C112-R116 WeakPolarHBondContact O-CG 3.36Å; C112-R116 PolarHBondContact O-N 3.38Å; C112-R116 VanDerWaalsContact O-N 3.14Å; C112-M449 HydrophobicContact CB-CE 4.04Å
113	V	95.4	Very high	91.3	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.03	16%	0.159	C	C	.	.	H	α-helix	trans	-62.8	-49	176.5	177.5	0	0	0	0	111.1	Y87 L89 L109 L110 R111 V115 E117	Y87-V113 HydrophobicContact CD1-CG2 3.72Å; Y87-V113 HydrophobicContact CD2-CG1 3.81Å; Y87-V113 HydrophobicContact CD2-CG2 4.27Å; Y87-V113 HydrophobicContact CE1-CG2 4.08Å; Y87-V113 HydrophobicContact CE2-CG1 3.9Å; Y87-V113 HydrophobicContact CG-CG1 4.21Å; Y87-V113 HydrophobicContact CG-CG2 3.82Å; L89-V113 HydrophobicContact CD2-CG2 4.21Å; L109-V113 PolarHBondContact O-N 3Å; L109-V113 VanDerWaalsContact O-N 3.08Å; L110-V113 PolarHBondContact O-N 3.09Å; L110-V113 VanDerWaalsContact O-N 3.16Å; R111-V113 VanDerWaalsContact C-N 3.32Å; R111-V113 PolarHBondContact O-N 2.98Å; V113-V115 PolarHBondContact O-N 3.05Å; V113-E117 HydrophobicContact CG1-CG 4.35Å; V113-E117 VanDerWaalsContact O-CB 3.27Å; V113-E117 WeakPolarHBondContact O-CB 3.27Å; V113-E117 WeakPolarHBondContact O-CG 3.33Å; V113-E117 PolarHBondContact O-N 3.42Å
114	F	96.4	Very high	92.9	Very high	6 Å²	6	31.1 Å²	31.1	3%	0.026	15%	0.15	C	C	.	.	H	α-helix	trans	-63.8	-45	-173.6	-61.8	-13.2	0	0	0	112.7	C33 L110 R111 R118 I119 V122 A135 A139 L142 L144	C33-F114 HydrophobicContact CB-CD1 4.31Å; C33-F114 HydrophobicContact CB-CE1 4.1Å; L110-F114 HydrophobicContact CB-CE1 4.5Å; L110-F114 HydrophobicContact CB-CE2 4.02Å; L110-F114 HydrophobicContact CB-CZ 3.99Å; L110-F114 HydrophobicContact CD2-CE1 4.15Å; L110-F114 HydrophobicContact CD2-CZ 3.95Å; L110-F114 HydrophobicContact CG-CZ 4.43Å; L110-F114 WeakPolarHBondContact O-CB 3.46Å; L110-F114 WeakPolarHBondContact O-CD1 3.38Å; L110-F114 WeakPolarHBondContact O-CD2 3.44Å; L110-F114 WeakPolarHBondContact O-CG 3.44Å; L110-F114 PolarHBondContact O-N 2.97Å; R111-F114 PolarHBondContact O-N 3.46Å; F114-R118 PolarHBondContact O-N 2.67Å; F114-I119 HydrophobicContact CB-CB 4.29Å; F114-I119 HydrophobicContact CB-CG1 4.41Å; F114-I119 HydrophobicContact CD1-CB 4.46Å; F114-I119 HydrophobicContact CD1-CG1 4.19Å; F114-I119 PolarHBondContact O-N 3.12Å; F114-V122 HydrophobicContact CD1-CG2 4.36Å; F114-V122 HydrophobicContact CD2-CG2 4.38Å; F114-V122 HydrophobicContact CE1-CG2 3.95Å; F114-V122 HydrophobicContact CE2-CG2 3.99Å; F114-V122 HydrophobicContact CZ-CG1 4.19Å; F114-V122 HydrophobicContact CZ-CG2 3.75Å; F114-A135 HydrophobicContact CZ-CB 4.33Å; F114-A139 HydrophobicContact CE2-CB 4.4Å; F114-L142 HydrophobicContact CD2-CD1 3.65Å; F114-L142 HydrophobicContact CE2-CD1 4.32Å; F114-L144 HydrophobicContact CB-CD1 4.01Å; F114-L144 HydrophobicContact CD2-CD1 3.71Å; F114-L144 HydrophobicContact CE2-CD1 4.44Å; F114-L144 HydrophobicContact CG-CD1 4Å
115	V	95.6	Very high	94	Very high	31 Å²	31	28.3 Å²	28.3	19%	0.188	14%	0.138	C	C	.	.	H	α-helix	trans	-68.9	-50.4	179.6	175.5	0	0	0	0	110.5	R111 V113 E117 R118 D446 M449 M451	R111-V115 HydrophobicContact CG-CG2 3.99Å; R111-V115 WeakPolarHBondContact O-CB 3.38Å; R111-V115 WeakPolarHBondContact O-CG2 3.43Å; R111-V115 PolarHBondContact O-N 3.07Å; V113-V115 PolarHBondContact O-N 3.05Å; V115-E117 VanDerWaalsContact C-N 3.29Å; V115-E117 PolarHBondContact O-N 2.95Å; V115-R118 PolarHBondContact O-N 3.33Å; V115-R118 VanDerWaalsContact O-N 3.12Å; V115-D446 HydrophobicContact CG1-CB 4.18Å; V115-M449 HydrophobicContact CB-CE 4.24Å; V115-M449 HydrophobicContact CB-SD 4.01Å; V115-M449 HydrophobicContact CG1-CB 4.27Å; V115-M449 HydrophobicContact CG1-CE 4.41Å; V115-M449 HydrophobicContact CG1-SD 3.76Å; V115-M449 HydrophobicContact CG2-SD 4.44Å; V115-M451 WeakPolarHBondContact O-CE 3.44Å
116	R	94.1	Very high	94.4	Very high	67 Å²	67	22.9 Å²	22.9	25%	0.253	11%	0.113	S	C	.	.	H	α-helix	trans	-62.1	-37.6	-177.3	-66.8	172	62.3	88.9	17.1	112.3	C112 R118 M449 D450 M451 A452	C112-R116 VanDerWaalsContact O-CB 3.22Å; C112-R116 WeakPolarHBondContact O-CB 3.23Å; C112-R116 VanDerWaalsContact O-CD 3.23Å; C112-R116 WeakPolarHBondContact O-CD 3.48Å; C112-R116 WeakPolarHBondContact O-CG 3.36Å; C112-R116 PolarHBondContact O-N 3.38Å; C112-R116 VanDerWaalsContact O-N 3.14Å; R116-R118 VanDerWaalsContact C-N 3.33Å; R116-M449 HydrophobicContact CG-CE 3.91Å; R116-D450 WeakPolarHBondContact CG-O 3.33Å; R116-D450 IonicContact CZ-OD1 3.98Å; R116-D450 IonicContact CZ-OD2 2.6Å; R116-D450 IonicContact NH1-OD1 3.45Å; R116-D450 PolarHBondContact NH1-OD1 3.25Å; R116-D450 IonicContact NH1-OD2 2.91Å; R116-D450 PolarHBondContact NH1-OD2 2.98Å; R116-D450 IonicContact NH2-OD1 2.91Å; R116-D450 IonicContact NH2-OD2 3.73Å; R116-D450 PolarHBondContact NH2-OD2 3.23Å; R116-M451 WeakPolarHBondContact O-CE 3.38Å; R116-A452 HydrophobicContact CB-CB 4.2Å; R116-A452 WeakPolarHBondContact O-CB 3.34Å; R116-A452 PolarHBondContact O-N 3.45Å
117	E	94.4	Very high	94.2	Very high	2 Å²	2	23.1 Å²	23.1	1%	0.009	12%	0.115	C	C	.	.	H	α-helix	trans	-86.6	-3.2	-179.3	-63.5	-68.6	-179.3	0	0	113.7	K63 V65 K85 Y87 V113 V115 I119 A452	K63-E117 WeakPolarHBondContact CE-O 3.46Å; K63-E117 WeakPolarHBondContact CE-OE2 3.47Å; K63-E117 PolarHBondContact NZ-O 3.02Å; K63-E117 IonicContact NZ-OE2 3.34Å; K63-E117 PolarHBondContact NZ-OE2 2.89Å; V65-E117 HydrophobicContact CG1-CG 4.13Å; V65-E117 HydrophobicContact CG2-CG 4.3Å; K85-E117 WeakPolarHBondContact CD-OE1 3.18Å; K85-E117 VanDerWaalsContact CE-OE1 3.3Å; K85-E117 WeakPolarHBondContact CE-OE1 3.49Å; K85-E117 IonicContact NZ-OE1 3.78Å; K85-E117 PolarHBondContact NZ-OE1 2.88Å; Y87-E117 HydrophobicContact CE2-CG 3.97Å; Y87-E117 WeakPolarHBondContact CE2-OE1 3.29Å; Y87-E117 VanDerWaalsContact CZ-OE1 3.3Å; Y87-E117 PolarHBondContact OH-OE1 3.29Å; V113-E117 HydrophobicContact CG1-CG 4.35Å; V113-E117 VanDerWaalsContact O-CB 3.27Å; V113-E117 WeakPolarHBondContact O-CB 3.27Å; V113-E117 WeakPolarHBondContact O-CG 3.33Å; V113-E117 PolarHBondContact O-N 3.42Å; V115-E117 VanDerWaalsContact C-N 3.29Å; V115-E117 PolarHBondContact O-N 2.95Å; E117-I119 VanDerWaalsContact C-N 3.29Å; E117-I119 HydrophobicContact CB-CD1 3.56Å; E117-I119 HydrophobicContact CB-CG1 3.83Å; E117-I119 PolarHBondContact O-N 2.78Å; E117-A452 HydrophobicContact CG-CB 4.17Å; E117-A452 VanDerWaalsContact OE1-CB 3.28Å; E117-A452 WeakPolarHBondContact OE1-CB 3.45Å; E117-A452 VanDerWaalsContact OE2-CB 3.26Å; E117-A452 WeakPolarHBondContact OE2-CB 3.48Å
118	R	94.6	Very high	93.7	Very high	157 Å²	157	26.9 Å²	26.9	59%	0.592	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	42.8	-174	-57.6	-178.9	175	165.5	-2.5	112.4	N31 F114 V115 R116 T120 M451	N31-R118 WeakPolarHBondContact CB-O 3.39Å; N31-R118 PolarHBondContact ND2-O 3.35Å; F114-R118 PolarHBondContact O-N 2.67Å; V115-R118 PolarHBondContact O-N 3.33Å; V115-R118 VanDerWaalsContact O-N 3.12Å; R116-R118 VanDerWaalsContact C-N 3.33Å; R118-T120 PolarHBondContact O-N 3.09Å; R118-M451 HydrophobicContact CG-CE 3.2Å; R118-M451 HydrophobicContact CG-SD 4.44Å
119	I	96.4	Very high	93.4	Very high	9 Å²	9	25 Å²	25	5%	0.046	12%	0.119	C	C	.	.			trans	-60.9	132.4	-177	-59.6	-55.6	0	0	0	109.9	N31 C33 V65 F114 E117 V121 V122 L144	N31-I119 HydrophobicContact CB-CD1 4.47Å; N31-I119 WeakPolarHBondContact O-CA 3.45Å; C33-I119 HydrophobicContact CB-CD1 3.84Å; C33-I119 HydrophobicContact CB-CG1 3.91Å; C33-I119 HydrophobicContact CB-CG2 3.82Å; V65-I119 HydrophobicContact CG2-CD1 3.82Å; F114-I119 HydrophobicContact CB-CB 4.29Å; F114-I119 HydrophobicContact CB-CG1 4.41Å; F114-I119 HydrophobicContact CD1-CB 4.46Å; F114-I119 HydrophobicContact CD1-CG1 4.19Å; F114-I119 PolarHBondContact O-N 3.12Å; E117-I119 VanDerWaalsContact C-N 3.29Å; E117-I119 HydrophobicContact CB-CD1 3.56Å; E117-I119 HydrophobicContact CB-CG1 3.83Å; E117-I119 PolarHBondContact O-N 2.78Å; I119-V121 VanDerWaalsContact CG2-O 3.28Å; I119-V121 WeakPolarHBondContact CG2-O 3.38Å; I119-V122 HydrophobicContact CG2-CG2 3.89Å; I119-L144 HydrophobicContact CG2-CD1 4.49Å; I119-L144 WeakPolarHBondContact O-CD2 3.49Å
120	T	94.8	Very high	93.1	Very high	47 Å²	47	22.7 Å²	22.7	29%	0.288	11%	0.108	S	C	.	.	S	Bend	trans	-106.9	-30.5	174.4	57.6	0	0	0	0	111.3	N31 R118 N145	N31-T120 HydrophobicContact CB-CG2 4.46Å; N31-T120 PolarHBondContact N-OG1 2.75Å; N31-T120 VanDerWaalsContact N-OG1 3.12Å; N31-T120 PolarHBondContact O-N 3.27Å; N31-T120 PolarHBondContact O-OG1 3.15Å; R118-T120 PolarHBondContact O-N 3.09Å; T120-N145 PolarHBondContact O-N 2.93Å
121	V	97.4	Very high	92.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	124.9	179.5	-177.3	0	0	0	0	110.3	N31 I32 C33 I119 N145 V147 Y396 V399	N31-V121 PolarHBondContact O-N 3.25Å; N31-V121 VanDerWaalsContact O-N 3.14Å; I32-V121 WeakPolarHBondContact CA-O 3.41Å; I32-V121 HydrophobicContact CG1-CB 4.4Å; C33-V121 PolarHBondContact N-O 2.97Å; I119-V121 VanDerWaalsContact CG2-O 3.28Å; I119-V121 WeakPolarHBondContact CG2-O 3.38Å; V121-N145 WeakPolarHBondContact CA-O 3.32Å; V121-N145 HydrophobicContact CG2-CB 4.42Å; V121-V147 HydrophobicContact CG1-CG2 3.99Å; V121-Y396 HydrophobicContact CG1-CD1 3.82Å; V121-Y396 HydrophobicContact CG1-CE1 3.94Å; V121-V399 HydrophobicContact CG2-CG2 4.47Å
122	V	98.1	Very high	92.7	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	116.3	168.3	176.9	0	0	0	0	108.2	V35 F114 I119 A135 A139 L144 N145 T146 V147	V35-V122 HydrophobicContact CG2-CG1 3.88Å; F114-V122 HydrophobicContact CD1-CG2 4.36Å; F114-V122 HydrophobicContact CD2-CG2 4.38Å; F114-V122 HydrophobicContact CE1-CG2 3.95Å; F114-V122 HydrophobicContact CE2-CG2 3.99Å; F114-V122 HydrophobicContact CZ-CG1 4.19Å; F114-V122 HydrophobicContact CZ-CG2 3.75Å; I119-V122 HydrophobicContact CG2-CG2 3.89Å; V122-A135 HydrophobicContact CG1-CB 4.24Å; V122-A139 HydrophobicContact CB-CB 3.85Å; V122-A139 HydrophobicContact CG1-CB 4.24Å; V122-A139 HydrophobicContact CG2-CB 3.69Å; V122-L144 HydrophobicContact CG2-CD1 3.97Å; V122-N145 PolarHBondContact N-O 3.39Å; V122-T146 HydrophobicContact CB-CG2 4.5Å; V122-T146 WeakPolarHBondContact O-CA 3.02Å; V122-V147 PolarHBondContact O-N 3.37Å
123	H	98.1	Very high	92.6	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	99.2	-179.7	-172.7	-162.8	0	0	0	110.4	I32 C33 M34 V35 H125 V147 T149 Y396	I32-H123 HydrophobicContact CG2-CB 4.16Å; C33-H123 PolarHBondContact O-N 3.31Å; M34-H123 CarbonylContact C-O 3.56Å; M34-H123 VanDerWaalsContact CA-O 3.3Å; M34-H123 WeakPolarHBondContact CA-O 3.31Å; M34-H123 HydrophobicContact SD-CB 3.68Å; M34-H123 PolarHBondContact SD-ND1 2.91Å; M34-H123 VanDerWaalsContact SD-ND1 3.39Å; V35-H123 PolarHBondContact N-O 3.43Å; H123-H125 AromaticContact CD2-CE1 3.77Å; H123-H125 AromaticContact CE1-CE1 3.49Å; H123-H125 PolarHBondContact CE1-CE1 2.99Å; H123-H125 VanDerWaalsContact CE1-CE1 3.49Å; H123-H125 AromaticContact CE1-NE2 3.26Å; H123-H125 PolarHBondContact CE1-NE2 3.44Å; H123-H125 VanDerWaalsContact CE1-NE2 3.26Å; H123-H125 AromaticContact CG-CE1 3.53Å; H123-H125 AromaticContact ND1-CE1 3.31Å; H123-H125 PolarHBondContact ND1-CE1 3.28Å; H123-H125 VanDerWaalsContact ND1-CE1 3.31Å; H123-H125 AromaticContact ND1-NE2 3.55Å; H123-H125 AromaticContact NE2-CE1 3.78Å; H123-H125 AromaticContact NE2-NE2 3.65Å; H123-H125 PolarHBondContact O-CE1 3.25Å; H123-H125 PolarHBondContact O-ND1 3.4Å; H123-H125 VanDerWaalsContact O-ND1 3.11Å; H123-V147 CarbonylContact C-O 3.6Å; H123-V147 WeakPolarHBondContact CA-O 3.45Å; H123-V147 HydrophobicContact CB-CB 4.45Å; H123-V147 PolarHBondContact CD2-O 2.93Å; H123-T149 PolarHBondContact CE1-OG1 2.85Å; H123-T149 PolarHBondContact NE2-OG1 2.87Å; H123-Y396 HydrophobicContact CB-CE1 4.4Å; H123-Y396 AromaticContact ND1-CZ 3.88Å; H123-Y396 PolarHBondContact ND1-OH 3.04Å
124	A	96.3	Very high	92.4	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	143.4	-176.2	0	0	0	0	0	111.2	V35 A132 L136 V147 F148 T149	V35-A124 WeakPolarHBondContact O-CA 3.36Å; A124-A132 HydrophobicContact CB-CB 3.93Å; A124-L136 HydrophobicContact CB-CD1 3.96Å; A124-L136 HydrophobicContact CB-CD2 3.69Å; A124-L136 HydrophobicContact CB-CG 3.55Å; A124-V147 PolarHBondContact N-O 3.38Å; A124-F148 HydrophobicContact CB-CD2 3.95Å; A124-F148 CarbonylContact O-C 3.53Å; A124-F148 VanDerWaalsContact O-CA 3.31Å; A124-F148 WeakPolarHBondContact O-CA 3.28Å; A124-F148 WeakPolarHBondContact O-CD2 3.39Å; A124-T149 PolarHBondContact O-N 2.94Å
125	H	94.4	Very high	92.2	Very high	0 Å²	0	20 Å²	20	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141.8	-175.8	-63	74.8	0	0	0	112.2	M34 V35 S36 V46 I50 H123 H151	M34-H125 VanDerWaalsContact SD-CE1 3.55Å; V35-H125 PolarHBondContact O-N 3.31Å; S36-H125 PolarHBondContact OG-O 3.26Å; S36-H125 VanDerWaalsContact OG-O 3.06Å; V46-H125 HydrophobicContact CG1-CB 4.48Å; I50-H125 HydrophobicContact CD1-CB 3.83Å; I50-H125 HydrophobicContact CG1-CB 4.13Å; H123-H125 AromaticContact CD2-CE1 3.77Å; H123-H125 AromaticContact CE1-CE1 3.49Å; H123-H125 PolarHBondContact CE1-CE1 2.99Å; H123-H125 VanDerWaalsContact CE1-CE1 3.49Å; H123-H125 AromaticContact CE1-NE2 3.26Å; H123-H125 PolarHBondContact CE1-NE2 3.44Å; H123-H125 VanDerWaalsContact CE1-NE2 3.26Å; H123-H125 AromaticContact CG-CE1 3.53Å; H123-H125 AromaticContact ND1-CE1 3.31Å; H123-H125 PolarHBondContact ND1-CE1 3.28Å; H123-H125 VanDerWaalsContact ND1-CE1 3.31Å; H123-H125 AromaticContact ND1-NE2 3.55Å; H123-H125 AromaticContact NE2-CE1 3.78Å; H123-H125 AromaticContact NE2-NE2 3.65Å; H123-H125 PolarHBondContact O-CE1 3.25Å; H123-H125 PolarHBondContact O-ND1 3.4Å; H123-H125 VanDerWaalsContact O-ND1 3.11Å; H125-H151 AromaticContact CD2-NE2 3.46Å; H125-H151 PolarHBondContact CD2-NE2 3.07Å
126	S	87.5	Confident	92.1	Very high	4 Å²	4	18.7 Å²	18.7	3%	0.028	8%	0.083	C	C	.	.			trans	72.2	124.3	176.6	-174.2	0	0	0	0	114.9	F128 S129 T149	S126-F128 PolarHBondContact O-N 3.12Å; S126-F128 VanDerWaalsContact O-N 3.12Å; S126-F128 PolarHBondContact OG-N 3.38Å; S126-S129 PolarHBondContact O-N 3.39Å; S126-S129 VanDerWaalsContact O-N 3.1Å; S126-T149 PolarHBondContact N-O 3.37Å
127	S	83.5	Confident	92	Very high	6 Å²	6	16.7 Å²	16.7	4%	0.042	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-19.6	172.9	-69.4	0	0	0	0	114.4	H133 D150 L168	S127-H133 PolarHBondContact O-NE2 3.1Å; S127-D150 PolarHBondContact OG-OD1 3.38Å; S127-D150 PolarHBondContact OG-OD2 3.24Å; S127-L168 WeakPolarHBondContact OG-CD2 3.32Å
128	F	81.2	Confident	92	Very high	79 Å²	79	16.6 Å²	16.6	35%	0.346	8%	0.075	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-5.2	178.6	-67.7	-75.3	0	0	0	114.2	F38 S98 S126 S152 F154	F38-F128 HydrophobicContact CE2-CB 3.87Å; F38-F128 HydrophobicContact CZ-CB 4.02Å; S98-F128 PolarHBondContact OG-O 2.62Å; S98-F128 VanDerWaalsContact OG-O 3.05Å; S126-F128 PolarHBondContact O-N 3.12Å; S126-F128 VanDerWaalsContact O-N 3.12Å; S126-F128 PolarHBondContact OG-N 3.38Å; F128-S152 WeakPolarHBondContact CD2-OG 3.47Å; F128-S152 WeakPolarHBondContact CE2-OG 3.47Å; F128-F154 HydrophobicContact CD1-CZ 4.11Å; F128-F154 HydrophobicContact CD2-CZ 4.31Å; F128-F154 AromaticContact CE1-CE1 3.5Å; F128-F154 HydrophobicContact CE1-CE1 3.5Å; F128-F154 HydrophobicContact CE1-CE2 4.48Å; F128-F154 AromaticContact CE1-CZ 3.39Å; F128-F154 HydrophobicContact CE1-CZ 3.39Å; F128-F154 HydrophobicContact CE2-CE1 4.26Å; F128-F154 AromaticContact CE2-CE2 3.97Å; F128-F154 HydrophobicContact CE2-CE2 3.97Å; F128-F154 AromaticContact CE2-CZ 3.62Å; F128-F154 HydrophobicContact CE2-CZ 3.62Å; F128-F154 HydrophobicContact CZ-CD1 4.24Å; F128-F154 AromaticContact CZ-CE1 3.33Å; F128-F154 HydrophobicContact CZ-CE1 3.33Å; F128-F154 AromaticContact CZ-CE2 3.85Å; F128-F154 HydrophobicContact CZ-CE2 3.85Å; F128-F154 AromaticContact CZ-CZ 3.11Å; F128-F154 HydrophobicContact CZ-CZ 3.11Å
129	S	86.9	Confident	92	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.047	C	C	.	.			trans	-88.5	109.3	179.3	173.2	0	0	0	0	110	D37 S126 M131 A132 H133	D37-S129 PolarHBondContact N-OG 3.06Å; D37-S129 WeakPolarHBondContact OD2-CA 3.43Å; D37-S129 VanDerWaalsContact OD2-CB 3.25Å; D37-S129 WeakPolarHBondContact OD2-CB 3.44Å; D37-S129 PolarHBondContact OD2-OG 2.86Å; S126-S129 PolarHBondContact O-N 3.39Å; S126-S129 VanDerWaalsContact O-N 3.1Å; S129-M131 VanDerWaalsContact C-N 3.29Å; S129-A132 VanDerWaalsContact CB-CB 3.47Å; S129-A132 WeakPolarHBondContact O-CB 3.35Å; S129-A132 PolarHBondContact O-N 2.89Å; S129-A132 VanDerWaalsContact OG-CB 3.23Å; S129-A132 WeakPolarHBondContact OG-CB 3.35Å; S129-A132 PolarHBondContact OG-N 2.87Å; S129-H133 PolarHBondContact O-CD2 2.91Å; S129-H133 PolarHBondContact O-N 3.25Å
130	A	86.7	Confident	91.8	Very high	7 Å²	7	9.3 Å²	9.3	6%	0.058	5%	0.048	C	C	.	.	H	α-helix	trans	-62.7	-39	173	0	0	0	0	0	111.5	D37 S98 T99 A132 H133 D134	D37-A130 PolarHBondContact OD2-N 3.49Å; S98-A130 PolarHBondContact OG-N 2.77Å; T99-A130 WeakPolarHBondContact O-CB 3.41Å; A130-A132 VanDerWaalsContact C-N 3.3Å; A130-A132 PolarHBondContact O-N 2.8Å; A130-H133 PolarHBondContact O-N 2.85Å; A130-D134 PolarHBondContact O-N 3.49Å
131	M	89.7	Confident	91.7	Very high	1 Å²	1	7.7 Å²	7.7	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-62.8	-35.7	176.4	-176.2	177.1	169.6	0	0	112.3	V35 D37 A67 L89 L91 L110 S129 A135	V35-M131 HydrophobicContact CG1-CE 3.89Å; V35-M131 HydrophobicContact CG1-CG 3.86Å; V35-M131 HydrophobicContact CG1-SD 4.43Å; D37-M131 VanDerWaalsContact OD2-CB 3.27Å; D37-M131 WeakPolarHBondContact OD2-CB 3.21Å; D37-M131 PolarHBondContact OD2-N 2.88Å; A67-M131 HydrophobicContact CB-CE 3.7Å; A67-M131 WeakPolarHBondContact O-CE 3.46Å; L89-M131 HydrophobicContact CD1-CE 3.67Å; L89-M131 HydrophobicContact CG-CE 4.37Å; L91-M131 HydrophobicContact CD1-CE 4.37Å; L91-M131 HydrophobicContact CD1-CG 4.29Å; L91-M131 HydrophobicContact CD1-SD 3.95Å; L110-M131 HydrophobicContact CD2-CE 4.18Å; S129-M131 VanDerWaalsContact C-N 3.29Å; M131-A135 VanDerWaalsContact O-CB 3.25Å; M131-A135 WeakPolarHBondContact O-CB 3.45Å; M131-A135 PolarHBondContact O-N 2.92Å
132	A	91.7	Very high	91.5	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-61.7	-46.1	174.6	0	0	0	0	0	111.1	A124 S129 A130 A135 L136	A124-A132 HydrophobicContact CB-CB 3.93Å; S129-A132 VanDerWaalsContact CB-CB 3.47Å; S129-A132 WeakPolarHBondContact O-CB 3.35Å; S129-A132 PolarHBondContact O-N 2.89Å; S129-A132 VanDerWaalsContact OG-CB 3.23Å; S129-A132 WeakPolarHBondContact OG-CB 3.35Å; S129-A132 PolarHBondContact OG-N 2.87Å; A130-A132 VanDerWaalsContact C-N 3.3Å; A130-A132 PolarHBondContact O-N 2.8Å; A132-A135 PolarHBondContact O-N 3.04Å; A132-L136 WeakPolarHBondContact O-CG 3.31Å; A132-L136 PolarHBondContact O-N 2.69Å
133	H	90.9	Very high	91.3	Very high	7 Å²	7	11 Å²	11	3%	0.032	7%	0.065	C	C	.	.	H	α-helix	trans	-67.1	-44	178.1	-63	-56.2	0	0	0	112.6	S127 S129 A130 A135 L136 F137 S171	S127-H133 PolarHBondContact O-NE2 3.1Å; S129-H133 PolarHBondContact O-CD2 2.91Å; S129-H133 PolarHBondContact O-N 3.25Å; A130-H133 PolarHBondContact O-N 2.85Å; H133-A135 VanDerWaalsContact C-N 3.32Å; H133-A135 PolarHBondContact O-N 3.17Å; H133-L136 PolarHBondContact O-N 2.79Å; H133-F137 PolarHBondContact O-N 3.4Å; H133-S171 VanDerWaalsContact ND1-CB 3.3Å; H133-S171 WeakPolarHBondContact ND1-CB 3.38Å
134	D	90.6	Very high	91.2	Very high	4 Å²	4	12.2 Å²	12.2	2%	0.021	7%	0.072	C	C	.	.	H	α-helix	trans	-58.4	-45.2	174.4	-84.9	4.5	0	0	0	110.6	T101 T102 S106 A130 L136 F137 H138	T101-D134 WeakPolarHBondContact CG2-OD1 3.34Å; T102-D134 PolarHBondContact N-OD2 2.93Å; S106-D134 PolarHBondContact OG-OD2 3.01Å; S106-D134 VanDerWaalsContact OG-OD2 3.1Å; A130-D134 PolarHBondContact O-N 3.49Å; D134-L136 PolarHBondContact O-N 2.91Å; D134-F137 WeakPolarHBondContact O-CB 3.4Å; D134-F137 PolarHBondContact O-N 2.91Å; D134-H138 WeakPolarHBondContact O-CB 3.44Å; D134-H138 PolarHBondContact O-CD2 3.27Å; D134-H138 VanDerWaalsContact O-CG 3.24Å; D134-H138 PolarHBondContact O-N 2.94Å
135	A	93.8	Very high	91.2	Very high	0 Å²	0	13.1 Å²	13.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-65.1	-38.5	179.4	0	0	0	0	0	113.3	V35 L110 F114 V122 M131 A132 H133 F137 A139	V35-A135 HydrophobicContact CB-CB 4.04Å; V35-A135 HydrophobicContact CG1-CB 3.64Å; V35-A135 HydrophobicContact CG2-CB 3.94Å; L110-A135 HydrophobicContact CD1-CB 3.99Å; L110-A135 HydrophobicContact CD2-CB 4.48Å; F114-A135 HydrophobicContact CZ-CB 4.33Å; V122-A135 HydrophobicContact CG1-CB 4.24Å; M131-A135 VanDerWaalsContact O-CB 3.25Å; M131-A135 WeakPolarHBondContact O-CB 3.45Å; M131-A135 PolarHBondContact O-N 2.92Å; A132-A135 PolarHBondContact O-N 3.04Å; H133-A135 VanDerWaalsContact C-N 3.32Å; H133-A135 PolarHBondContact O-N 3.17Å; A135-F137 VanDerWaalsContact C-N 3.32Å; A135-A139 WeakPolarHBondContact O-CB 3.25Å; A135-A139 PolarHBondContact O-N 2.84Å
136	L	93.8	Very high	91.3	Very high	3 Å²	3	13.1 Å²	13.1	2%	0.016	8%	0.077	C	C	.	.	H	α-helix	trans	-59.5	-45.8	172	-72.4	173.5	0	0	0	111.1	A124 A132 H133 D134 K140 T146 F148 L172 T175	A124-L136 HydrophobicContact CB-CD1 3.96Å; A124-L136 HydrophobicContact CB-CD2 3.69Å; A124-L136 HydrophobicContact CB-CG 3.55Å; A132-L136 WeakPolarHBondContact O-CG 3.31Å; A132-L136 PolarHBondContact O-N 2.69Å; H133-L136 PolarHBondContact O-N 2.79Å; D134-L136 PolarHBondContact O-N 2.91Å; L136-K140 WeakPolarHBondContact O-CG 3.5Å; L136-K140 PolarHBondContact O-N 3.34Å; L136-T146 HydrophobicContact CD2-CG2 4Å; L136-F148 HydrophobicContact CD1-CB 4.18Å; L136-F148 HydrophobicContact CD1-CD2 3.76Å; L136-F148 HydrophobicContact CD1-CG 4.24Å; L136-L172 HydrophobicContact CD1-CD2 4.18Å; L136-T175 HydrophobicContact CD2-CG2 4.46Å
137	F	91.7	Very high	91.8	Very high	25 Å²	25	13 Å²	13	11%	0.11	8%	0.076	C	C	.	.	H	α-helix	trans	-63.5	-46.4	-178.4	-167.9	-97.1	0	0	0	112	H133 D134 A135 K140 T141 R410 C429 A430 D433	H133-F137 PolarHBondContact O-N 3.4Å; D134-F137 WeakPolarHBondContact O-CB 3.4Å; D134-F137 PolarHBondContact O-N 2.91Å; A135-F137 VanDerWaalsContact C-N 3.32Å; F137-K140 PolarHBondContact O-N 3.21Å; F137-T141 PolarHBondContact O-N 3.01Å; F137-T141 PolarHBondContact O-OG1 3.28Å; F137-R410 VanDerWaalsContact CD2-NH2 3.3Å; F137-R410 PolarHBondContact O-NH2 2.7Å; F137-C429 HydrophobicContact CZ-CB 4.14Å; F137-A430 HydrophobicContact CE2-CB 4.41Å; F137-A430 HydrophobicContact CZ-CB 3.79Å; F137-D433 HydrophobicContact CD1-CB 4.5Å; F137-D433 HydrophobicContact CE1-CB 3.82Å
138	H	93.3	Very high	92.4	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-71.2	-37.3	179.2	-65.8	-41.9	0	0	0	113.2	C103 S106 L107 D134 K140 T141 L142 D433	C103-H138 PolarHBondContact O-CE1 3.22Å; S106-H138 PolarHBondContact OG-NE2 2.97Å; L107-H138 HydrophobicContact CD1-CB 3.76Å; D134-H138 WeakPolarHBondContact O-CB 3.44Å; D134-H138 PolarHBondContact O-CD2 3.27Å; D134-H138 VanDerWaalsContact O-CG 3.24Å; D134-H138 PolarHBondContact O-N 2.94Å; H138-K140 PolarHBondContact O-N 3.4Å; H138-T141 WeakPolarHBondContact O-CB 3.49Å; H138-T141 PolarHBondContact O-N 2.76Å; H138-T141 VanDerWaalsContact O-N 3.1Å; H138-L142 PolarHBondContact O-N 3.43Å; H138-D433 IonicContact CE1-OD1 2.94Å; H138-D433 PolarHBondContact CE1-OD1 3.08Å; H138-D433 IonicContact CE1-OD2 3.11Å; H138-D433 IonicContact ND1-OD1 3.04Å; H138-D433 PolarHBondContact ND1-OD1 2.86Å; H138-D433 IonicContact ND1-OD2 3.03Å; H138-D433 PolarHBondContact ND1-OD2 3.25Å; H138-D433 VanDerWaalsContact ND1-OD2 3.11Å
139	A	94.8	Very high	93.1	Very high	0 Å²	0	9 Å²	9	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-56.3	-40.8	175.8	0	0	0	0	0	111	F114 V122 A135 L142 G143 L144 T146	F114-A139 HydrophobicContact CE2-CB 4.4Å; V122-A139 HydrophobicContact CB-CB 3.85Å; V122-A139 HydrophobicContact CG1-CB 4.24Å; V122-A139 HydrophobicContact CG2-CB 3.69Å; A135-A139 WeakPolarHBondContact O-CB 3.25Å; A135-A139 PolarHBondContact O-N 2.84Å; A139-L142 CarbonylContact O-C 3.51Å; A139-L142 PolarHBondContact O-N 3.37Å; A139-G143 PolarHBondContact O-N 3.06Å; A139-G143 VanDerWaalsContact O-N 3.11Å; A139-L144 HydrophobicContact CB-CB 4.12Å; A139-L144 HydrophobicContact CB-CD1 4.47Å; A139-L144 WeakPolarHBondContact O-CB 3.37Å; A139-L144 PolarHBondContact O-N 2.76Å; A139-T146 HydrophobicContact CB-CG2 3.5Å
140	K	92.5	Very high	93.3	Very high	13 Å²	13	9.1 Å²	9.1	6%	0.057	6%	0.058	C	C	.	.	H	α-helix	trans	-66.4	-39.6	175.6	-68.9	-71.7	167.3	159.5	0	113.1	L136 F137 H138 L142 G143 T146 D174 N176 V404	L136-K140 WeakPolarHBondContact O-CG 3.5Å; L136-K140 PolarHBondContact O-N 3.34Å; F137-K140 PolarHBondContact O-N 3.21Å; H138-K140 PolarHBondContact O-N 3.4Å; K140-L142 PolarHBondContact O-N 3.39Å; K140-G143 PolarHBondContact O-N 3.12Å; K140-G143 VanDerWaalsContact O-N 3.1Å; K140-T146 HydrophobicContact CD-CG2 4.4Å; K140-T146 WeakPolarHBondContact CE-OG1 3.23Å; K140-T146 HydrophobicContact CG-CG2 4.22Å; K140-D174 WeakPolarHBondContact CE-O 3.4Å; K140-D174 PolarHBondContact NZ-O 2.91Å; K140-N176 PolarHBondContact NZ-OD1 3.19Å; K140-V404 HydrophobicContact CD-CG1 3.99Å
141	T	92.6	Very high	93.2	Very high	13 Å²	13	10 Å²	10	8%	0.08	6%	0.061	C	C	.	.	H	α-helix	trans	-62.4	-33	174.1	-51.7	0	0	0	0	111.7	F137 H138 G143 R410 D433 F434 L437	F137-T141 PolarHBondContact O-N 3.01Å; F137-T141 PolarHBondContact O-OG1 3.28Å; H138-T141 WeakPolarHBondContact O-CB 3.49Å; H138-T141 PolarHBondContact O-N 2.76Å; H138-T141 VanDerWaalsContact O-N 3.1Å; T141-G143 VanDerWaalsContact C-N 3.33Å; T141-R410 PolarHBondContact OG1-NH1 2.98Å; T141-D433 WeakPolarHBondContact CB-OD2 3.21Å; T141-D433 HydrophobicContact CG2-CB 4.47Å; T141-D433 WeakPolarHBondContact CG2-OD2 3.39Å; T141-D433 PolarHBondContact OG1-OD2 3.47Å; T141-F434 HydrophobicContact CG2-CB 4.06Å; T141-F434 HydrophobicContact CG2-CD2 4.15Å; T141-L437 HydrophobicContact CG2-CB 4.2Å; T141-L437 HydrophobicContact CG2-CD2 3.86Å; T141-L437 WeakPolarHBondContact O-CD2 3.24Å
142	L	93.6	Very high	92.4	Very high	24 Å²	24	10.5 Å²	10.5	13%	0.126	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-3.4	176.3	-74.4	159.8	0	0	0	114.1	L107 R111 F114 H138 A139 K140 L144 L437	L107-L142 HydrophobicContact CD1-CD1 4.39Å; R111-L142 HydrophobicContact CB-CD1 4.29Å; R111-L142 HydrophobicContact CG-CD2 4.2Å; F114-L142 HydrophobicContact CD2-CD1 3.65Å; F114-L142 HydrophobicContact CE2-CD1 4.32Å; H138-L142 PolarHBondContact O-N 3.43Å; A139-L142 CarbonylContact O-C 3.51Å; A139-L142 PolarHBondContact O-N 3.37Å; K140-L142 PolarHBondContact O-N 3.39Å; L142-L144 HydrophobicContact CB-CD1 4.28Å; L142-L144 HydrophobicContact CB-CG 4.12Å; L142-L437 HydrophobicContact CD2-CD1 3.53Å; L142-L437 HydrophobicContact CD2-CD2 3.87Å; L142-L437 HydrophobicContact CD2-CG 4.38Å; L142-L437 HydrophobicContact CG-CD1 4.37Å; L142-L437 HydrophobicContact CG-CD2 4.23Å
143	G	93.8	Very high	91.1	Very high	44 Å²	44	11.7 Å²	11.7	45%	0.454	7%	0.071	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	28	-179.6	0	0	0	0	0	114.3	A139 K140 T141	A139-G143 PolarHBondContact O-N 3.06Å; A139-G143 VanDerWaalsContact O-N 3.11Å; K140-G143 PolarHBondContact O-N 3.12Å; K140-G143 VanDerWaalsContact O-N 3.1Å; T141-G143 VanDerWaalsContact C-N 3.33Å
144	L	95.9	Very high	89.6	Confident	27 Å²	27	12.9 Å²	12.9	14%	0.141	8%	0.076	C	C	.	.			trans	-97.8	149.8	-179	-56.7	178.6	0	0	0	112.1	F114 I119 V122 A139 L142	F114-L144 HydrophobicContact CB-CD1 4.01Å; F114-L144 HydrophobicContact CD2-CD1 3.71Å; F114-L144 HydrophobicContact CE2-CD1 4.44Å; F114-L144 HydrophobicContact CG-CD1 4Å; I119-L144 HydrophobicContact CG2-CD1 4.49Å; I119-L144 WeakPolarHBondContact O-CD2 3.49Å; V122-L144 HydrophobicContact CG2-CD1 3.97Å; A139-L144 HydrophobicContact CB-CB 4.12Å; A139-L144 HydrophobicContact CB-CD1 4.47Å; A139-L144 WeakPolarHBondContact O-CB 3.37Å; A139-L144 PolarHBondContact O-N 2.76Å; L142-L144 HydrophobicContact CB-CD1 4.28Å; L142-L144 HydrophobicContact CB-CG 4.12Å
145	N	96.4	Very high	87.7	Confident	19 Å²	19	15.1 Å²	15.1	10%	0.102	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	141.8	172.4	-61.8	106.4	0	0	0	110.2	T120 V121 V122 N176 V399 E402	T120-N145 PolarHBondContact O-N 2.93Å; V121-N145 WeakPolarHBondContact CA-O 3.32Å; V121-N145 HydrophobicContact CG2-CB 4.42Å; V122-N145 PolarHBondContact N-O 3.39Å; N145-N176 WeakPolarHBondContact CA-OD1 3.45Å; N145-V399 HydrophobicContact CB-CB 4.39Å; N145-V399 HydrophobicContact CB-CG2 4.11Å; N145-V399 PolarHBondContact ND2-O 3.15Å; N145-E402 PolarHBondContact ND2-O 2.9Å
146	T	97.1	Very high	85.6	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	135.6	-176.2	60.9	0	0	0	0	112.9	V122 L136 A139 K140 T175 N176 H177	V122-T146 HydrophobicContact CB-CG2 4.5Å; V122-T146 WeakPolarHBondContact O-CA 3.02Å; L136-T146 HydrophobicContact CD2-CG2 4Å; A139-T146 HydrophobicContact CB-CG2 3.5Å; K140-T146 HydrophobicContact CD-CG2 4.4Å; K140-T146 WeakPolarHBondContact CE-OG1 3.23Å; K140-T146 HydrophobicContact CG-CG2 4.22Å; T146-T175 WeakPolarHBondContact OG1-CA 3.35Å; T146-N176 PolarHBondContact N-OD1 3.22Å; T146-N176 VanDerWaalsContact O-CB 3.28Å; T146-N176 WeakPolarHBondContact O-CB 3.31Å; T146-N176 PolarHBondContact O-N 3.41Å; T146-N176 VanDerWaalsContact O-N 3.17Å; T146-N176 PolarHBondContact OG1-N 3.06Å; T146-H177 PolarHBondContact O-N 3.39Å
147	V	97.6	Very high	83.2	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	144.8	171.6	-177.8	0	0	0	0	108.2	V121 V122 H123 A124 H177 V179 V395 Y396 V399	V121-V147 HydrophobicContact CG1-CG2 3.99Å; V122-V147 PolarHBondContact O-N 3.37Å; H123-V147 CarbonylContact C-O 3.6Å; H123-V147 WeakPolarHBondContact CA-O 3.45Å; H123-V147 HydrophobicContact CB-CB 4.45Å; H123-V147 PolarHBondContact CD2-O 2.93Å; A124-V147 PolarHBondContact N-O 3.38Å; V147-H177 VanDerWaalsContact CA-O 3.29Å; V147-H177 WeakPolarHBondContact CA-O 3.38Å; V147-V179 HydrophobicContact CG1-CG2 4.18Å; V147-V395 HydrophobicContact CG1-CG1 4.06Å; V147-V395 HydrophobicContact CG2-CG1 4.02Å; V147-Y396 HydrophobicContact CB-CE1 4.33Å; V147-Y396 HydrophobicContact CG2-CD1 3.99Å; V147-Y396 HydrophobicContact CG2-CE1 4.02Å; V147-V399 HydrophobicContact CG2-CG1 4.23Å; V147-V399 HydrophobicContact CG2-CG2 4.02Å
148	F	96.7	Very high	81.1	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	129.2	174.5	179.2	-103.4	0	0	0	111.1	A124 L136 D150 L172 T175 H177 I178 V179	A124-F148 HydrophobicContact CB-CD2 3.95Å; A124-F148 CarbonylContact O-C 3.53Å; A124-F148 VanDerWaalsContact O-CA 3.31Å; A124-F148 WeakPolarHBondContact O-CA 3.28Å; A124-F148 WeakPolarHBondContact O-CD2 3.39Å; L136-F148 HydrophobicContact CD1-CB 4.18Å; L136-F148 HydrophobicContact CD1-CD2 3.76Å; L136-F148 HydrophobicContact CD1-CG 4.24Å; F148-D150 HydrophobicContact CD1-CB 4.35Å; F148-D150 HydrophobicContact CE1-CB 3.74Å; F148-L172 HydrophobicContact CB-CD2 3.89Å; F148-L172 HydrophobicContact CD1-CD1 4.2Å; F148-L172 HydrophobicContact CD1-CD2 3.41Å; F148-L172 VanDerWaalsContact CD1-CD2 3.41Å; F148-L172 HydrophobicContact CD1-CG 4.46Å; F148-L172 HydrophobicContact CD2-CD2 4.12Å; F148-L172 HydrophobicContact CE1-CD1 4.13Å; F148-L172 HydrophobicContact CE1-CD2 3.85Å; F148-L172 HydrophobicContact CE2-CD2 4.5Å; F148-L172 HydrophobicContact CG-CD2 3.53Å; F148-L172 HydrophobicContact CZ-CD2 4.36Å; F148-T175 HydrophobicContact CB-CG2 4.06Å; F148-H177 PolarHBondContact N-O 3.02Å; F148-I178 HydrophobicContact CB-CG1 4.35Å; F148-I178 HydrophobicContact CD1-CG2 4.24Å; F148-I178 CarbonylContact O-C 3.56Å; F148-I178 VanDerWaalsContact O-CA 3.32Å; F148-I178 WeakPolarHBondContact O-CA 3.49Å; F148-V179 PolarHBondContact O-N 3.08Å
149	T	95.4	Very high	78.6	Confident	3 Å²	3	36 Å²	36	2%	0.018	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	118.7	170	-63.8	0	0	0	0	110.8	H123 A124 S126 H151 V179 V181	H123-T149 PolarHBondContact CE1-OG1 2.85Å; H123-T149 PolarHBondContact NE2-OG1 2.87Å; A124-T149 PolarHBondContact O-N 2.94Å; S126-T149 PolarHBondContact N-O 3.37Å; T149-H151 WeakPolarHBondContact CG2-CE1 3.42Å; T149-V179 CarbonylContact C-O 3.59Å; T149-V179 VanDerWaalsContact CA-O 3.31Å; T149-V179 WeakPolarHBondContact CA-O 3.22Å; T149-V179 HydrophobicContact CG2-CB 4.37Å; T149-V179 HydrophobicContact CG2-CG1 4.25Å; T149-V181 HydrophobicContact CG2-CG1 4.47Å
150	D	90.6	Very high	76.6	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	114.7	174.6	-160.8	4.2	0	0	0	110.9	S127 F148 S152 V179 T189	S127-D150 PolarHBondContact OG-OD1 3.38Å; S127-D150 PolarHBondContact OG-OD2 3.24Å; F148-D150 HydrophobicContact CD1-CB 4.35Å; F148-D150 HydrophobicContact CE1-CB 3.74Å; D150-S152 WeakPolarHBondContact OD1-CB 3.32Å; D150-S152 PolarHBondContact OD1-N 2.84Å; D150-V179 PolarHBondContact N-O 3.23Å; D150-T189 PolarHBondContact OD2-OG1 3Å
151	H	85.6	Confident	74.9	Confident	26 Å²	26	39.5 Å²	39.5	12%	0.12	25%	0.25	C	S	.	.			trans	-97.8	1.9	174.4	-60.9	-66.5	0	0	0	112.9	V46 H49 H125 T149	V46-H151 HydrophobicContact CG2-CB 3.81Å; H49-H151 AromaticContact CD2-CE1 3.53Å; H49-H151 AromaticContact CD2-NE2 3.8Å; H49-H151 AromaticContact CE1-CE1 3.84Å; H49-H151 AromaticContact CG-CE1 3.59Å; H49-H151 AromaticContact ND1-CE1 3.76Å; H49-H151 AromaticContact NE2-CE1 3.71Å; H125-H151 AromaticContact CD2-NE2 3.46Å; H125-H151 PolarHBondContact CD2-NE2 3.07Å; T149-H151 WeakPolarHBondContact CG2-CE1 3.42Å
152	S	72.1	Confident	73.4	Confident	12 Å²	12	42.7 Å²	42.7	8%	0.084	27%	0.27	C	S	.	.			trans	-108.7	143.7	-171.5	-58	0	0	0	0	111.5	F128 D150	F128-S152 WeakPolarHBondContact CD2-OG 3.47Å; F128-S152 WeakPolarHBondContact CE2-OG 3.47Å; D150-S152 WeakPolarHBondContact OD1-CB 3.32Å; D150-S152 PolarHBondContact OD1-N 2.84Å
153	L	63.9	Low	72	Confident	24 Å²	24	47.9 Å²	47.9	13%	0.126	30%	0.297	C	S	.	.			trans	-120.8	123.9	166.2	-164.3	76.8	0	0	0	108.1	T184 N188 T309 E310 A311	L153-T184 HydrophobicContact CD1-CG2 4.43Å; L153-T184 HydrophobicContact CD2-CG2 4.47Å; L153-N188 HydrophobicContact CD1-CB 3.75Å; L153-T309 PolarHBondContact O-OG1 2.93Å; L153-E310 WeakPolarHBondContact CD2-O 3.46Å; L153-A311 HydrophobicContact CB-CB 4.14Å
154	F	60.3	Low	70.7	Confident	32 Å²	32	47.8 Å²	47.8	14%	0.14	29%	0.288	C	S	.	.			trans	-111.7	146.1	177.5	-61.5	-116.6	0	0	0	110.8	F128 T164 N188 R192	F128-F154 HydrophobicContact CD1-CZ 4.11Å; F128-F154 HydrophobicContact CD2-CZ 4.31Å; F128-F154 AromaticContact CE1-CE1 3.5Å; F128-F154 HydrophobicContact CE1-CE1 3.5Å; F128-F154 HydrophobicContact CE1-CE2 4.48Å; F128-F154 AromaticContact CE1-CZ 3.39Å; F128-F154 HydrophobicContact CE1-CZ 3.39Å; F128-F154 HydrophobicContact CE2-CE1 4.26Å; F128-F154 AromaticContact CE2-CE2 3.97Å; F128-F154 HydrophobicContact CE2-CE2 3.97Å; F128-F154 AromaticContact CE2-CZ 3.62Å; F128-F154 HydrophobicContact CE2-CZ 3.62Å; F128-F154 HydrophobicContact CZ-CD1 4.24Å; F128-F154 AromaticContact CZ-CE1 3.33Å; F128-F154 HydrophobicContact CZ-CE1 3.33Å; F128-F154 AromaticContact CZ-CE2 3.85Å; F128-F154 HydrophobicContact CZ-CE2 3.85Å; F128-F154 AromaticContact CZ-CZ 3.11Å; F128-F154 HydrophobicContact CZ-CZ 3.11Å; F154-T164 HydrophobicContact CE1-CG2 4.07Å; F154-T164 HydrophobicContact CZ-CG2 4.08Å; F154-N188 PolarHBondContact O-ND2 2.86Å; F154-N188 VanDerWaalsContact O-ND2 3.1Å; F154-R192 VanDerWaalsContact CB-CZ 3.44Å; F154-R192 VanDerWaalsContact CD2-NH2 3.33Å; F154-R192 VanDerWaalsContact CG-NH1 3.31Å
155	G	50.3	Low	69.6	Low	51 Å²	51	47.7 Å²	47.7	53%	0.526	29%	0.287	S	S	.	.			trans	-74.6	154.1	162.7	0	0	0	0	0	111.2	A157	G155-A157 VanDerWaalsContact C-N 3.25Å; G155-A157 PolarHBondContact O-N 3.4Å
156	F	49.2	Very low	68.5	Low	133 Å²	133	52.8 Å²	52.8	58%	0.583	31%	0.309	S	S	*	.	S	Bend	trans	-81	3	179.8	-67.4	-86.6	0	0	0	114	R192	F156-R192 HydrophobicContact CD1-CG 4.34Å; F156-R192 HydrophobicContact CE1-CG 3.63Å; F156-R192 HydrophobicContact CZ-CG 4.22Å
157	A	44.4	Very low	67.4	Low	93 Å²	93	55.4 Å²	55.4	77%	0.769	32%	0.322	S	S	*	.			trans	-97.3	-8.9	-155.7	0	0	0	0	0	116.9	G155	G155-A157 VanDerWaalsContact C-N 3.25Å; G155-A157 PolarHBondContact O-N 3.4Å
158	D	46.2	Very low	66.5	Low	110 Å²	110	55.7 Å²	55.7	59%	0.588	32%	0.324	S	S	*	.			trans	-111.8	145.5	-173.6	-69.2	-29.1	0	0	0	113.5	S160 S161 V162	D158-S160 PolarHBondContact O-N 2.76Å; D158-S161 WeakPolarHBondContact O-CA 3.31Å; D158-S161 WeakPolarHBondContact O-CB 3.33Å; D158-S161 PolarHBondContact O-N 2.86Å; D158-S161 PolarHBondContact O-OG 3.02Å; D158-V162 PolarHBondContact O-N 3.38Å
159	V	42.5	Very low	65.9	Low	131 Å²	131	56.7 Å²	56.7	79%	0.794	33%	0.33	S	S	*	.	H	α-helix	trans	-59.8	-32.6	176.6	177.1	0	0	0	0	112.1	S161 V162	V159-S161 PolarHBondContact O-N 2.96Å; V159-V162 PolarHBondContact O-N 2.93Å
160	S	51.2	Low	65.2	Low	80 Å²	80	56.9 Å²	56.9	56%	0.559	33%	0.331	S	S	*	.	H	α-helix	trans	-63.4	-28.2	170.6	58.3	0	0	0	0	112.6	D158 T164	D158-S160 PolarHBondContact O-N 2.76Å; S160-T164 WeakPolarHBondContact O-CB 3.47Å; S160-T164 PolarHBondContact O-N 3.39Å; S160-T164 PolarHBondContact O-OG1 3.12Å
161	S	58.5	Low	64.8	Low	6 Å²	6	57.7 Å²	57.7	4%	0.042	34%	0.337	C	S	.	.	H	α-helix	trans	-68.9	-33.9	174.6	83.2	0	0	0	0	111.6	D158 V159 T164 N165	D158-S161 WeakPolarHBondContact O-CA 3.31Å; D158-S161 WeakPolarHBondContact O-CB 3.33Å; D158-S161 PolarHBondContact O-N 2.86Å; D158-S161 PolarHBondContact O-OG 3.02Å; V159-S161 PolarHBondContact O-N 2.96Å; S161-T164 PolarHBondContact O-N 3.07Å; S161-N165 VanDerWaalsContact O-CB 3.24Å; S161-N165 WeakPolarHBondContact O-CB 3.47Å; S161-N165 PolarHBondContact O-N 2.99Å; S161-N165 PolarHBondContact O-ND2 3.47Å; S161-N165 PolarHBondContact O-OD1 3.02Å
162	V	61.1	Low	64.9	Low	80 Å²	80	56.5 Å²	56.5	49%	0.485	33%	0.331	S	S	.	.	H	α-helix	trans	-66.1	-45.8	179.4	-179.1	0	0	0	0	111.7	D158 V159 N165 K166	D158-V162 PolarHBondContact O-N 3.38Å; V159-V162 PolarHBondContact O-N 2.93Å; V162-N165 PolarHBondContact O-N 3Å; V162-K166 PolarHBondContact O-N 3.43Å; V162-K166 VanDerWaalsContact O-N 3.09Å
163	L	63.3	Low	65.6	Low	134 Å²	134	56.3 Å²	56.3	70%	0.702	33%	0.33	S	S	*	.	H	α-helix	trans	-65.9	-42.8	177.3	-176.5	62.9	0	0	0	111.2	N165 K166 L167	L163-N165 VanDerWaalsContact C-N 3.32Å; L163-N165 PolarHBondContact O-N 3.46Å; L163-K166 PolarHBondContact O-N 2.77Å; L163-L167 PolarHBondContact O-N 2.84Å
164	T	66.8	Low	66.7	Low	42 Å²	42	55.6 Å²	55.6	26%	0.258	33%	0.326	S	S	.	.	H	α-helix	trans	-63.5	-38.6	176.4	-52.4	0	0	0	0	111.5	F154 S160 S161 L167 L168	F154-T164 HydrophobicContact CE1-CG2 4.07Å; F154-T164 HydrophobicContact CZ-CG2 4.08Å; S160-T164 WeakPolarHBondContact O-CB 3.47Å; S160-T164 PolarHBondContact O-N 3.39Å; S160-T164 PolarHBondContact O-OG1 3.12Å; S161-T164 PolarHBondContact O-N 3.07Å; T164-L167 PolarHBondContact O-N 2.69Å; T164-L168 HydrophobicContact CG2-CD1 4.22Å; T164-L168 WeakPolarHBondContact O-CB 3.48Å; T164-L168 WeakPolarHBondContact O-CG 3.47Å; T164-L168 PolarHBondContact O-N 3.44Å
165	N	72.6	Confident	68.2	Low	25 Å²	25	54.3 Å²	54.3	13%	0.134	32%	0.321	C	S	.	.	H	α-helix	trans	-62.3	-45.5	176.2	-68	-10.7	0	0	0	110.8	S161 V162 L163 L167 L168 T169 R192	S161-N165 VanDerWaalsContact O-CB 3.24Å; S161-N165 WeakPolarHBondContact O-CB 3.47Å; S161-N165 PolarHBondContact O-N 2.99Å; S161-N165 PolarHBondContact O-ND2 3.47Å; S161-N165 PolarHBondContact O-OD1 3.02Å; V162-N165 PolarHBondContact O-N 3Å; L163-N165 VanDerWaalsContact C-N 3.32Å; L163-N165 PolarHBondContact O-N 3.46Å; N165-L167 PolarHBondContact O-N 3.43Å; N165-L168 WeakPolarHBondContact O-CB 2.96Å; N165-L168 PolarHBondContact O-N 3.03Å; N165-T169 PolarHBondContact O-N 3.3Å; N165-T169 PolarHBondContact O-OG1 3.36Å; N165-R192 PolarHBondContact OD1-NE 2.89Å; N165-R192 PolarHBondContact OD1-NH2 2.71Å
166	K	73.6	Confident	70.3	Confident	126 Å²	126	52.5 Å²	52.5	55%	0.548	30%	0.299	S	S	.	.	H	α-helix	trans	-62.5	-41.6	177	-72.9	-173.8	179.3	-169.2	0	112.3	V162 L163 L168 T169 V170	V162-K166 PolarHBondContact O-N 3.43Å; V162-K166 VanDerWaalsContact O-N 3.09Å; L163-K166 PolarHBondContact O-N 2.77Å; K166-L168 VanDerWaalsContact C-N 3.32Å; K166-T169 WeakPolarHBondContact O-CB 3.46Å; K166-T169 PolarHBondContact O-N 2.95Å; K166-V170 WeakPolarHBondContact O-CG2 3.29Å; K166-V170 PolarHBondContact O-N 3.39Å
167	L	74.2	Confident	72.5	Confident	55 Å²	55	46.3 Å²	46.3	29%	0.288	27%	0.272	S	S	.	.	H	α-helix	trans	-62.3	-41.7	175.3	-176.5	65	0	0	0	111.3	L163 T164 N165 V170 S171	L163-L167 PolarHBondContact O-N 2.84Å; T164-L167 PolarHBondContact O-N 2.69Å; N165-L167 PolarHBondContact O-N 3.43Å; L167-V170 PolarHBondContact O-N 3.04Å; L167-S171 WeakPolarHBondContact O-CB 3.24Å; L167-S171 PolarHBondContact O-N 3.01Å; L167-S171 PolarHBondContact O-OG 2.98Å
168	L	78.3	Confident	75	Confident	6 Å²	6	41.9 Å²	41.9	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-63.9	-45.7	174.3	-75.5	167.8	0	0	0	112	S127 T164 N165 K166 V170 S171 L172	S127-L168 WeakPolarHBondContact OG-CD2 3.32Å; T164-L168 HydrophobicContact CG2-CD1 4.22Å; T164-L168 WeakPolarHBondContact O-CB 3.48Å; T164-L168 WeakPolarHBondContact O-CG 3.47Å; T164-L168 PolarHBondContact O-N 3.44Å; N165-L168 WeakPolarHBondContact O-CB 2.96Å; N165-L168 PolarHBondContact O-N 3.03Å; K166-L168 VanDerWaalsContact C-N 3.32Å; L168-V170 VanDerWaalsContact C-N 3.25Å; L168-V170 PolarHBondContact O-N 3.04Å; L168-S171 PolarHBondContact O-N 3.23Å; L168-L172 HydrophobicContact CD2-CD1 4.24Å; L168-L172 WeakPolarHBondContact O-CB 3.39Å; L168-L172 VanDerWaalsContact O-CG 3.24Å; L168-L172 WeakPolarHBondContact O-CG 3.44Å; L168-L172 PolarHBondContact O-N 3.44Å
169	T	83.3	Confident	77.4	Confident	20 Å²	20	36.8 Å²	36.8	12%	0.123	21%	0.208	C	C	.	.	H	α-helix	trans	-52.5	-47.9	175.4	-52.5	0	0	0	0	110.5	N165 K166 C173 R192	N165-T169 PolarHBondContact O-N 3.3Å; N165-T169 PolarHBondContact O-OG1 3.36Å; K166-T169 WeakPolarHBondContact O-CB 3.46Å; K166-T169 PolarHBondContact O-N 2.95Å; T169-C173 WeakPolarHBondContact O-CB 3.36Å; T169-C173 PolarHBondContact O-N 3.05Å; T169-R192 PolarHBondContact OG1-O 3.42Å
170	V	81.6	Confident	79.9	Confident	8 Å²	8	30.6 Å²	30.6	5%	0.048	17%	0.171	C	C	.	.	H	α-helix	trans	-70.7	-45	-177.2	176.7	0	0	0	0	111.6	K166 L167 L168 L172 C173 L414 C418 F426	K166-V170 WeakPolarHBondContact O-CG2 3.29Å; K166-V170 PolarHBondContact O-N 3.39Å; L167-V170 PolarHBondContact O-N 3.04Å; L168-V170 VanDerWaalsContact C-N 3.25Å; L168-V170 PolarHBondContact O-N 3.04Å; V170-L172 VanDerWaalsContact C-N 3.27Å; V170-L172 PolarHBondContact O-N 3.43Å; V170-C173 PolarHBondContact O-SG 3.39Å; V170-L414 HydrophobicContact CG1-CD2 4.2Å; V170-C418 HydrophobicContact CG2-CB 4.1Å; V170-F426 HydrophobicContact CB-CD2 4.06Å; V170-F426 HydrophobicContact CB-CE2 4.03Å; V170-F426 HydrophobicContact CB-CG 4.36Å; V170-F426 HydrophobicContact CB-CZ 4.27Å; V170-F426 HydrophobicContact CG1-CB 3.81Å; V170-F426 HydrophobicContact CG1-CD1 3.5Å; V170-F426 VanDerWaalsContact CG1-CD1 3.5Å; V170-F426 HydrophobicContact CG1-CD2 3.49Å; V170-F426 VanDerWaalsContact CG1-CD2 3.49Å; V170-F426 HydrophobicContact CG1-CE1 3.79Å; V170-F426 HydrophobicContact CG1-CE2 3.82Å; V170-F426 HydrophobicContact CG1-CG 3.32Å; V170-F426 HydrophobicContact CG1-CZ 3.94Å; V170-F426 HydrophobicContact CG2-CD2 3.47Å; V170-F426 VanDerWaalsContact CG2-CD2 3.47Å; V170-F426 HydrophobicContact CG2-CE2 3.43Å; V170-F426 VanDerWaalsContact CG2-CE2 3.43Å; V170-F426 HydrophobicContact CG2-CG 4.22Å; V170-F426 HydrophobicContact CG2-CZ 4.13Å
171	S	81.7	Confident	81.9	Confident	18 Å²	18	26.8 Å²	26.8	13%	0.126	14%	0.144	C	C	.	.	H	α-helix	trans	-67.8	-33.5	-176.5	-53.8	0	0	0	0	111.3	H133 L167 L168 T175	H133-S171 VanDerWaalsContact ND1-CB 3.3Å; H133-S171 WeakPolarHBondContact ND1-CB 3.38Å; L167-S171 WeakPolarHBondContact O-CB 3.24Å; L167-S171 PolarHBondContact O-N 3.01Å; L167-S171 PolarHBondContact O-OG 2.98Å; L168-S171 PolarHBondContact O-N 3.23Å; S171-T175 PolarHBondContact O-OG1 3.46Å
172	L	88	Confident	83.6	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-92.7	-19.7	-176.7	-59	-177.9	0	0	0	113.9	L136 F148 L168 V170 D174 T175 I178 T189 A193 L195	L136-L172 HydrophobicContact CD1-CD2 4.18Å; F148-L172 HydrophobicContact CB-CD2 3.89Å; F148-L172 HydrophobicContact CD1-CD1 4.2Å; F148-L172 HydrophobicContact CD1-CD2 3.41Å; F148-L172 VanDerWaalsContact CD1-CD2 3.41Å; F148-L172 HydrophobicContact CD1-CG 4.46Å; F148-L172 HydrophobicContact CD2-CD2 4.12Å; F148-L172 HydrophobicContact CE1-CD1 4.13Å; F148-L172 HydrophobicContact CE1-CD2 3.85Å; F148-L172 HydrophobicContact CE2-CD2 4.5Å; F148-L172 HydrophobicContact CG-CD2 3.53Å; F148-L172 HydrophobicContact CZ-CD2 4.36Å; L168-L172 HydrophobicContact CD2-CD1 4.24Å; L168-L172 WeakPolarHBondContact O-CB 3.39Å; L168-L172 VanDerWaalsContact O-CG 3.24Å; L168-L172 WeakPolarHBondContact O-CG 3.44Å; L168-L172 PolarHBondContact O-N 3.44Å; V170-L172 VanDerWaalsContact C-N 3.27Å; V170-L172 PolarHBondContact O-N 3.43Å; L172-D174 PolarHBondContact O-N 3.13Å; L172-D174 VanDerWaalsContact O-N 3.09Å; L172-T175 WeakPolarHBondContact O-CB 3.46Å; L172-T175 PolarHBondContact O-N 3.44Å; L172-I178 HydrophobicContact CB-CD1 4Å; L172-I178 HydrophobicContact CD1-CD1 4.33Å; L172-I178 HydrophobicContact CD2-CD1 4.41Å; L172-I178 HydrophobicContact CG-CD1 4.47Å; L172-T189 HydrophobicContact CD1-CG2 4.2Å; L172-A193 HydrophobicContact CB-CB 4.46Å; L172-A193 HydrophobicContact CD1-CB 4.15Å; L172-L195 HydrophobicContact CB-CD1 4.36Å; L172-L195 HydrophobicContact CB-CD2 4.04Å; L172-L195 HydrophobicContact CD1-CD1 4.35Å
173	C	86.5	Confident	85.2	Confident	7 Å²	7	29.6 Å²	29.6	5%	0.047	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-28	-175.2	70	0	0	0	0	113.6	T169 V170 R413 H417	T169-C173 WeakPolarHBondContact O-CB 3.36Å; T169-C173 PolarHBondContact O-N 3.05Å; V170-C173 PolarHBondContact O-SG 3.39Å; C173-R413 WeakPolarHBondContact O-CD 3.36Å; C173-H417 HydrophobicContact CB-CB 4.31Å
174	D	86.8	Confident	86.6	Confident	10 Å²	10	25.4 Å²	25.4	5%	0.053	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	3.2	-179.9	-156.5	25.8	0	0	0	113	K140 L172 R410 R413	K140-D174 WeakPolarHBondContact CE-O 3.4Å; K140-D174 PolarHBondContact NZ-O 2.91Å; L172-D174 PolarHBondContact O-N 3.13Å; L172-D174 VanDerWaalsContact O-N 3.09Å; D174-R410 WeakPolarHBondContact OD2-CD 3.45Å; D174-R410 WeakPolarHBondContact OD2-CG 3.41Å; D174-R410 IonicContact OD2-NE 3.87Å; D174-R410 PolarHBondContact OD2-NE 2.97Å; D174-R413 IonicContact OD1-NH1 3.93Å
175	T	91.8	Very high	87.6	Confident	5 Å²	5	23.4 Å²	23.4	3%	0.031	11%	0.114	C	C	.	.			trans	-71	137.8	178.2	-66.5	0	0	0	0	110.7	L136 T146 F148 S171 L172 H177 I178	L136-T175 HydrophobicContact CD2-CG2 4.46Å; T146-T175 WeakPolarHBondContact OG1-CA 3.35Å; F148-T175 HydrophobicContact CB-CG2 4.06Å; S171-T175 PolarHBondContact O-OG1 3.46Å; L172-T175 WeakPolarHBondContact O-CB 3.46Å; L172-T175 PolarHBondContact O-N 3.44Å; T175-H177 WeakPolarHBondContact CG2-O 3.41Å; T175-I178 HydrophobicContact CG2-CG1 3.99Å
176	N	94.7	Very high	88.6	Confident	12 Å²	12	24.6 Å²	24.6	6%	0.064	12%	0.118	C	C	.	.	S	Bend	trans	-66.1	-47.2	-179.1	-72.9	94	0	0	0	111.3	K140 N145 T146 V399 E402	K140-N176 PolarHBondContact NZ-OD1 3.19Å; N145-N176 WeakPolarHBondContact CA-OD1 3.45Å; T146-N176 PolarHBondContact N-OD1 3.22Å; T146-N176 VanDerWaalsContact O-CB 3.28Å; T146-N176 WeakPolarHBondContact O-CB 3.31Å; T146-N176 PolarHBondContact O-N 3.41Å; T146-N176 VanDerWaalsContact O-N 3.17Å; T146-N176 PolarHBondContact OG1-N 3.06Å; N176-V399 HydrophobicContact CB-CB 3.91Å; N176-V399 HydrophobicContact CB-CG1 3.62Å; N176-E402 WeakPolarHBondContact CB-OE2 3.47Å; N176-E402 PolarHBondContact ND2-OE2 3.16Å
177	H	96.2	Very high	89.4	Confident	4 Å²	4	24.9 Å²	24.9	2%	0.019	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	145	-177.2	-162.3	89.7	0	0	0	112.3	T146 V147 F148 T175 I199 S201 V395 V399	T146-H177 PolarHBondContact O-N 3.39Å; V147-H177 VanDerWaalsContact CA-O 3.29Å; V147-H177 WeakPolarHBondContact CA-O 3.38Å; F148-H177 PolarHBondContact N-O 3.02Å; T175-H177 WeakPolarHBondContact CG2-O 3.41Å; H177-I199 CarbonylContact C-O 3.58Å; H177-I199 WeakPolarHBondContact CA-O 3.37Å; H177-I199 PolarHBondContact ND1-O 3.05Å; H177-S201 VanDerWaalsContact NE2-CB 3.35Å; H177-S201 WeakPolarHBondContact NE2-CB 3.4Å; H177-S201 PolarHBondContact NE2-OG 3.02Å; H177-V395 HydrophobicContact CB-CG1 3.89Å; H177-V395 WeakPolarHBondContact CD2-CG1 3.39Å; H177-V399 HydrophobicContact CB-CG1 3.47Å; H177-V399 VanDerWaalsContact CB-CG1 3.47Å
178	I	96.3	Very high	90	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136.7	-177.1	-63.3	158.4	0	0	0	109.2	F148 L172 T175 T189 L195 I199 V200 S201	F148-I178 HydrophobicContact CB-CG1 4.35Å; F148-I178 HydrophobicContact CD1-CG2 4.24Å; F148-I178 CarbonylContact O-C 3.56Å; F148-I178 VanDerWaalsContact O-CA 3.32Å; F148-I178 WeakPolarHBondContact O-CA 3.49Å; L172-I178 HydrophobicContact CB-CD1 4Å; L172-I178 HydrophobicContact CD1-CD1 4.33Å; L172-I178 HydrophobicContact CD2-CD1 4.41Å; L172-I178 HydrophobicContact CG-CD1 4.47Å; T175-I178 HydrophobicContact CG2-CG1 3.99Å; I178-T189 HydrophobicContact CG2-CG2 4.39Å; I178-L195 HydrophobicContact CD1-CD1 3.31Å; I178-L195 HydrophobicContact CD1-CD2 4.03Å; I178-L195 HydrophobicContact CD1-CG 4.24Å; I178-I199 PolarHBondContact N-O 2.82Å; I178-V200 HydrophobicContact CB-CG1 4.32Å; I178-V200 HydrophobicContact CB-CG2 4.21Å; I178-V200 HydrophobicContact CG2-CG1 4.16Å; I178-V200 CarbonylContact O-C 3.57Å; I178-V200 VanDerWaalsContact O-CA 3.3Å; I178-V200 WeakPolarHBondContact O-CA 3.36Å; I178-S201 PolarHBondContact O-N 2.88Å
179	V	96.8	Very high	90.5	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.018	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.4	177.5	178	0	0	0	0	108.6	V147 F148 T149 D150 S201 I203 V395	V147-V179 HydrophobicContact CG1-CG2 4.18Å; F148-V179 PolarHBondContact O-N 3.08Å; T149-V179 CarbonylContact C-O 3.59Å; T149-V179 VanDerWaalsContact CA-O 3.31Å; T149-V179 WeakPolarHBondContact CA-O 3.22Å; T149-V179 HydrophobicContact CG2-CB 4.37Å; T149-V179 HydrophobicContact CG2-CG1 4.25Å; D150-V179 PolarHBondContact N-O 3.23Å; V179-S201 CarbonylContact C-O 3.55Å; V179-S201 WeakPolarHBondContact CA-O 3.27Å; V179-I203 HydrophobicContact CG1-CB 3.6Å; V179-I203 HydrophobicContact CG1-CD1 3.94Å; V179-I203 HydrophobicContact CG1-CG1 3.81Å; V179-I203 HydrophobicContact CG2-CD1 4.11Å; V179-V395 HydrophobicContact CG2-CG2 4.48Å
180	C	95.3	Very high	90.8	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	145.4	173.7	-64.8	0	0	0	0	109.4	S182 K186 S201 V202 I203	C180-S182 VanDerWaalsContact C-N 3.3Å; C180-S182 PolarHBondContact O-N 2.9Å; C180-K186 HydrophobicContact CB-CB 3.93Å; C180-S201 PolarHBondContact N-O 2.67Å; C180-V202 CarbonylContact O-C 3.53Å; C180-V202 VanDerWaalsContact O-CA 3.24Å; C180-V202 WeakPolarHBondContact O-CA 3.42Å; C180-I203 PolarHBondContact O-N 3.39Å
181	V	93.7	Very high	91.1	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.006	14%	0.139	C	C	.	.	S	Bend	trans	-81.5	-7	-175.3	-61	0	0	0	0	114.4	T149 I203 P204 N205 A311 F312	T149-V181 HydrophobicContact CG2-CG1 4.47Å; V181-I203 WeakPolarHBondContact CA-O 3.45Å; V181-P204 WeakPolarHBondContact O-CA 3.39Å; V181-N205 WeakPolarHBondContact CG1-OD1 3.5Å; V181-A311 HydrophobicContact CG2-CB 3.5Å; V181-A311 VanDerWaalsContact CG2-CB 3.5Å; V181-F312 HydrophobicContact CB-CB 4.19Å; V181-F312 HydrophobicContact CG2-CB 3.92Å; V181-F312 WeakPolarHBondContact O-CD2 3.41Å
182	S	94.2	Very high	91.1	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.007	14%	0.136	C	C	.	.	S	Bend	trans	-154.1	162.8	175	54.2	0	0	0	0	110.8	C180 T184 S185 K186 A311 E336	C180-S182 VanDerWaalsContact C-N 3.3Å; C180-S182 PolarHBondContact O-N 2.9Å; S182-T184 VanDerWaalsContact C-N 3.33Å; S182-S185 WeakPolarHBondContact O-CB 3.4Å; S182-S185 PolarHBondContact O-N 3.34Å; S182-S185 VanDerWaalsContact OG-CB 3.22Å; S182-S185 WeakPolarHBondContact OG-CB 3.35Å; S182-S185 PolarHBondContact OG-N 3.07Å; S182-S185 VanDerWaalsContact OG-N 3.13Å; S182-K186 PolarHBondContact O-N 3.17Å; S182-A311 WeakPolarHBondContact CB-O 3.28Å; S182-A311 PolarHBondContact OG-O 2.88Å; S182-E336 WeakPolarHBondContact CB-OE2 3.33Å
183	Y	94.1	Very high	91	Very high	144 Å²	144	28.2 Å²	28.2	57%	0.565	14%	0.136	S	C	*	.	H	α-helix	trans	-63.3	-41.5	172.4	-72.6	-83.7	0	0	0	111.1	S185 K186 E187 V202 E336	Y183-S185 VanDerWaalsContact C-N 3.28Å; Y183-S185 PolarHBondContact O-N 3.17Å; Y183-K186 WeakPolarHBondContact O-CA 3.25Å; Y183-K186 WeakPolarHBondContact O-CB 3.32Å; Y183-K186 PolarHBondContact O-N 3.32Å; Y183-E187 PolarHBondContact O-N 3.41Å; Y183-V202 HydrophobicContact CD1-CG2 3.69Å; Y183-V202 HydrophobicContact CD2-CG1 4.24Å; Y183-V202 HydrophobicContact CD2-CG2 4.37Å; Y183-V202 HydrophobicContact CE1-CB 4.38Å; Y183-V202 HydrophobicContact CE1-CG2 3.92Å; Y183-V202 HydrophobicContact CE2-CB 4.47Å; Y183-V202 HydrophobicContact CE2-CG1 4.28Å; Y183-V202 HydrophobicContact CG-CG2 3.93Å; Y183-E336 WeakPolarHBondContact CB-OE2 3.36Å; Y183-E336 WeakPolarHBondContact CD2-OE2 3.34Å; Y183-E336 PolarHBondContact N-OE1 3Å; Y183-E336 PolarHBondContact N-OE2 3.31Å
184	T	91.4	Very high	91	Very high	46 Å²	46	30.9 Å²	30.9	28%	0.282	16%	0.159	S	C	.	.	H	α-helix	trans	-58.4	-41	173.3	-55.8	0	0	0	0	111.8	L153 S182 N188 G332 E336	L153-T184 HydrophobicContact CD1-CG2 4.43Å; L153-T184 HydrophobicContact CD2-CG2 4.47Å; S182-T184 VanDerWaalsContact C-N 3.33Å; T184-N188 WeakPolarHBondContact O-CB 3.23Å; T184-N188 PolarHBondContact O-N 2.75Å; T184-G332 PolarHBondContact OG1-O 3.36Å; T184-E336 WeakPolarHBondContact CB-OE1 3.38Å; T184-E336 PolarHBondContact N-OE1 3.43Å; T184-E336 PolarHBondContact OG1-OE1 3.16Å
185	S	88.9	Confident	91	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-65.8	-42	173.2	173	0	0	0	0	111.7	S182 Y183 E187 N188 T189	S182-S185 WeakPolarHBondContact O-CB 3.4Å; S182-S185 PolarHBondContact O-N 3.34Å; S182-S185 VanDerWaalsContact OG-CB 3.22Å; S182-S185 WeakPolarHBondContact OG-CB 3.35Å; S182-S185 PolarHBondContact OG-N 3.07Å; S182-S185 VanDerWaalsContact OG-N 3.13Å; Y183-S185 VanDerWaalsContact C-N 3.28Å; Y183-S185 PolarHBondContact O-N 3.17Å; S185-E187 PolarHBondContact O-N 3.44Å; S185-N188 PolarHBondContact O-N 3.42Å; S185-T189 WeakPolarHBondContact O-CB 3.35Å; S185-T189 PolarHBondContact O-N 2.94Å; S185-T189 PolarHBondContact O-OG1 2.98Å
186	K	93.3	Very high	91	Very high	50 Å²	50	34.2 Å²	34.2	22%	0.217	18%	0.176	C	C	.	.	H	α-helix	trans	-57.4	-48.8	175.2	169.6	169.7	176.2	168.5	0	111.6	C180 S182 Y183 T189 V190 P197 V200 V202	C180-K186 HydrophobicContact CB-CB 3.93Å; S182-K186 PolarHBondContact O-N 3.17Å; Y183-K186 WeakPolarHBondContact O-CA 3.25Å; Y183-K186 WeakPolarHBondContact O-CB 3.32Å; Y183-K186 PolarHBondContact O-N 3.32Å; K186-T189 PolarHBondContact O-N 2.93Å; K186-V190 HydrophobicContact CG-CG2 4.19Å; K186-V190 VanDerWaalsContact O-CB 3.24Å; K186-V190 WeakPolarHBondContact O-CB 3.41Å; K186-V190 WeakPolarHBondContact O-CG2 2.97Å; K186-V190 PolarHBondContact O-N 2.84Å; K186-P197 PolarHBondContact NZ-O 3.16Å; K186-V200 HydrophobicContact CB-CG1 4.32Å; K186-V200 HydrophobicContact CD-CB 4.35Å; K186-V200 HydrophobicContact CD-CG1 4.06Å; K186-V200 WeakPolarHBondContact CE-O 3.37Å; K186-V200 HydrophobicContact CG-CB 4.35Å; K186-V200 HydrophobicContact CG-CG1 3.76Å; K186-V200 PolarHBondContact NZ-O 2.87Å; K186-V202 HydrophobicContact CB-CG2 3.76Å; K186-V202 HydrophobicContact CD-CG2 3.79Å; K186-V202 HydrophobicContact CG-CG2 4.39Å
187	E	90.9	Very high	90.8	Very high	131 Å²	131	36.9 Å²	36.9	61%	0.612	19%	0.194	S	C	*	.	H	α-helix	trans	-60.3	-46.6	177.7	-70.2	178.8	-178	0	0	111.4	Y183 S185 T189 L191	Y183-E187 PolarHBondContact O-N 3.41Å; S185-E187 PolarHBondContact O-N 3.44Å; E187-T189 PolarHBondContact O-N 3.04Å; E187-L191 WeakPolarHBondContact O-CB 3.3Å; E187-L191 VanDerWaalsContact O-CG 3.24Å; E187-L191 WeakPolarHBondContact O-CG 3.5Å; E187-L191 PolarHBondContact O-N 2.96Å
188	N	86.9	Confident	90.6	Very high	13 Å²	13	43.2 Å²	43.2	7%	0.07	22%	0.224	C	C	.	.	H	α-helix	trans	-59.8	-48.2	177.7	-172.1	-101.3	0	0	0	112.2	L153 F154 T184 S185 R192	L153-N188 HydrophobicContact CD1-CB 3.75Å; F154-N188 PolarHBondContact O-ND2 2.86Å; F154-N188 VanDerWaalsContact O-ND2 3.1Å; T184-N188 WeakPolarHBondContact O-CB 3.23Å; T184-N188 PolarHBondContact O-N 2.75Å; S185-N188 PolarHBondContact O-N 3.42Å; N188-R192 WeakPolarHBondContact O-CB 3.22Å; N188-R192 WeakPolarHBondContact O-CD 3.39Å; N188-R192 WeakPolarHBondContact O-CG 2.86Å; N188-R192 PolarHBondContact O-N 3.04Å; N188-R192 WeakPolarHBondContact OD1-CD 3.39Å; N188-R192 PolarHBondContact OD1-NH1 3.18Å
189	T	87.6	Confident	90.4	Very high	4 Å²	4	45 Å²	45	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-68.6	-43.7	-177.6	-56.7	0	0	0	0	111.2	D150 L172 I178 S185 K186 E187 L191 R192 A193 L195	D150-T189 PolarHBondContact OD2-OG1 3Å; L172-T189 HydrophobicContact CD1-CG2 4.2Å; I178-T189 HydrophobicContact CG2-CG2 4.39Å; S185-T189 WeakPolarHBondContact O-CB 3.35Å; S185-T189 PolarHBondContact O-N 2.94Å; S185-T189 PolarHBondContact O-OG1 2.98Å; K186-T189 PolarHBondContact O-N 2.93Å; E187-T189 PolarHBondContact O-N 3.04Å; T189-L191 PolarHBondContact O-N 3.32Å; T189-R192 PolarHBondContact O-N 3.4Å; T189-A193 WeakPolarHBondContact O-CB 3.37Å; T189-A193 PolarHBondContact O-N 2.84Å; T189-L195 HydrophobicContact CG2-CD1 4.2Å
190	V	90.4	Very high	90.4	Very high	21 Å²	21	45.1 Å²	45.1	13%	0.127	23%	0.234	C	C	.	.	H	α-helix	trans	-57.6	-47.6	175.8	164	0	0	0	0	111	K186 A194 L195 P197 V200	K186-V190 HydrophobicContact CG-CG2 4.19Å; K186-V190 VanDerWaalsContact O-CB 3.24Å; K186-V190 WeakPolarHBondContact O-CB 3.41Å; K186-V190 WeakPolarHBondContact O-CG2 2.97Å; K186-V190 PolarHBondContact O-N 2.84Å; V190-A194 CarbonylContact O-C 3.51Å; V190-A194 VanDerWaalsContact O-CA 3.24Å; V190-A194 WeakPolarHBondContact O-CA 3.46Å; V190-A194 PolarHBondContact O-N 2.87Å; V190-L195 PolarHBondContact O-N 2.98Å; V190-P197 HydrophobicContact CG1-CG 4.03Å; V190-V200 HydrophobicContact CG2-CB 4.14Å; V190-V200 HydrophobicContact CG2-CG1 4.34Å; V190-V200 HydrophobicContact CG2-CG2 3.76Å
191	L	87.3	Confident	90.5	Very high	124 Å²	124	46.4 Å²	46.4	65%	0.649	24%	0.243	S	C	*	.	H	α-helix	trans	-66.7	-44.8	-179.8	-71.4	171.6	0	0	0	112.2	E187 T189 A194	E187-L191 WeakPolarHBondContact O-CB 3.3Å; E187-L191 VanDerWaalsContact O-CG 3.24Å; E187-L191 WeakPolarHBondContact O-CG 3.5Å; E187-L191 PolarHBondContact O-N 2.96Å; T189-L191 PolarHBondContact O-N 3.32Å; L191-A194 PolarHBondContact O-N 3.14Å
192	R	82.4	Confident	90.6	Very high	15 Å²	15	47.1 Å²	47.1	6%	0.057	25%	0.247	C	C	.	.	H	α-helix	trans	-72.7	-35.8	-174.9	-71.8	169.8	65	-152	-1.9	113.4	F154 F156 N165 T169 N188 T189	F154-R192 VanDerWaalsContact CB-CZ 3.44Å; F154-R192 VanDerWaalsContact CD2-NH2 3.33Å; F154-R192 VanDerWaalsContact CG-NH1 3.31Å; F156-R192 HydrophobicContact CD1-CG 4.34Å; F156-R192 HydrophobicContact CE1-CG 3.63Å; F156-R192 HydrophobicContact CZ-CG 4.22Å; N165-R192 PolarHBondContact OD1-NE 2.89Å; N165-R192 PolarHBondContact OD1-NH2 2.71Å; T169-R192 PolarHBondContact OG1-O 3.42Å; N188-R192 WeakPolarHBondContact O-CB 3.22Å; N188-R192 WeakPolarHBondContact O-CD 3.39Å; N188-R192 WeakPolarHBondContact O-CG 2.86Å; N188-R192 PolarHBondContact O-N 3.04Å; N188-R192 WeakPolarHBondContact OD1-CD 3.39Å; N188-R192 PolarHBondContact OD1-NH1 3.18Å; T189-R192 PolarHBondContact O-N 3.4Å
193	A	84.9	Confident	90.7	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.008	25%	0.248	C	C	.	.	H	α-helix	trans	-96.8	3	178.3	0	0	0	0	0	112.9	L172 T189 L195 H417	L172-A193 HydrophobicContact CB-CB 4.46Å; L172-A193 HydrophobicContact CD1-CB 4.15Å; T189-A193 WeakPolarHBondContact O-CB 3.37Å; T189-A193 PolarHBondContact O-N 2.84Å; A193-L195 VanDerWaalsContact C-N 3.26Å; A193-L195 HydrophobicContact CB-CD1 3.55Å; A193-L195 HydrophobicContact CB-CD2 4.16Å; A193-L195 HydrophobicContact CB-CG 3.57Å; A193-L195 PolarHBondContact O-N 3.48Å; A193-H417 PolarHBondContact O-CE1 2.93Å; A193-H417 VanDerWaalsContact O-CE1 3.31Å
194	A	86.6	Confident	90.6	Very high	63 Å²	63	41.4 Å²	41.4	52%	0.521	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	40	-179.6	0	0	0	0	0	113.7	V190 L191 H417	V190-A194 CarbonylContact O-C 3.51Å; V190-A194 VanDerWaalsContact O-CA 3.24Å; V190-A194 WeakPolarHBondContact O-CA 3.46Å; V190-A194 PolarHBondContact O-N 2.87Å; L191-A194 PolarHBondContact O-N 3.14Å; A194-H417 PolarHBondContact O-CE1 3.28Å; A194-H417 PolarHBondContact O-NE2 2.68Å; A194-H417 VanDerWaalsContact O-NE2 3.09Å
195	L	88.4	Confident	90.6	Very high	11 Å²	11	40 Å²	40	6%	0.058	22%	0.218	C	C	.	.			trans	-86.8	157.8	-170.3	-60.6	162.1	0	0	0	112.4	L172 I178 T189 V190 A193 P197 V200	L172-L195 HydrophobicContact CB-CD1 4.36Å; L172-L195 HydrophobicContact CB-CD2 4.04Å; L172-L195 HydrophobicContact CD1-CD1 4.35Å; I178-L195 HydrophobicContact CD1-CD1 3.31Å; I178-L195 HydrophobicContact CD1-CD2 4.03Å; I178-L195 HydrophobicContact CD1-CG 4.24Å; T189-L195 HydrophobicContact CG2-CD1 4.2Å; V190-L195 PolarHBondContact O-N 2.98Å; A193-L195 VanDerWaalsContact C-N 3.26Å; A193-L195 HydrophobicContact CB-CD1 3.55Å; A193-L195 HydrophobicContact CB-CD2 4.16Å; A193-L195 HydrophobicContact CB-CG 3.57Å; A193-L195 PolarHBondContact O-N 3.48Å; L195-P197 WeakPolarHBondContact O-CD 3.34Å; L195-V200 HydrophobicContact CB-CG2 4.45Å; L195-V200 HydrophobicContact CD1-CG2 4.44Å
196	N	90	Very high	90.7	Very high	75 Å²	75	40 Å²	40	40%	0.401	22%	0.218	S	C	.	.			trans	-68.4	123.7	165.5	179.2	-5.7	0	0	0	109.7	E198 I199	N196-E198 PolarHBondContact ND2-OE2 3.35Å; N196-E198 VanDerWaalsContact ND2-OE2 3.12Å; N196-E198 PolarHBondContact O-N 3.07Å; N196-E198 VanDerWaalsContact O-N 3.09Å; N196-E198 WeakPolarHBondContact OD1-CB 3.34Å; N196-E198 WeakPolarHBondContact OD1-CG 3.1Å; N196-E198 PolarHBondContact OD1-N 3.05Å; N196-I199 HydrophobicContact CB-CG1 4.35Å; N196-I199 WeakPolarHBondContact O-CG1 3.42Å; N196-I199 PolarHBondContact O-N 3.34Å
197	P	91.9	Very high	90.4	Very high	67 Å²	67	38 Å²	38	44%	0.435	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-58.3	-20.4	177.6	-23.5	32.6	0	0	0	115.8	K186 V190 L195 V200	K186-P197 PolarHBondContact NZ-O 3.16Å; V190-P197 HydrophobicContact CG1-CG 4.03Å; L195-P197 WeakPolarHBondContact O-CD 3.34Å; P197-V200 PolarHBondContact O-N 3.4Å; P197-V200 VanDerWaalsContact O-O 3.14Å
198	E	91.7	Very high	90.2	Very high	138 Å²	138	34 Å²	34	65%	0.645	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-74.1	-23.3	-178.5	-64.9	178	154.5	0	0	114.1	N196 V200 R398	N196-E198 PolarHBondContact ND2-OE2 3.35Å; N196-E198 VanDerWaalsContact ND2-OE2 3.12Å; N196-E198 PolarHBondContact O-N 3.07Å; N196-E198 VanDerWaalsContact O-N 3.09Å; N196-E198 WeakPolarHBondContact OD1-CB 3.34Å; N196-E198 WeakPolarHBondContact OD1-CG 3.1Å; N196-E198 PolarHBondContact OD1-N 3.05Å; E198-V200 VanDerWaalsContact C-N 3.28Å; E198-R398 PolarHBondContact O-NH1 3.03Å; E198-R398 VanDerWaalsContact O-NH1 3.14Å; E198-R398 PolarHBondContact O-NH2 3.38Å; E198-R398 VanDerWaalsContact O-NH2 3.16Å
199	I	92.4	Very high	89.8	Confident	38 Å²	38	34.5 Å²	34.5	20%	0.195	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-91.9	8	174.2	65.3	158.8	0	0	0	111.8	H177 I178 N196	H177-I199 CarbonylContact C-O 3.58Å; H177-I199 WeakPolarHBondContact CA-O 3.37Å; H177-I199 PolarHBondContact ND1-O 3.05Å; I178-I199 PolarHBondContact N-O 2.82Å; N196-I199 HydrophobicContact CB-CG1 4.35Å; N196-I199 WeakPolarHBondContact O-CG1 3.42Å; N196-I199 PolarHBondContact O-N 3.34Å
200	V	95.9	Very high	89.8	Confident	5 Å²	5	39.2 Å²	39.2	3%	0.03	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	120.2	-179.7	-168.3	0	0	0	0	109.9	I178 K186 V190 L195 P197 E198	I178-V200 HydrophobicContact CB-CG1 4.32Å; I178-V200 HydrophobicContact CB-CG2 4.21Å; I178-V200 HydrophobicContact CG2-CG1 4.16Å; I178-V200 CarbonylContact O-C 3.57Å; I178-V200 VanDerWaalsContact O-CA 3.3Å; I178-V200 WeakPolarHBondContact O-CA 3.36Å; K186-V200 HydrophobicContact CB-CG1 4.32Å; K186-V200 HydrophobicContact CD-CB 4.35Å; K186-V200 HydrophobicContact CD-CG1 4.06Å; K186-V200 WeakPolarHBondContact CE-O 3.37Å; K186-V200 HydrophobicContact CG-CB 4.35Å; K186-V200 HydrophobicContact CG-CG1 3.76Å; K186-V200 PolarHBondContact NZ-O 2.87Å; V190-V200 HydrophobicContact CG2-CB 4.14Å; V190-V200 HydrophobicContact CG2-CG1 4.34Å; V190-V200 HydrophobicContact CG2-CG2 3.76Å; L195-V200 HydrophobicContact CB-CG2 4.45Å; L195-V200 HydrophobicContact CD1-CG2 4.44Å; P197-V200 PolarHBondContact O-N 3.4Å; P197-V200 VanDerWaalsContact O-O 3.14Å; E198-V200 VanDerWaalsContact C-N 3.28Å
201	S	96.6	Very high	89.7	Confident	27 Å²	27	41.9 Å²	41.9	19%	0.189	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	149.7	174	58.2	0	0	0	0	111.4	H177 I178 V179 C180	H177-S201 VanDerWaalsContact NE2-CB 3.35Å; H177-S201 WeakPolarHBondContact NE2-CB 3.4Å; H177-S201 PolarHBondContact NE2-OG 3.02Å; I178-S201 PolarHBondContact O-N 2.88Å; V179-S201 CarbonylContact C-O 3.55Å; V179-S201 WeakPolarHBondContact CA-O 3.27Å; C180-S201 PolarHBondContact N-O 2.67Å
202	V	96.8	Very high	89.9	Confident	15 Å²	15	36.1 Å²	36.1	9%	0.091	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	123.6	167.6	-179.5	0	0	0	0	108.3	C180 Y183 K186 R391	C180-V202 CarbonylContact O-C 3.53Å; C180-V202 VanDerWaalsContact O-CA 3.24Å; C180-V202 WeakPolarHBondContact O-CA 3.42Å; Y183-V202 HydrophobicContact CD1-CG2 3.69Å; Y183-V202 HydrophobicContact CD2-CG1 4.24Å; Y183-V202 HydrophobicContact CD2-CG2 4.37Å; Y183-V202 HydrophobicContact CE1-CB 4.38Å; Y183-V202 HydrophobicContact CE1-CG2 3.92Å; Y183-V202 HydrophobicContact CE2-CB 4.47Å; Y183-V202 HydrophobicContact CE2-CG1 4.28Å; Y183-V202 HydrophobicContact CG-CG2 3.93Å; K186-V202 HydrophobicContact CB-CG2 3.76Å; K186-V202 HydrophobicContact CD-CG2 3.79Å; K186-V202 HydrophobicContact CG-CG2 4.39Å; V202-R391 PolarHBondContact O-NH2 3.03Å
203	I	95.9	Very high	90.5	Very high	7 Å²	7	37.5 Å²	37.5	4%	0.036	22%	0.219	C	C	.	.			trans	-133.4	109.6	168.2	-53.1	179	0	0	0	106.4	V179 C180 V181 V388 R391 V395	V179-I203 HydrophobicContact CG1-CB 3.6Å; V179-I203 HydrophobicContact CG1-CD1 3.94Å; V179-I203 HydrophobicContact CG1-CG1 3.81Å; V179-I203 HydrophobicContact CG2-CD1 4.11Å; C180-I203 PolarHBondContact O-N 3.39Å; V181-I203 WeakPolarHBondContact CA-O 3.45Å; I203-V388 HydrophobicContact CG2-CB 4.41Å; I203-V388 HydrophobicContact CG2-CG1 3.91Å; I203-V388 HydrophobicContact CG2-CG2 4.4Å; I203-R391 HydrophobicContact CD1-CB 3.89Å; I203-R391 HydrophobicContact CG1-CB 4.23Å; I203-R391 HydrophobicContact CG2-CB 4.1Å; I203-V395 HydrophobicContact CD1-CG2 4.11Å
204	P	92.9	Very high	91	Very high	19 Å²	19	39 Å²	39	12%	0.123	23%	0.228	C	C	.	.			trans	-66.6	159.7	-175.8	29.3	-34.9	0	0	0	111.5	V181 F312 Y383 V388	V181-P204 WeakPolarHBondContact O-CA 3.39Å; P204-F312 HydrophobicContact CB-CD2 4.08Å; P204-F312 HydrophobicContact CB-CE2 3.51Å; P204-F312 HydrophobicContact CB-CZ 3.99Å; P204-Y383 HydrophobicContact CB-CD1 3.78Å; P204-Y383 HydrophobicContact CB-CE1 3.72Å; P204-Y383 HydrophobicContact CG-CD1 3.74Å; P204-Y383 HydrophobicContact CG-CE1 3.81Å; P204-V388 VanDerWaalsContact O-CG2 3.27Å; P204-V388 WeakPolarHBondContact O-CG2 3.4Å
205	N	91.8	Very high	91.5	Very high	15 Å²	15	38 Å²	38	8%	0.08	21%	0.214	C	C	.	.			trans	-67.1	162.6	167.3	-69.3	-36	0	0	0	110.2	H49 V181 F312 M314	H49-N205 PolarHBondContact CE1-OD1 3.21Å; H49-N205 PolarHBondContact ND1-OD1 3.42Å; V181-N205 WeakPolarHBondContact CG1-OD1 3.5Å; N205-F312 HydrophobicContact CB-CD1 3.64Å; N205-F312 HydrophobicContact CB-CE1 3.85Å; N205-F312 HydrophobicContact CB-CG 4.31Å; N205-F312 WeakPolarHBondContact O-CZ 3.09Å; N205-M314 HydrophobicContact CB-CG 3.89Å; N205-M314 HydrophobicContact CB-SD 4Å
206	A	90.5	Very high	91.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.232	C	C	.	.			trans	-121.7	164.7	176.9	0	0	0	0	0	112	Y383 T384 W385 V388	A206-Y383 WeakPolarHBondContact CA-O 3.46Å; A206-Y383 VanDerWaalsContact CB-O 3.29Å; A206-Y383 WeakPolarHBondContact CB-O 3.44Å; A206-T384 VanDerWaalsContact CB-C 3.44Å; A206-W385 HydrophobicContact CB-CD2 3.55Å; A206-W385 HydrophobicContact CB-CE3 3.79Å; A206-W385 HydrophobicContact CB-CG 3.92Å; A206-W385 HydrophobicContact CB-CH2 4.29Å; A206-W385 HydrophobicContact CB-CZ2 4.15Å; A206-W385 HydrophobicContact CB-CZ3 4.15Å; A206-W385 WeakPolarHBondContact O-CZ2 3.43Å; A206-V388 HydrophobicContact CB-CG2 3.7Å
207	V	87.4	Confident	91.8	Very high	8 Å²	8	41.6 Å²	41.6	5%	0.048	24%	0.244	C	C	.	.			trans	-128.1	155.2	168.3	-62.4	0	0	0	0	108	P209 M314 V317 E318 Y383	V207-P209 VanDerWaalsContact O-CD 3.24Å; V207-P209 WeakPolarHBondContact O-CD 3.45Å; V207-M314 HydrophobicContact CG1-CB 4.21Å; V207-V317 HydrophobicContact CB-CG1 4.48Å; V207-V317 HydrophobicContact CG1-CB 3.96Å; V207-V317 HydrophobicContact CG1-CG1 4.21Å; V207-V317 HydrophobicContact CG2-CB 4.1Å; V207-V317 HydrophobicContact CG2-CG1 3.44Å; V207-V317 VanDerWaalsContact CG2-CG1 3.44Å; V207-E318 HydrophobicContact CG1-CG 3.9Å; V207-Y383 PolarHBondContact N-O 3.08Å; V207-Y383 VanDerWaalsContact N-O 3.1Å; V207-Y383 VanDerWaalsContact O-O 3.09Å
208	D	85.9	Confident	91.8	Very high	49 Å²	49	43.3 Å²	43.3	26%	0.262	25%	0.247	S	C	.	.			trans	-85.8	107.8	168.1	-166.2	-34.4	0	0	0	108.8	T210 D211 F212	D208-T210 PolarHBondContact O-N 2.86Å; D208-T210 WeakPolarHBondContact OD1-CB 3.05Å; D208-T210 PolarHBondContact OD1-N 3.22Å; D208-T210 PolarHBondContact OD1-OG1 3.31Å; D208-D211 HydrophobicContact CB-CB 4.27Å; D208-D211 PolarHBondContact O-N 3.04Å; D208-D211 VanDerWaalsContact O-N 3.16Å; D208-F212 WeakPolarHBondContact O-CD2 3.16Å
209	P	79.3	Confident	91.9	Very high	22 Å²	22	38.3 Å²	38.3	14%	0.143	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-19.5	-179.3	31.1	-39	0	0	0	112.8	V207 D211 F212 H376 K380	V207-P209 VanDerWaalsContact O-CD 3.24Å; V207-P209 WeakPolarHBondContact O-CD 3.45Å; P209-D211 VanDerWaalsContact C-N 3.3Å; P209-F212 CarbonylContact O-C 3.56Å; P209-F212 PolarHBondContact O-N 3.28Å; P209-H376 PolarHBondContact O-CE1 3.29Å; P209-K380 HydrophobicContact CB-CB 3.71Å; P209-K380 HydrophobicContact CG-CB 4.2Å; P209-K380 WeakPolarHBondContact CG-O 3.33Å
210	T	86.1	Confident	91.8	Very high	103 Å²	103	38 Å²	38	63%	0.632	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-25.6	177	68	0	0	0	0	112.3	D208 F212	D208-T210 PolarHBondContact O-N 2.86Å; D208-T210 WeakPolarHBondContact OD1-CB 3.05Å; D208-T210 PolarHBondContact OD1-N 3.22Å; D208-T210 PolarHBondContact OD1-OG1 3.31Å; T210-F212 VanDerWaalsContact C-N 3.31Å
211	D	88.6	Confident	91.3	Very high	77 Å²	77	44.3 Å²	44.3	41%	0.412	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-17.7	172.3	-68.2	-20.3	0	0	0	111.9	D208 P209 R294	D208-D211 HydrophobicContact CB-CB 4.27Å; D208-D211 PolarHBondContact O-N 3.04Å; D208-D211 VanDerWaalsContact O-N 3.16Å; P209-D211 VanDerWaalsContact C-N 3.3Å; D211-R294 WeakPolarHBondContact O-CD 3.3Å; D211-R294 WeakPolarHBondContact O-CG 3.42Å
212	F	92.6	Very high	91.1	Very high	4 Å²	4	48.2 Å²	48.2	2%	0.018	28%	0.282	C	S	.	.	S	Bend	trans	-126.8	75.3	-175.9	-63.5	-76.3	0	0	0	111.7	D208 P209 T210 H290 V293 R294 L297 E318 S321 H376	D208-F212 WeakPolarHBondContact O-CD2 3.16Å; P209-F212 CarbonylContact O-C 3.56Å; P209-F212 PolarHBondContact O-N 3.28Å; T210-F212 VanDerWaalsContact C-N 3.31Å; F212-H290 AromaticContact CE2-CE1 3.92Å; F212-H290 AromaticContact CE2-NE2 3.93Å; F212-H290 AromaticContact CZ-CE1 3.58Å; F212-H290 AromaticContact CZ-NE2 3.87Å; F212-V293 HydrophobicContact CE1-CB 4.2Å; F212-V293 HydrophobicContact CE1-CG1 3.86Å; F212-V293 HydrophobicContact CZ-CG1 4.47Å; F212-R294 HydrophobicContact CD1-CB 4.16Å; F212-R294 HydrophobicContact CE1-CB 4.32Å; F212-L297 HydrophobicContact CD1-CD1 3.96Å; F212-L297 HydrophobicContact CE1-CD1 4.11Å; F212-E318 HydrophobicContact CD1-CB 3.99Å; F212-E318 HydrophobicContact CD1-CG 4.34Å; F212-E318 HydrophobicContact CD2-CB 4.42Å; F212-E318 HydrophobicContact CD2-CG 4.06Å; F212-E318 HydrophobicContact CE1-CB 3.96Å; F212-E318 HydrophobicContact CE1-CG 4.02Å; F212-E318 HydrophobicContact CE2-CB 4.41Å; F212-E318 HydrophobicContact CE2-CG 3.73Å; F212-E318 HydrophobicContact CG-CB 4.23Å; F212-E318 HydrophobicContact CG-CG 4.37Å; F212-E318 HydrophobicContact CZ-CB 4.18Å; F212-E318 HydrophobicContact CZ-CG 3.7Å; F212-S321 CarbonylContact O-C 3.59Å; F212-S321 WeakPolarHBondContact O-CB 3.41Å; F212-S321 VanDerWaalsContact O-O 3.04Å; F212-H376 PolarHBondContact O-CE1 2.96Å; F212-H376 PolarHBondContact O-ND1 3.1Å
213	T	94.8	Very high	91	Very high	44 Å²	44	51.7 Å²	51.7	27%	0.27	29%	0.294	S	S	.	.			trans	-102.5	143.2	176.3	63.5	0	0	0	0	111.4	R294	T213-R294 PolarHBondContact O-NE 3.32Å; T213-R294 PolarHBondContact O-NH2 2.75Å; T213-R294 PolarHBondContact OG1-NE 2.98Å; T213-R294 VanDerWaalsContact OG1-NE 3.09Å; T213-R294 PolarHBondContact OG1-NH2 2.84Å
214	P	95.8	Very high	91	Very high	31 Å²	31	51.9 Å²	51.9	20%	0.201	30%	0.295	C	S	.	.			trans	-65.2	142.4	176	28	-34.6	0	0	0	111.9	C322 P372 H376	P214-C322 WeakPolarHBondContact CA-O 3.3Å; P214-C322 WeakPolarHBondContact CB-O 3.5Å; P214-P372 HydrophobicContact CB-CB 3.79Å; P214-H376 HydrophobicContact CG-CB 3.92Å
215	D	95.6	Very high	91.3	Very high	42 Å²	42	51.4 Å²	51.4	23%	0.225	29%	0.292	C	S	.	.			trans	-137.7	85.2	167.5	-175.8	-3.3	0	0	0	109.6	S217 Q218 V298	D215-S217 PolarHBondContact O-N 2.84Å; D215-S217 VanDerWaalsContact O-N 3.16Å; D215-S217 WeakPolarHBondContact OD1-CB 3.47Å; D215-S217 PolarHBondContact OD1-N 3.28Å; D215-S217 PolarHBondContact OD1-OG 3.37Å; D215-Q218 HydrophobicContact CB-CG 4.21Å; D215-Q218 PolarHBondContact O-N 2.75Å; D215-Q218 VanDerWaalsContact OD2-CG 3.32Å; D215-Q218 WeakPolarHBondContact OD2-CG 3.4Å; D215-V298 HydrophobicContact CB-CB 4.08Å; D215-V298 HydrophobicContact CB-CG1 4.05Å; D215-V298 HydrophobicContact CB-CG2 4.39Å
216	P	91.3	Very high	91.6	Very high	68 Å²	68	50.7 Å²	50.7	44%	0.442	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-63.7	-17.5	-177.5	-22.8	34.9	0	0	0	114.1	Q218 R219 P372	P216-Q218 PolarHBondContact O-N 2.73Å; P216-R219 WeakPolarHBondContact O-CB 3.43Å; P216-R219 PolarHBondContact O-N 3.29Å; P216-P372 HydrophobicContact CG-CB 4.07Å; P216-P372 HydrophobicContact CG-CG 3.99Å
217	S	93.4	Very high	92	Very high	94 Å²	94	50.7 Å²	50.7	66%	0.657	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-68.1	-21.2	179.6	75	0	0	0	0	113	D215 R219	D215-S217 PolarHBondContact O-N 2.84Å; D215-S217 VanDerWaalsContact O-N 3.16Å; D215-S217 WeakPolarHBondContact OD1-CB 3.47Å; D215-S217 PolarHBondContact OD1-N 3.28Å; D215-S217 PolarHBondContact OD1-OG 3.37Å; S217-R219 VanDerWaalsContact C-N 3.28Å
218	Q	93.8	Very high	92.5	Very high	103 Å²	103	50.5 Å²	50.5	48%	0.481	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-82.1	-6.5	177.4	-60.4	-64.1	-30.8	0	0	112.9	D215 P216 V298	D215-Q218 HydrophobicContact CB-CG 4.21Å; D215-Q218 PolarHBondContact O-N 2.75Å; D215-Q218 VanDerWaalsContact OD2-CG 3.32Å; D215-Q218 WeakPolarHBondContact OD2-CG 3.4Å; P216-Q218 PolarHBondContact O-N 2.73Å; Q218-V298 HydrophobicContact CB-CB 4.43Å; Q218-V298 HydrophobicContact CB-CG2 3.91Å; Q218-V298 HydrophobicContact CG-CG2 3.94Å
219	R	92.9	Very high	93	Very high	34 Å²	34	49.2 Å²	49.2	13%	0.128	28%	0.279	C	S	.	.	S	Bend	trans	-80.4	130.4	-179.7	-64.9	179	-178.2	179.1	-1.7	109.7	P216 S217 V298 G300 G323 P372	P216-R219 WeakPolarHBondContact O-CB 3.43Å; P216-R219 PolarHBondContact O-N 3.29Å; S217-R219 VanDerWaalsContact C-N 3.28Å; R219-V298 VanDerWaalsContact CG-O 3.25Å; R219-V298 WeakPolarHBondContact CG-O 3.45Å; R219-G300 PolarHBondContact NE-O 3Å; R219-G323 PolarHBondContact NH2-O 3.34Å; R219-P372 VanDerWaalsContact NH1-CG 3.28Å
220	P	89.8	Confident	93.6	Very high	32 Å²	32	49.2 Å²	49.2	21%	0.208	28%	0.28	C	S	.	.			trans	-60.2	129.4	172.1	-23.9	34.5	0	0	0	110.8	D222 R223	P220-D222 VanDerWaalsContact C-N 3.3Å; P220-D222 WeakPolarHBondContact CB-OD1 3.32Å; P220-D222 PolarHBondContact O-N 3.28Å; P220-R223 HydrophobicContact CB-CG 3.45Å; P220-R223 VanDerWaalsContact CB-CG 3.45Å; P220-R223 HydrophobicContact CG-CG 4.12Å
221	P	86.1	Confident	93.8	Very high	136 Å²	136	52.2 Å²	52.2	88%	0.883	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-19.4	-177.3	30.4	-35.2	0	0	0	113.2
222	D	91.8	Very high	94.1	Very high	109 Å²	109	48.6 Å²	48.6	58%	0.583	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-6.2	-171.8	62.6	-38.9	0	0	0	113.9	P220	P220-D222 VanDerWaalsContact C-N 3.3Å; P220-D222 WeakPolarHBondContact CB-OD1 3.32Å; P220-D222 PolarHBondContact O-N 3.28Å
223	R	94.7	Very high	94	Very high	88 Å²	88	50.3 Å²	50.3	33%	0.332	27%	0.271	S	S	.	.	S	Bend	trans	-154.1	153	-170.9	55.6	-173.8	137.1	-174.3	-2.6	114	P220 D254 H256 H301	P220-R223 HydrophobicContact CB-CG 3.45Å; P220-R223 VanDerWaalsContact CB-CG 3.45Å; P220-R223 HydrophobicContact CG-CG 4.12Å; R223-D254 WeakPolarHBondContact CA-O 3.17Å; R223-D254 WeakPolarHBondContact CB-O 3.34Å; R223-H256 WeakPolarHBondContact CD-CE1 3.42Å; R223-H256 VanDerWaalsContact CD-ND1 3.3Å; R223-H256 WeakPolarHBondContact CD-ND1 3.41Å; R223-H256 PolarHBondContact NH1-CD2 3.35Å; R223-H256 VanDerWaalsContact NH1-CD2 3.33Å; R223-H256 PolarHBondContact NH1-NE2 2.8Å; R223-H301 PolarHBondContact O-CE1 2.82Å; R223-H301 VanDerWaalsContact O-CE1 3.22Å
224	I	96.9	Very high	93.8	Very high	11 Å²	11	55.3 Å²	55.3	6%	0.056	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	125.5	171.4	-60.1	176.1	0	0	0	108.4	D254 L255 H256 H301 I302 I361 Q364 R365	I224-D254 PolarHBondContact N-O 2.84Å; I224-L255 HydrophobicContact CB-CD1 4.02Å; I224-L255 HydrophobicContact CG2-CD1 3.89Å; I224-L255 WeakPolarHBondContact O-CA 3.21Å; I224-H256 PolarHBondContact O-N 3.26Å; I224-H301 HydrophobicContact CG2-CB 4.15Å; I224-I302 HydrophobicContact CG2-CD1 4.17Å; I224-I361 HydrophobicContact CD1-CG2 3.77Å; I224-Q364 HydrophobicContact CD1-CG 4.41Å; I224-R365 HydrophobicContact CD1-CG 3.74Å
225	T	98.1	Very high	93.4	Very high	10 Å²	10	60 Å²	60	6%	0.061	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	121.8	179.3	-59.5	0	0	0	0	110.5	V227 H256 L258 H301 I302	T225-V227 HydrophobicContact CG2-CG2 4.23Å; T225-H256 CarbonylContact C-O 3.39Å; T225-H256 WeakPolarHBondContact CA-O 3.38Å; T225-L258 HydrophobicContact CG2-CB 4.02Å; T225-H301 PolarHBondContact N-ND1 2.95Å; T225-H301 PolarHBondContact O-N 2.96Å; T225-I302 PolarHBondContact O-N 3.42Å
226	I	98.5	Very high	93.3	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	126	169.1	-62.1	168.3	0	0	0	108.3	L248 L255 H256 F257 L258 I302 L304 L357	I226-L248 HydrophobicContact CD1-CD1 4.48Å; I226-L255 HydrophobicContact CD1-CD1 3.74Å; I226-L255 HydrophobicContact CD1-CD2 3.86Å; I226-L255 HydrophobicContact CD1-CG 4.07Å; I226-L255 HydrophobicContact CG1-CD1 3.98Å; I226-H256 PolarHBondContact N-O 2.66Å; I226-F257 HydrophobicContact CB-CD1 3.91Å; I226-F257 HydrophobicContact CB-CE1 3.94Å; I226-F257 HydrophobicContact CD1-CD1 4.44Å; I226-F257 HydrophobicContact CD1-CE1 3.68Å; I226-F257 HydrophobicContact CD1-CE2 4.37Å; I226-F257 HydrophobicContact CD1-CZ 3.64Å; I226-F257 HydrophobicContact CG1-CE1 4.42Å; I226-F257 HydrophobicContact CG2-CD1 4.01Å; I226-F257 HydrophobicContact CG2-CE1 3.9Å; I226-F257 WeakPolarHBondContact O-CA 3.31Å; I226-L258 PolarHBondContact O-N 2.94Å; I226-I302 CarbonylContact C-O 3.58Å; I226-I302 WeakPolarHBondContact CA-O 3.49Å; I226-I302 HydrophobicContact CG1-CB 4.16Å; I226-I302 HydrophobicContact CG1-CD1 4.32Å; I226-L304 HydrophobicContact CG2-CB 3.56Å; I226-L304 HydrophobicContact CG2-CD2 4.06Å; I226-L304 HydrophobicContact CG2-CG 4.48Å; I226-L357 HydrophobicContact CD1-CD2 3.9Å; I226-L357 HydrophobicContact CG1-CD2 4.46Å
227	V	98.4	Very high	93.4	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.7	178.9	179.6	0	0	0	0	109.6	T225 I229 L258 V296 L297 I302 F303 L304 L324	T225-V227 HydrophobicContact CG2-CG2 4.23Å; V227-I229 HydrophobicContact CG1-CD1 3.98Å; V227-I229 HydrophobicContact CG1-CG1 3.84Å; V227-L258 WeakPolarHBondContact CA-O 3.25Å; V227-L258 HydrophobicContact CG2-CB 4.25Å; V227-L258 HydrophobicContact CG2-CD2 4.4Å; V227-V296 HydrophobicContact CG1-CG1 4.06Å; V227-L297 HydrophobicContact CG1-CD2 3.99Å; V227-I302 PolarHBondContact N-O 3.37Å; V227-F303 WeakPolarHBondContact O-CA 3.3Å; V227-L304 PolarHBondContact O-N 2.7Å; V227-L324 HydrophobicContact CB-CD2 4.26Å; V227-L324 HydrophobicContact CG2-CD2 4.36Å
228	V	98.3	Very high	93.6	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121.5	172.9	-178.9	0	0	0	0	107.8	L241 L258 I259 G260 L304	V228-L241 HydrophobicContact CB-CD2 4.43Å; V228-L241 HydrophobicContact CG1-CD2 4Å; V228-L241 HydrophobicContact CG2-CD1 4.07Å; V228-L241 HydrophobicContact CG2-CD2 4.22Å; V228-L258 PolarHBondContact N-O 3.44Å; V228-I259 HydrophobicContact CB-CG1 4.29Å; V228-I259 HydrophobicContact CB-CG2 4.34Å; V228-I259 CarbonylContact O-C 3.54Å; V228-I259 WeakPolarHBondContact O-CA 3.28Å; V228-G260 PolarHBondContact O-N 3.19Å; V228-L304 HydrophobicContact CG2-CB 3.94Å; V228-L304 HydrophobicContact CG2-CD2 4.15Å; V228-L304 HydrophobicContact CG2-CG 4.25Å
229	I	95.9	Very high	93.7	Very high	23 Å²	23	49.7 Å²	49.7	12%	0.118	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	109.1	175.4	-58.9	178.4	0	0	0	108.9	V227 G260 L288 V293 V296 L297 F303	V227-I229 HydrophobicContact CG1-CD1 3.98Å; V227-I229 HydrophobicContact CG1-CG1 3.84Å; I229-G260 VanDerWaalsContact CA-O 3.31Å; I229-G260 WeakPolarHBondContact CA-O 3.18Å; I229-L288 HydrophobicContact CD1-CD1 4.3Å; I229-L288 HydrophobicContact CG1-CD1 4.46Å; I229-L288 HydrophobicContact CG2-CD1 4.48Å; I229-V293 HydrophobicContact CD1-CG1 3.78Å; I229-V293 HydrophobicContact CG2-CG1 4.47Å; I229-V296 HydrophobicContact CD1-CB 4.15Å; I229-V296 HydrophobicContact CD1-CG1 3.9Å; I229-V296 HydrophobicContact CG1-CG1 4.38Å; I229-L297 HydrophobicContact CD1-CD2 3.67Å; I229-L297 HydrophobicContact CD1-CG 3.76Å; I229-L297 HydrophobicContact CG1-CD2 4.5Å; I229-F303 HydrophobicContact CB-CE2 4.36Å
230	S	92.6	Very high	93.9	Very high	21 Å²	21	49.4 Å²	49.4	15%	0.147	24%	0.236	C	C	.	.	S	Bend	trans	-165.6	164.2	178.5	72.8	0	0	0	0	112.4	L232 G260 G261	S230-L232 PolarHBondContact O-N 3.01Å; S230-G260 PolarHBondContact N-O 2.9Å; S230-G261 WeakPolarHBondContact O-CA 3.32Å
231	R	90.4	Very high	94.3	Very high	166 Å²	166	47.9 Å²	47.9	63%	0.626	23%	0.226	S	C	*	.			trans	-63.5	134.6	164.5	-68.8	-177.8	-66.9	177.1	-3.7	109.9	V233 K236	R231-V233 VanDerWaalsContact C-N 3.29Å; R231-V233 HydrophobicContact CB-CG1 4.48Å; R231-V233 HydrophobicContact CB-CG2 4.32Å; R231-V233 PolarHBondContact O-N 2.87Å; R231-K236 WeakPolarHBondContact O-CB 3.45Å; R231-K236 WeakPolarHBondContact O-CG 3.39Å
232	L	94	Very high	94.8	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	19%	0.188	C	C	.	.			trans	-85.7	71.7	-176.7	-53	-179.4	0	0	0	111	S230 I238 I259 G261 E262 G263 P264 K265 R266 L269	S230-L232 PolarHBondContact O-N 3.01Å; L232-I238 HydrophobicContact CB-CG1 4.23Å; L232-I238 HydrophobicContact CD2-CD1 3.63Å; L232-I238 HydrophobicContact CD2-CG1 4.21Å; L232-I259 HydrophobicContact CD2-CG2 4.24Å; L232-G261 WeakPolarHBondContact CD1-O 3.35Å; L232-E262 PolarHBondContact N-O 3.4Å; L232-G263 CarbonylContact O-C 3.57Å; L232-G263 VanDerWaalsContact O-C 3.22Å; L232-G263 WeakPolarHBondContact O-CA 3.37Å; L232-P264 WeakPolarHBondContact O-CD 3.41Å; L232-K265 WeakPolarHBondContact O-CB 3.46Å; L232-K265 PolarHBondContact O-N 3.46Å; L232-R266 HydrophobicContact CD1-CB 3.74Å; L232-R266 HydrophobicContact CD1-CG 4.02Å; L232-L269 HydrophobicContact CD1-CD1 4.29Å; L232-L269 HydrophobicContact CD2-CD1 4.28Å
233	V	90.8	Very high	95	Very high	40 Å²	40	37.9 Å²	37.9	24%	0.242	17%	0.174	C	C	.	.	S	Bend	trans	-126.7	160.5	-178	-63.6	0	0	0	0	111.4	R231 R235 K236 P264	R231-V233 VanDerWaalsContact C-N 3.29Å; R231-V233 HydrophobicContact CB-CG1 4.48Å; R231-V233 HydrophobicContact CB-CG2 4.32Å; R231-V233 PolarHBondContact O-N 2.87Å; V233-R235 VanDerWaalsContact C-N 3.32Å; V233-R235 PolarHBondContact O-N 2.68Å; V233-K236 HydrophobicContact CG2-CB 4.27Å; V233-K236 HydrophobicContact CG2-CG 3.74Å; V233-K236 WeakPolarHBondContact O-CB 3.16Å; V233-K236 PolarHBondContact O-N 3.07Å; V233-P264 HydrophobicContact CG1-CG 4.37Å
234	Y	90.3	Very high	95.2	Very high	148 Å²	148	33.7 Å²	33.7	58%	0.58	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-50	-46.8	-178	178.4	-102	0	0	0	113.8	K236 G237 D239 L308	Y234-K236 PolarHBondContact O-N 3.31Å; Y234-K236 VanDerWaalsContact O-N 3.1Å; Y234-G237 PolarHBondContact O-N 3.33Å; Y234-D239 WeakPolarHBondContact CD2-OD2 3.39Å; Y234-L308 HydrophobicContact CD1-CD1 4.4Å; Y234-L308 HydrophobicContact CE1-CD1 3.93Å; Y234-L308 HydrophobicContact CE2-CD1 4.33Å
235	R	88.8	Confident	95.2	Very high	130 Å²	130	33.3 Å²	33.3	49%	0.491	16%	0.156	S	C	.	.	G	3₁₀ helix	trans	-60.1	-23.3	179.8	-70.9	-172.2	-82.4	170.2	-8.6	114	V233 L308 T309	V233-R235 VanDerWaalsContact C-N 3.32Å; V233-R235 PolarHBondContact O-N 2.68Å; R235-L308 PolarHBondContact O-N 2.79Å; R235-T309 HydrophobicContact CB-CG2 4.23Å; R235-T309 HydrophobicContact CG-CG2 4.19Å
236	K	92.2	Very high	95.2	Very high	30 Å²	30	33.6 Å²	33.6	13%	0.13	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-85.3	3.8	175.9	-64.5	-64.2	-166.2	167	0	112.9	R231 V233 Y234 I238 T306 S307 E310	R231-K236 WeakPolarHBondContact O-CB 3.45Å; R231-K236 WeakPolarHBondContact O-CG 3.39Å; V233-K236 HydrophobicContact CG2-CB 4.27Å; V233-K236 HydrophobicContact CG2-CG 3.74Å; V233-K236 WeakPolarHBondContact O-CB 3.16Å; V233-K236 PolarHBondContact O-N 3.07Å; Y234-K236 PolarHBondContact O-N 3.31Å; Y234-K236 VanDerWaalsContact O-N 3.1Å; K236-I238 VanDerWaalsContact C-N 3.33Å; K236-I238 HydrophobicContact CB-CD1 4.11Å; K236-I238 HydrophobicContact CB-CG1 4.39Å; K236-I238 PolarHBondContact O-N 2.86Å; K236-T306 CarbonylContact O-C 3.22Å; K236-T306 PolarHBondContact O-OG1 3.27Å; K236-T306 VanDerWaalsContact O-OG1 3.08Å; K236-S307 VanDerWaalsContact CD-OG 3.28Å; K236-S307 WeakPolarHBondContact CD-OG 3.42Å; K236-S307 PolarHBondContact O-N 2.83Å; K236-E310 IonicContact NZ-OE1 2.75Å; K236-E310 PolarHBondContact NZ-OE1 3.47Å
237	G	94.5	Very high	95.1	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.01	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	39.8	174.3	0	0	0	0	0	113.2	Y234 D239 L240 L241 T306	Y234-G237 PolarHBondContact O-N 3.33Å; G237-D239 PolarHBondContact O-N 3.02Å; G237-L240 WeakPolarHBondContact O-CB 3.32Å; G237-L240 PolarHBondContact O-N 2.83Å; G237-L240 VanDerWaalsContact O-N 3.07Å; G237-L241 PolarHBondContact O-N 2.98Å; G237-T306 VanDerWaalsContact CA-O 3.32Å; G237-T306 WeakPolarHBondContact CA-O 3.46Å; G237-T306 PolarHBondContact O-OG1 3.32Å
238	I	96.6	Very high	95.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-64.6	-28.1	177.5	-53.5	-52.5	0	0	0	111.3	L232 K236 L240 L241 G242 K265 L269	L232-I238 HydrophobicContact CB-CG1 4.23Å; L232-I238 HydrophobicContact CD2-CD1 3.63Å; L232-I238 HydrophobicContact CD2-CG1 4.21Å; K236-I238 VanDerWaalsContact C-N 3.33Å; K236-I238 HydrophobicContact CB-CD1 4.11Å; K236-I238 HydrophobicContact CB-CG1 4.39Å; K236-I238 PolarHBondContact O-N 2.86Å; I238-L240 VanDerWaalsContact C-N 3.3Å; I238-L240 PolarHBondContact O-N 2.79Å; I238-L241 WeakPolarHBondContact O-CB 3.35Å; I238-L241 PolarHBondContact O-N 2.94Å; I238-G242 PolarHBondContact O-N 2.63Å; I238-K265 HydrophobicContact CB-CB 3.75Å; I238-K265 HydrophobicContact CB-CG 4.44Å; I238-K265 HydrophobicContact CG1-CB 4.08Å; I238-K265 HydrophobicContact CG2-CB 3.82Å; I238-L269 HydrophobicContact CG2-CD1 3.93Å; I238-L269 HydrophobicContact CG2-CD2 3.89Å; I238-L269 HydrophobicContact CG2-CG 3.75Å
239	D	96.1	Very high	95	Very high	60 Å²	60	36.8 Å²	36.8	32%	0.321	17%	0.173	S	C	.	.	H	α-helix	trans	-63	-36.7	172.7	-59.3	-50.1	0	0	0	111.6	Y234 G237 G243 K265	Y234-D239 WeakPolarHBondContact CD2-OD2 3.39Å; G237-D239 PolarHBondContact O-N 3.02Å; D239-G243 PolarHBondContact O-N 2.9Å; D239-K265 IonicContact OD1-NZ 3.83Å; D239-K265 PolarHBondContact OD1-NZ 3.35Å; D239-K265 WeakPolarHBondContact OD2-CE 3.47Å; D239-K265 IonicContact OD2-NZ 2.7Å; D239-K265 PolarHBondContact OD2-NZ 3.33Å
240	L	97.4	Very high	95	Very high	27 Å²	27	43.1 Å²	43.1	14%	0.141	21%	0.207	C	C	.	.	H	α-helix	trans	-67	-43.4	172.6	-61.5	177.3	0	0	0	110.8	G237 I238 G242 G243 I244 L308 P348 V350 L353	G237-L240 WeakPolarHBondContact O-CB 3.32Å; G237-L240 PolarHBondContact O-N 2.83Å; G237-L240 VanDerWaalsContact O-N 3.07Å; I238-L240 VanDerWaalsContact C-N 3.3Å; I238-L240 PolarHBondContact O-N 2.79Å; L240-G242 VanDerWaalsContact C-N 3.3Å; L240-G242 PolarHBondContact O-N 3.45Å; L240-G243 PolarHBondContact O-N 3.48Å; L240-G243 VanDerWaalsContact O-N 3.07Å; L240-I244 HydrophobicContact CB-CD1 4.45Å; L240-I244 WeakPolarHBondContact O-CD1 3.33Å; L240-I244 VanDerWaalsContact O-CG1 3.24Å; L240-I244 WeakPolarHBondContact O-CG1 3.46Å; L240-I244 PolarHBondContact O-N 3.02Å; L240-L308 HydrophobicContact CD1-CD2 3.7Å; L240-L308 HydrophobicContact CG-CD2 4.44Å; L240-P348 HydrophobicContact CD1-CB 4.27Å; L240-V350 HydrophobicContact CD2-CG2 4.08Å; L240-L353 HydrophobicContact CB-CD1 4.34Å; L240-L353 HydrophobicContact CD1-CD1 4.02Å
241	L	97.4	Very high	95.1	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.7	-42.3	177.6	-177.7	60.3	0	0	0	111.8	V228 G237 I238 G243 I244 I245 F257 I259 L269 L304 T306	V228-L241 HydrophobicContact CB-CD2 4.43Å; V228-L241 HydrophobicContact CG1-CD2 4Å; V228-L241 HydrophobicContact CG2-CD1 4.07Å; V228-L241 HydrophobicContact CG2-CD2 4.22Å; G237-L241 PolarHBondContact O-N 2.98Å; I238-L241 WeakPolarHBondContact O-CB 3.35Å; I238-L241 PolarHBondContact O-N 2.94Å; L241-G243 PolarHBondContact O-N 3.2Å; L241-I244 PolarHBondContact O-N 3.05Å; L241-I245 HydrophobicContact CD1-CD1 4.01Å; L241-I245 HydrophobicContact CD1-CG1 4.03Å; L241-I245 HydrophobicContact CG-CD1 3.83Å; L241-I245 HydrophobicContact CG-CG1 4.34Å; L241-I245 VanDerWaalsContact O-CG1 3.32Å; L241-I245 WeakPolarHBondContact O-CG1 3.35Å; L241-I245 PolarHBondContact O-N 3.2Å; L241-I245 VanDerWaalsContact O-N 3.07Å; L241-F257 HydrophobicContact CD1-CE1 4.49Å; L241-I259 HydrophobicContact CD2-CD1 4.03Å; L241-L269 HydrophobicContact CB-CD2 4.41Å; L241-L269 HydrophobicContact CD2-CD1 4.24Å; L241-L269 HydrophobicContact CD2-CD2 4.07Å; L241-L269 HydrophobicContact CG-CD2 4.03Å; L241-L304 HydrophobicContact CD1-CD2 3.88Å; L241-T306 HydrophobicContact CB-CG2 4.47Å
242	G	96.9	Very high	95.4	Very high	7 Å²	7	40.3 Å²	40.3	7%	0.072	20%	0.197	C	C	.	.	H	α-helix	trans	-61.2	-29.8	175.2	0	0	0	0	0	113.9	I238 L240 P246 V272	I238-G242 PolarHBondContact O-N 2.63Å; L240-G242 VanDerWaalsContact C-N 3.3Å; L240-G242 PolarHBondContact O-N 3.45Å; G242-P246 WeakPolarHBondContact O-CD 3.45Å; G242-P246 WeakPolarHBondContact O-CG 3.05Å; G242-V272 WeakPolarHBondContact O-CG2 3.44Å
243	G	96.9	Very high	95.4	Very high	29 Å²	29	45 Å²	45	30%	0.299	23%	0.227	S	C	.	.	H	α-helix	trans	-79	-34.7	172.6	0	0	0	0	0	114	D239 L240 L241	D239-G243 PolarHBondContact O-N 2.9Å; L240-G243 PolarHBondContact O-N 3.48Å; L240-G243 VanDerWaalsContact O-N 3.07Å; L241-G243 PolarHBondContact O-N 3.2Å
244	I	97.9	Very high	95.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-72.1	-44.8	-176.9	-69	159.1	0	0	0	112	L240 L241 E247 L248 T306 V350 L353 L357	L240-I244 HydrophobicContact CB-CD1 4.45Å; L240-I244 WeakPolarHBondContact O-CD1 3.33Å; L240-I244 VanDerWaalsContact O-CG1 3.24Å; L240-I244 WeakPolarHBondContact O-CG1 3.46Å; L240-I244 PolarHBondContact O-N 3.02Å; L241-I244 PolarHBondContact O-N 3.05Å; I244-E247 PolarHBondContact O-N 3.38Å; I244-L248 HydrophobicContact CG2-CD1 3.59Å; I244-L248 HydrophobicContact CG2-CG 4.16Å; I244-L248 PolarHBondContact O-N 3.5Å; I244-T306 HydrophobicContact CD1-CG2 3.92Å; I244-V350 HydrophobicContact CG1-CB 4.48Å; I244-V350 HydrophobicContact CG1-CG1 4.03Å; I244-L353 HydrophobicContact CD1-CB 3.53Å; I244-L353 HydrophobicContact CD1-CD1 3.64Å; I244-L353 HydrophobicContact CD1-CG 4.17Å; I244-L353 HydrophobicContact CG1-CB 4.16Å; I244-L357 HydrophobicContact CG2-CD1 3.64Å
245	I	98	Very high	95.9	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.01	20%	0.2	C	C	.	.	H	α-helix	trans	-52.1	-57.2	-175.6	-73.3	166.7	0	0	0	112.4	L241 E247 C249 F257 I259 L269 V272 L278 V282	L241-I245 HydrophobicContact CD1-CD1 4.01Å; L241-I245 HydrophobicContact CD1-CG1 4.03Å; L241-I245 HydrophobicContact CG-CD1 3.83Å; L241-I245 HydrophobicContact CG-CG1 4.34Å; L241-I245 VanDerWaalsContact O-CG1 3.32Å; L241-I245 WeakPolarHBondContact O-CG1 3.35Å; L241-I245 PolarHBondContact O-N 3.2Å; L241-I245 VanDerWaalsContact O-N 3.07Å; I245-E247 PolarHBondContact O-N 3.12Å; I245-C249 VanDerWaalsContact O-CB 3.23Å; I245-C249 WeakPolarHBondContact O-CB 3.24Å; I245-C249 PolarHBondContact O-N 2.97Å; I245-C249 PolarHBondContact O-SG 3.49Å; I245-F257 HydrophobicContact CB-CE2 4.46Å; I245-F257 HydrophobicContact CG1-CD1 3.97Å; I245-F257 HydrophobicContact CG1-CD2 4.21Å; I245-F257 HydrophobicContact CG1-CE1 3.93Å; I245-F257 HydrophobicContact CG1-CE2 4.17Å; I245-F257 HydrophobicContact CG1-CG 4.11Å; I245-F257 HydrophobicContact CG1-CZ 4.02Å; I245-F257 HydrophobicContact CG2-CD2 4.4Å; I245-F257 HydrophobicContact CG2-CE2 4.47Å; I245-I259 HydrophobicContact CD1-CD1 3.78Å; I245-L269 HydrophobicContact CD1-CD2 4Å; I245-V272 HydrophobicContact CB-CG1 4.39Å; I245-V272 HydrophobicContact CG2-CG1 4.12Å; I245-L278 HydrophobicContact CG2-CD1 3.68Å; I245-V282 HydrophobicContact CD1-CG1 4.35Å; I245-V282 HydrophobicContact CG2-CG2 3.52Å
246	P	97.4	Very high	96.4	Very high	16 Å²	16	33.5 Å²	33.5	10%	0.104	18%	0.183	C	C	.	.	H	α-helix	trans	-66.2	-37.7	-176.2	25.2	-34	0	0	0	112.3	G242 L250 V272 Y276	G242-P246 WeakPolarHBondContact O-CD 3.45Å; G242-P246 WeakPolarHBondContact O-CG 3.05Å; P246-L250 WeakPolarHBondContact O-CB 3.35Å; P246-L250 PolarHBondContact O-N 2.93Å; P246-V272 HydrophobicContact CG-CG1 4.3Å; P246-Y276 HydrophobicContact CB-CD1 3.79Å; P246-Y276 HydrophobicContact CB-CD2 3.71Å; P246-Y276 HydrophobicContact CB-CE1 3.83Å; P246-Y276 HydrophobicContact CB-CE2 3.76Å; P246-Y276 HydrophobicContact CB-CG 3.74Å; P246-Y276 HydrophobicContact CG-CD2 4.25Å; P246-Y276 HydrophobicContact CG-CE2 3.95Å
247	E	96.7	Very high	96.7	Very high	66 Å²	66	32.2 Å²	32.2	31%	0.308	18%	0.178	S	C	.	.	H	α-helix	trans	-62.8	-48.2	-179.7	-168.2	-171.2	149.4	0	0	111.7	I244 I245 K251 C354	I244-E247 PolarHBondContact O-N 3.38Å; I245-E247 PolarHBondContact O-N 3.12Å; E247-K251 PolarHBondContact O-N 3.09Å; E247-K251 IonicContact OE1-NZ 2.67Å; E247-K251 PolarHBondContact OE1-NZ 3.4Å; E247-C354 PolarHBondContact OE2-SG 2.6Å
248	L	97.2	Very high	96.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-73.9	-36.9	-179.5	-68.1	-178	0	0	0	112.3	I226 I244 L250 K251 H252 L255 F257 C354 L357 E358	I226-L248 HydrophobicContact CD1-CD1 4.48Å; I244-L248 HydrophobicContact CG2-CD1 3.59Å; I244-L248 HydrophobicContact CG2-CG 4.16Å; I244-L248 PolarHBondContact O-N 3.5Å; L248-L250 VanDerWaalsContact C-N 3.27Å; L248-L250 PolarHBondContact O-N 3.44Å; L248-K251 PolarHBondContact O-N 3.13Å; L248-H252 PolarHBondContact O-N 3.08Å; L248-L255 HydrophobicContact CB-CD2 3.55Å; L248-L255 HydrophobicContact CD1-CD2 4.25Å; L248-F257 HydrophobicContact CD1-CZ 4.36Å; L248-C354 HydrophobicContact CD2-CB 4.21Å; L248-L357 HydrophobicContact CD1-CB 3.75Å; L248-L357 HydrophobicContact CD1-CD1 3.44Å; L248-L357 VanDerWaalsContact CD1-CD1 3.44Å; L248-L357 HydrophobicContact CD1-CG 4.18Å; L248-E358 HydrophobicContact CD2-CG 3.85Å
249	C	96.7	Very high	96.9	Very high	4 Å²	4	32.6 Å²	32.6	3%	0.027	18%	0.179	C	C	.	.	H	α-helix	trans	-62.8	-35.7	177	-77	0	0	0	0	112.1	I245 L278 R281	I245-C249 VanDerWaalsContact O-CB 3.23Å; I245-C249 WeakPolarHBondContact O-CB 3.24Å; I245-C249 PolarHBondContact O-N 2.97Å; I245-C249 PolarHBondContact O-SG 3.49Å; C249-L278 HydrophobicContact CB-CD1 4.16Å; C249-L278 HydrophobicContact CB-CD2 3.79Å; C249-R281 VanDerWaalsContact CA-NH2 3.35Å; C249-R281 PolarHBondContact O-NH1 3.34Å; C249-R281 PolarHBondContact O-NH2 3.46Å
250	L	95.6	Very high	96.9	Very high	156 Å²	156	29.8 Å²	29.8	82%	0.817	17%	0.165	S	C	*	.	H	α-helix	trans	-65	-39.6	175.6	-175.5	66	0	0	0	112.2	P246 L248	P246-L250 WeakPolarHBondContact O-CB 3.35Å; P246-L250 PolarHBondContact O-N 2.93Å; L248-L250 VanDerWaalsContact C-N 3.27Å; L248-L250 PolarHBondContact O-N 3.44Å
251	K	96.1	Very high	96.8	Very high	103 Å²	103	29 Å²	29	45%	0.448	16%	0.163	S	C	.	.	H	α-helix	trans	-80.6	-31.7	-177.6	-69	172.4	177.6	172.8	0	113.8	E247 L248 E358	E247-K251 PolarHBondContact O-N 3.09Å; E247-K251 IonicContact OE1-NZ 2.67Å; E247-K251 PolarHBondContact OE1-NZ 3.4Å; L248-K251 PolarHBondContact O-N 3.13Å; K251-E358 WeakPolarHBondContact CD-OE1 3.45Å; K251-E358 IonicContact NZ-OE1 3.47Å; K251-E358 PolarHBondContact NZ-OE1 2.91Å
252	H	95.8	Very high	96.5	Very high	25 Å²	25	33 Å²	33	12%	0.116	18%	0.181	C	C	.	.			trans	-124.9	93.8	-172.5	-63.9	-87.8	0	0	0	110.4	L248 D254 L255 R281 R365	L248-H252 PolarHBondContact O-N 3.08Å; H252-D254 PolarHBondContact O-N 2.89Å; H252-L255 HydrophobicContact CB-CB 3.79Å; H252-L255 HydrophobicContact CB-CD2 4.41Å; H252-L255 WeakPolarHBondContact O-CB 3.22Å; H252-L255 PolarHBondContact O-N 2.78Å; H252-R281 PolarHBondContact O-NH2 3.24Å; H252-R365 PolarHBondContact ND1-NH1 3.1Å; H252-R365 PolarHBondContact ND1-NH2 3.12Å
253	P	93.8	Very high	96.3	Very high	101 Å²	101	33.8 Å²	33.8	66%	0.656	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-28.9	-175.7	-26	35.5	0	0	0	114.9	L255 R281	P253-L255 VanDerWaalsContact C-N 3.33Å; P253-R281 VanDerWaalsContact O-CZ 3.3Å
254	D	95.3	Very high	96.1	Very high	47 Å²	47	37.2 Å²	37.2	25%	0.251	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-4.6	178.5	59.1	-52.2	0	0	0	113.8	R223 I224 H252 H256 R365	R223-D254 WeakPolarHBondContact CA-O 3.17Å; R223-D254 WeakPolarHBondContact CB-O 3.34Å; I224-D254 PolarHBondContact N-O 2.84Å; H252-D254 PolarHBondContact O-N 2.89Å; D254-H256 PolarHBondContact O-ND1 3.46Å; D254-R365 IonicContact OD1-CZ 2.77Å; D254-R365 IonicContact OD1-NH2 2.62Å; D254-R365 PolarHBondContact OD1-NH2 3.36Å; D254-R365 IonicContact OD2-CZ 3.07Å; D254-R365 IonicContact OD2-NE 3.64Å; D254-R365 IonicContact OD2-NH2 3.39Å; D254-R365 PolarHBondContact OD2-NH2 3.12Å
255	L	97.6	Very high	96	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	134.3	-175.1	-166.7	69.3	0	0	0	112.4	I224 I226 L248 H252 P253 F257 R281 I361	I224-L255 HydrophobicContact CB-CD1 4.02Å; I224-L255 HydrophobicContact CG2-CD1 3.89Å; I224-L255 WeakPolarHBondContact O-CA 3.21Å; I226-L255 HydrophobicContact CD1-CD1 3.74Å; I226-L255 HydrophobicContact CD1-CD2 3.86Å; I226-L255 HydrophobicContact CD1-CG 4.07Å; I226-L255 HydrophobicContact CG1-CD1 3.98Å; L248-L255 HydrophobicContact CB-CD2 3.55Å; L248-L255 HydrophobicContact CD1-CD2 4.25Å; H252-L255 HydrophobicContact CB-CB 3.79Å; H252-L255 HydrophobicContact CB-CD2 4.41Å; H252-L255 WeakPolarHBondContact O-CB 3.22Å; H252-L255 PolarHBondContact O-N 2.78Å; P253-L255 VanDerWaalsContact C-N 3.33Å; L255-F257 HydrophobicContact CD2-CE2 3.87Å; L255-F257 HydrophobicContact CD2-CZ 4.15Å; L255-F257 HydrophobicContact CG-CE2 4.23Å; L255-R281 VanDerWaalsContact O-CZ 3.25Å; L255-R281 PolarHBondContact O-NE 3.39Å; L255-R281 PolarHBondContact O-NH2 3.31Å; L255-I361 HydrophobicContact CD1-CD1 3.94Å; L255-I361 HydrophobicContact CD1-CG1 4.39Å; L255-I361 HydrophobicContact CD2-CD1 4.17Å
256	H	97.9	Very high	95.9	Very high	30 Å²	30	42.2 Å²	42.2	14%	0.139	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.6	177.9	-68.2	66.1	0	0	0	110.7	R223 I224 T225 I226 D254 R281	R223-H256 WeakPolarHBondContact CD-CE1 3.42Å; R223-H256 VanDerWaalsContact CD-ND1 3.3Å; R223-H256 WeakPolarHBondContact CD-ND1 3.41Å; R223-H256 PolarHBondContact NH1-CD2 3.35Å; R223-H256 VanDerWaalsContact NH1-CD2 3.33Å; R223-H256 PolarHBondContact NH1-NE2 2.8Å; I224-H256 PolarHBondContact O-N 3.26Å; T225-H256 CarbonylContact C-O 3.39Å; T225-H256 WeakPolarHBondContact CA-O 3.38Å; I226-H256 PolarHBondContact N-O 2.66Å; D254-H256 PolarHBondContact O-ND1 3.46Å; H256-R281 CarbonylContact C-O 3.2Å; H256-R281 WeakPolarHBondContact CA-O 3.3Å
257	F	98.4	Very high	95.9	Very high	3 Å²	3	46.6 Å²	46.6	1%	0.013	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	131.7	176.3	-72.8	-95.3	0	0	0	110.5	I226 L241 I245 L248 L255 I259 R281 V282 R283 L304	I226-F257 HydrophobicContact CB-CD1 3.91Å; I226-F257 HydrophobicContact CB-CE1 3.94Å; I226-F257 HydrophobicContact CD1-CD1 4.44Å; I226-F257 HydrophobicContact CD1-CE1 3.68Å; I226-F257 HydrophobicContact CD1-CE2 4.37Å; I226-F257 HydrophobicContact CD1-CZ 3.64Å; I226-F257 HydrophobicContact CG1-CE1 4.42Å; I226-F257 HydrophobicContact CG2-CD1 4.01Å; I226-F257 HydrophobicContact CG2-CE1 3.9Å; I226-F257 WeakPolarHBondContact O-CA 3.31Å; L241-F257 HydrophobicContact CD1-CE1 4.49Å; I245-F257 HydrophobicContact CB-CE2 4.46Å; I245-F257 HydrophobicContact CG1-CD1 3.97Å; I245-F257 HydrophobicContact CG1-CD2 4.21Å; I245-F257 HydrophobicContact CG1-CE1 3.93Å; I245-F257 HydrophobicContact CG1-CE2 4.17Å; I245-F257 HydrophobicContact CG1-CG 4.11Å; I245-F257 HydrophobicContact CG1-CZ 4.02Å; I245-F257 HydrophobicContact CG2-CD2 4.4Å; I245-F257 HydrophobicContact CG2-CE2 4.47Å; L248-F257 HydrophobicContact CD1-CZ 4.36Å; L255-F257 HydrophobicContact CD2-CE2 3.87Å; L255-F257 HydrophobicContact CD2-CZ 4.15Å; L255-F257 HydrophobicContact CG-CE2 4.23Å; F257-I259 HydrophobicContact CB-CD1 4.41Å; F257-I259 HydrophobicContact CB-CG1 4.37Å; F257-R281 PolarHBondContact N-O 3.43Å; F257-V282 HydrophobicContact CB-CG1 4.31Å; F257-V282 HydrophobicContact CB-CG2 4.26Å; F257-V282 HydrophobicContact CD2-CG2 4.37Å; F257-R283 PolarHBondContact O-N 2.57Å; F257-L304 HydrophobicContact CE1-CD2 4.44Å
258	L	97.9	Very high	95.8	Very high	7 Å²	7	45.1 Å²	45.1	4%	0.037	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	109.9	173.5	-169.6	63.3	0	0	0	108.5	T225 I226 V227 V228 R283 L285 V296 Q299	T225-L258 HydrophobicContact CG2-CB 4.02Å; I226-L258 PolarHBondContact O-N 2.94Å; V227-L258 WeakPolarHBondContact CA-O 3.25Å; V227-L258 HydrophobicContact CG2-CB 4.25Å; V227-L258 HydrophobicContact CG2-CD2 4.4Å; V228-L258 PolarHBondContact N-O 3.44Å; L258-R283 HydrophobicContact CD1-CB 3.87Å; L258-L285 HydrophobicContact CD1-CD1 3.68Å; L258-L285 HydrophobicContact CD1-CD2 3.77Å; L258-L285 HydrophobicContact CD1-CG 3.75Å; L258-L285 HydrophobicContact CD2-CD1 4.32Å; L258-L285 HydrophobicContact CG-CD1 3.82Å; L258-L285 HydrophobicContact CG-CG 4.34Å; L258-V296 HydrophobicContact CD2-CG1 3.59Å; L258-V296 HydrophobicContact CG-CG1 3.93Å; L258-Q299 HydrophobicContact CD2-CB 4.13Å
259	I	98.3	Very high	95.8	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	111.4	-170.2	-53.9	174.6	0	0	0	109.1	V228 L232 L241 I245 F257 L269 V282 R283 L284 L285	V228-I259 HydrophobicContact CB-CG1 4.29Å; V228-I259 HydrophobicContact CB-CG2 4.34Å; V228-I259 CarbonylContact O-C 3.54Å; V228-I259 WeakPolarHBondContact O-CA 3.28Å; L232-I259 HydrophobicContact CD2-CG2 4.24Å; L241-I259 HydrophobicContact CD2-CD1 4.03Å; I245-I259 HydrophobicContact CD1-CD1 3.78Å; F257-I259 HydrophobicContact CB-CD1 4.41Å; F257-I259 HydrophobicContact CB-CG1 4.37Å; I259-L269 HydrophobicContact CD1-CD1 4.05Å; I259-L269 HydrophobicContact CG2-CD1 4.03Å; I259-V282 HydrophobicContact CD1-CG1 4Å; I259-R283 PolarHBondContact N-O 3.05Å; I259-L284 HydrophobicContact CB-CD2 3.83Å; I259-L284 HydrophobicContact CD1-CD2 3.84Å; I259-L284 HydrophobicContact CG1-CD2 4.3Å; I259-L284 HydrophobicContact CG2-CD2 4.23Å; I259-L285 PolarHBondContact O-N 2.73Å
260	G	96.5	Very high	95.8	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	128.1	173.3	0	0	0	0	0	111.3	V228 I229 S230	V228-G260 PolarHBondContact O-N 3.19Å; I229-G260 VanDerWaalsContact CA-O 3.31Å; I229-G260 WeakPolarHBondContact CA-O 3.18Å; S230-G260 PolarHBondContact N-O 2.9Å
261	G	93.4	Very high	95.9	Very high	10 Å²	10	46.3 Å²	46.3	10%	0.103	25%	0.245	C	C	.	.			trans	149.7	159.7	-178.5	0	0	0	0	0	114.2	S230 L232 G286	S230-G261 WeakPolarHBondContact O-CA 3.32Å; L232-G261 WeakPolarHBondContact CD1-O 3.35Å; G261-G286 CarbonylContact C-O 3.49Å; G261-G286 PolarHBondContact N-O 3.06Å; G261-G286 CarbonylContact O-C 3.57Å; G261-G286 WeakPolarHBondContact O-CA 3.48Å
262	E	92.1	Very high	95.9	Very high	83 Å²	83	42.3 Å²	42.3	39%	0.388	23%	0.23	S	C	.	.			trans	-129.9	156.4	170.3	-80.4	-59.9	151.6	0	0	111.5	L232 R266 G286 A287	L232-E262 PolarHBondContact N-O 3.4Å; E262-R266 IonicContact OE1-CZ 2.7Å; E262-R266 IonicContact OE1-NE 3.16Å; E262-R266 IonicContact OE1-NH1 2.75Å; E262-R266 PolarHBondContact OE1-NH1 2.82Å; E262-R266 VanDerWaalsContact OE2-CD 3.27Å; E262-R266 WeakPolarHBondContact OE2-CD 3.26Å; E262-G286 WeakPolarHBondContact OE1-CA 3.21Å; E262-A287 HydrophobicContact CB-CB 4.22Å; E262-A287 HydrophobicContact CG-CB 3.63Å
263	G	93	Very high	95.9	Very high	24 Å²	24	43.9 Å²	43.9	25%	0.247	24%	0.235	C	C	.	.	S	Bend	trans	155.3	172	174.7	0	0	0	0	0	113.7	L232 K265 R266	L232-G263 CarbonylContact O-C 3.57Å; L232-G263 VanDerWaalsContact O-C 3.22Å; L232-G263 WeakPolarHBondContact O-CA 3.37Å; G263-K265 PolarHBondContact O-N 2.95Å; G263-K265 VanDerWaalsContact O-N 3.11Å; G263-R266 WeakPolarHBondContact O-CB 3.4Å; G263-R266 PolarHBondContact O-N 3.44Å
264	P	93	Very high	96.1	Very high	101 Å²	101	44.2 Å²	44.2	66%	0.656	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.5	-174	25.2	-35.8	0	0	0	113.8	L232 V233 R266	L232-P264 WeakPolarHBondContact O-CD 3.41Å; V233-P264 HydrophobicContact CG1-CG 4.37Å; P264-R266 VanDerWaalsContact C-N 3.26Å; P264-R266 PolarHBondContact O-N 3.37Å
265	K	94.9	Very high	96.2	Very high	56 Å²	56	49.7 Å²	49.7	24%	0.243	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	2.8	177	-67.6	-73.9	-171.3	164.2	0	113.4	L232 I238 D239 G263 L267 V268	L232-K265 WeakPolarHBondContact O-CB 3.46Å; L232-K265 PolarHBondContact O-N 3.46Å; I238-K265 HydrophobicContact CB-CB 3.75Å; I238-K265 HydrophobicContact CB-CG 4.44Å; I238-K265 HydrophobicContact CG1-CB 4.08Å; I238-K265 HydrophobicContact CG2-CB 3.82Å; D239-K265 IonicContact OD1-NZ 3.83Å; D239-K265 PolarHBondContact OD1-NZ 3.35Å; D239-K265 WeakPolarHBondContact OD2-CE 3.47Å; D239-K265 IonicContact OD2-NZ 2.7Å; D239-K265 PolarHBondContact OD2-NZ 3.33Å; G263-K265 PolarHBondContact O-N 2.95Å; G263-K265 VanDerWaalsContact O-N 3.11Å; K265-L267 PolarHBondContact O-N 3.01Å; K265-V268 HydrophobicContact CD-CG2 3.94Å; K265-V268 WeakPolarHBondContact O-CB 3.4Å; K265-V268 PolarHBondContact O-N 2.73Å
266	R	96.3	Very high	96.1	Very high	51 Å²	51	55.1 Å²	55.1	19%	0.192	27%	0.27	C	S	.	.	H	α-helix	trans	-56.5	-40.1	172.1	-177.8	175.4	165.5	117.8	10.7	111.9	L232 E262 G263 P264 V268 L269 E270	L232-R266 HydrophobicContact CD1-CB 3.74Å; L232-R266 HydrophobicContact CD1-CG 4.02Å; E262-R266 IonicContact OE1-CZ 2.7Å; E262-R266 IonicContact OE1-NE 3.16Å; E262-R266 IonicContact OE1-NH1 2.75Å; E262-R266 PolarHBondContact OE1-NH1 2.82Å; E262-R266 VanDerWaalsContact OE2-CD 3.27Å; E262-R266 WeakPolarHBondContact OE2-CD 3.26Å; G263-R266 WeakPolarHBondContact O-CB 3.4Å; G263-R266 PolarHBondContact O-N 3.44Å; P264-R266 VanDerWaalsContact C-N 3.26Å; P264-R266 PolarHBondContact O-N 3.37Å; R266-V268 PolarHBondContact O-N 3.5Å; R266-L269 WeakPolarHBondContact O-CB 3.3Å; R266-L269 PolarHBondContact O-N 3.08Å; R266-E270 HydrophobicContact CG-CG 4.46Å; R266-E270 IonicContact CZ-OE1 2.64Å; R266-E270 IonicContact NE-OE1 3.55Å; R266-E270 PolarHBondContact NE-OE1 3.17Å; R266-E270 IonicContact NH2-OE1 2.92Å; R266-E270 PolarHBondContact NH2-OE1 3Å; R266-E270 PolarHBondContact O-N 3.07Å; R266-E270 VanDerWaalsContact O-N 3.12Å
267	L	96.5	Very high	96.1	Very high	108 Å²	108	61.7 Å²	61.7	57%	0.565	30%	0.301	S	S	*	.	H	α-helix	trans	-54.1	-38.8	178.4	-68.5	171.5	0	0	0	112.6	K265 L269 E270 E271	K265-L267 PolarHBondContact O-N 3.01Å; L267-L269 VanDerWaalsContact C-N 3.28Å; L267-L269 PolarHBondContact O-N 3.41Å; L267-E270 PolarHBondContact O-N 3.34Å; L267-E271 WeakPolarHBondContact O-CB 3.41Å; L267-E271 WeakPolarHBondContact O-CG 3.28Å; L267-E271 PolarHBondContact O-N 3.32Å
268	V	96.1	Very high	96	Very high	36 Å²	36	62.3 Å²	62.3	22%	0.218	30%	0.304	C	S	.	.	H	α-helix	trans	-60	-39.9	177.6	178.9	0	0	0	0	111.3	K265 R266 V272	K265-V268 HydrophobicContact CD-CG2 3.94Å; K265-V268 WeakPolarHBondContact O-CB 3.4Å; K265-V268 PolarHBondContact O-N 2.73Å; R266-V268 PolarHBondContact O-N 3.5Å; V268-V272 VanDerWaalsContact O-CG2 3.24Å; V268-V272 WeakPolarHBondContact O-CG2 3.28Å; V268-V272 PolarHBondContact O-N 3.07Å; V268-V272 VanDerWaalsContact O-N 3.08Å
269	L	97.2	Very high	95.9	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-73.9	-34.9	179.4	-59.1	179	0	0	0	111.9	L232 I238 L241 I245 I259 R266 L267 R273 L284	L232-L269 HydrophobicContact CD1-CD1 4.29Å; L232-L269 HydrophobicContact CD2-CD1 4.28Å; I238-L269 HydrophobicContact CG2-CD1 3.93Å; I238-L269 HydrophobicContact CG2-CD2 3.89Å; I238-L269 HydrophobicContact CG2-CG 3.75Å; L241-L269 HydrophobicContact CB-CD2 4.41Å; L241-L269 HydrophobicContact CD2-CD1 4.24Å; L241-L269 HydrophobicContact CD2-CD2 4.07Å; L241-L269 HydrophobicContact CG-CD2 4.03Å; I245-L269 HydrophobicContact CD1-CD2 4Å; I259-L269 HydrophobicContact CD1-CD1 4.05Å; I259-L269 HydrophobicContact CG2-CD1 4.03Å; R266-L269 WeakPolarHBondContact O-CB 3.3Å; R266-L269 PolarHBondContact O-N 3.08Å; L267-L269 VanDerWaalsContact C-N 3.28Å; L267-L269 PolarHBondContact O-N 3.41Å; L269-R273 WeakPolarHBondContact O-CB 3.39Å; L269-R273 PolarHBondContact O-N 3.18Å; L269-L284 HydrophobicContact CB-CD1 4.23Å; L269-L284 HydrophobicContact CB-CD2 4.12Å; L269-L284 HydrophobicContact CD1-CD2 4.07Å
270	E	97	Very high	95.6	Very high	52 Å²	52	72.1 Å²	72.1	24%	0.243	36%	0.355	C	S	.	.	H	α-helix	trans	-65.9	-46.4	174.4	-69.8	175.4	166.3	0	0	110.8	R266 L267 V272 R273 E274 L284	R266-E270 HydrophobicContact CG-CG 4.46Å; R266-E270 IonicContact CZ-OE1 2.64Å; R266-E270 IonicContact NE-OE1 3.55Å; R266-E270 PolarHBondContact NE-OE1 3.17Å; R266-E270 IonicContact NH2-OE1 2.92Å; R266-E270 PolarHBondContact NH2-OE1 3Å; R266-E270 PolarHBondContact O-N 3.07Å; R266-E270 VanDerWaalsContact O-N 3.12Å; L267-E270 PolarHBondContact O-N 3.34Å; E270-V272 VanDerWaalsContact C-N 3.34Å; E270-V272 PolarHBondContact O-N 3.35Å; E270-R273 WeakPolarHBondContact O-CB 3.18Å; E270-R273 PolarHBondContact O-N 3.24Å; E270-R273 VanDerWaalsContact O-N 3.09Å; E270-E274 WeakPolarHBondContact O-CG 3.27Å; E270-E274 PolarHBondContact O-N 2.95Å; E270-L284 HydrophobicContact CG-CD1 3.55Å
271	E	96.9	Very high	95.6	Very high	131 Å²	131	74.2 Å²	74.2	61%	0.612	36%	0.362	S	S	*	.	H	α-helix	trans	-57.9	-43.8	174.4	-74.4	173.6	-170.2	0	0	112.3	L267 R273 E274 K275	L267-E271 WeakPolarHBondContact O-CB 3.41Å; L267-E271 WeakPolarHBondContact O-CG 3.28Å; L267-E271 PolarHBondContact O-N 3.32Å; E271-R273 VanDerWaalsContact C-N 3.34Å; E271-E274 PolarHBondContact O-N 3.31Å; E271-K275 WeakPolarHBondContact O-CB 3.34Å; E271-K275 PolarHBondContact O-N 2.88Å
272	V	96.3	Very high	95.8	Very high	20 Å²	20	73.9 Å²	73.9	12%	0.121	36%	0.358	C	S	.	.	H	α-helix	trans	-61.8	-42.9	174.6	166.8	0	0	0	0	110.9	G242 I245 P246 V268 E270 E274 Y276	G242-V272 WeakPolarHBondContact O-CG2 3.44Å; I245-V272 HydrophobicContact CB-CG1 4.39Å; I245-V272 HydrophobicContact CG2-CG1 4.12Å; P246-V272 HydrophobicContact CG-CG1 4.3Å; V268-V272 VanDerWaalsContact O-CG2 3.24Å; V268-V272 WeakPolarHBondContact O-CG2 3.28Å; V268-V272 PolarHBondContact O-N 3.07Å; V268-V272 VanDerWaalsContact O-N 3.08Å; E270-V272 VanDerWaalsContact C-N 3.34Å; E270-V272 PolarHBondContact O-N 3.35Å; V272-E274 PolarHBondContact O-N 2.85Å; V272-Y276 HydrophobicContact CG1-CD2 4.13Å; V272-Y276 WeakPolarHBondContact O-CD2 3.44Å; V272-Y276 PolarHBondContact O-N 3.08Å; V272-Y276 VanDerWaalsContact O-N 3.13Å
273	R	96.5	Very high	96.1	Very high	58 Å²	58	76.9 Å²	76.9	22%	0.219	37%	0.366	C	S	.	.	H	α-helix	trans	-63.3	-42.8	179.5	-167.9	-177.3	68	171.7	4.5	111.9	L269 E270 E271 Q277 L278 H279 V282	L269-R273 WeakPolarHBondContact O-CB 3.39Å; L269-R273 PolarHBondContact O-N 3.18Å; E270-R273 WeakPolarHBondContact O-CB 3.18Å; E270-R273 PolarHBondContact O-N 3.24Å; E270-R273 VanDerWaalsContact O-N 3.09Å; E271-R273 VanDerWaalsContact C-N 3.34Å; R273-Q277 CarbonylContact O-C 3.57Å; R273-Q277 WeakPolarHBondContact O-CA 3.35Å; R273-Q277 PolarHBondContact O-N 2.7Å; R273-L278 HydrophobicContact CG-CB 4.42Å; R273-L278 PolarHBondContact O-N 2.86Å; R273-H279 WeakPolarHBondContact CD-ND1 3.22Å; R273-H279 PolarHBondContact NE-CE1 3.28Å; R273-H279 VanDerWaalsContact NE-CE1 3.31Å; R273-H279 PolarHBondContact NE-ND1 3.27Å; R273-V282 WeakPolarHBondContact CD-O 3.14Å; R273-V282 HydrophobicContact CG-CB 4.45Å
274	E	96.8	Very high	96.3	Very high	107 Å²	107	76.9 Å²	76.9	50%	0.5	36%	0.36	S	S	.	.	H	α-helix	trans	-67.4	-51.9	176.7	-64.4	-56.5	157.8	0	0	111.8	E270 E271 V272 Y276 Q277 H279	E270-E274 WeakPolarHBondContact O-CG 3.27Å; E270-E274 PolarHBondContact O-N 2.95Å; E271-E274 PolarHBondContact O-N 3.31Å; V272-E274 PolarHBondContact O-N 2.85Å; E274-Y276 VanDerWaalsContact C-N 3.27Å; E274-Y276 PolarHBondContact O-N 3.42Å; E274-Q277 PolarHBondContact O-N 3.13Å; E274-Q277 VanDerWaalsContact O-N 3.17Å; E274-H279 IonicContact OE1-CE1 3.55Å; E274-H279 PolarHBondContact OE1-CE1 3.14Å; E274-H279 IonicContact OE1-NE2 2.86Å; E274-H279 PolarHBondContact OE1-NE2 2.89Å; E274-H279 IonicContact OE2-CE1 2.94Å; E274-H279 PolarHBondContact OE2-CE1 2.74Å; E274-H279 IonicContact OE2-NE2 2.76Å; E274-H279 PolarHBondContact OE2-NE2 3.27Å
275	K	97.2	Very high	96.5	Very high	162 Å²	162	75.1 Å²	75.1	70%	0.704	34%	0.344	S	S	*	.	H	α-helix	trans	-59.6	-36.9	-174.7	-178.9	176.7	178.6	-178.6	0	113	E271	E271-K275 WeakPolarHBondContact O-CB 3.34Å; E271-K275 PolarHBondContact O-N 2.88Å
276	Y	96.6	Very high	96.4	Very high	115 Å²	115	72.7 Å²	72.7	45%	0.451	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	7.2	-178.1	-64	-85.4	0	0	0	113.3	P246 V272 E274 L278	P246-Y276 HydrophobicContact CB-CD1 3.79Å; P246-Y276 HydrophobicContact CB-CD2 3.71Å; P246-Y276 HydrophobicContact CB-CE1 3.83Å; P246-Y276 HydrophobicContact CB-CE2 3.76Å; P246-Y276 HydrophobicContact CB-CG 3.74Å; P246-Y276 HydrophobicContact CG-CD2 4.25Å; P246-Y276 HydrophobicContact CG-CE2 3.95Å; V272-Y276 HydrophobicContact CG1-CD2 4.13Å; V272-Y276 WeakPolarHBondContact O-CD2 3.44Å; V272-Y276 PolarHBondContact O-N 3.08Å; V272-Y276 VanDerWaalsContact O-N 3.13Å; E274-Y276 VanDerWaalsContact C-N 3.27Å; E274-Y276 PolarHBondContact O-N 3.42Å; Y276-L278 VanDerWaalsContact C-N 3.32Å; Y276-L278 PolarHBondContact O-N 3.45Å
277	Q	96.6	Very high	96.2	Very high	168 Å²	168	74 Å²	74	79%	0.785	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	43	179.4	-58.7	179	-17.5	0	0	113.6	R273 E274 H279	R273-Q277 CarbonylContact O-C 3.57Å; R273-Q277 WeakPolarHBondContact O-CA 3.35Å; R273-Q277 PolarHBondContact O-N 2.7Å; E274-Q277 PolarHBondContact O-N 3.13Å; E274-Q277 VanDerWaalsContact O-N 3.17Å; Q277-H279 PolarHBondContact O-N 2.59Å
278	L	96.7	Very high	95.9	Very high	15 Å²	15	71.1 Å²	71.1	8%	0.079	34%	0.342	C	S	.	.			trans	-95.9	25.5	-173.2	-63.9	174.4	0	0	0	113.8	I245 C249 R273 Y276 D280 R281 V282	I245-L278 HydrophobicContact CG2-CD1 3.68Å; C249-L278 HydrophobicContact CB-CD1 4.16Å; C249-L278 HydrophobicContact CB-CD2 3.79Å; R273-L278 HydrophobicContact CG-CB 4.42Å; R273-L278 PolarHBondContact O-N 2.86Å; Y276-L278 VanDerWaalsContact C-N 3.32Å; Y276-L278 PolarHBondContact O-N 3.45Å; L278-D280 VanDerWaalsContact C-N 3.33Å; L278-D280 PolarHBondContact O-N 2.69Å; L278-R281 PolarHBondContact O-N 2.86Å; L278-V282 HydrophobicContact CB-CB 4.44Å; L278-V282 HydrophobicContact CB-CG2 3.81Å; L278-V282 HydrophobicContact CD1-CG2 4.24Å; L278-V282 PolarHBondContact O-N 2.88Å
279	H	95.1	Very high	95.4	Very high	75 Å²	75	74.6 Å²	74.6	35%	0.347	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-43.7	-175.1	-72.9	-61.2	0	0	0	114.1	R273 E274 Q277 R281	R273-H279 WeakPolarHBondContact CD-ND1 3.22Å; R273-H279 PolarHBondContact NE-CE1 3.28Å; R273-H279 VanDerWaalsContact NE-CE1 3.31Å; R273-H279 PolarHBondContact NE-ND1 3.27Å; E274-H279 IonicContact OE1-CE1 3.55Å; E274-H279 PolarHBondContact OE1-CE1 3.14Å; E274-H279 IonicContact OE1-NE2 2.86Å; E274-H279 PolarHBondContact OE1-NE2 2.89Å; E274-H279 IonicContact OE2-CE1 2.94Å; E274-H279 PolarHBondContact OE2-CE1 2.74Å; E274-H279 IonicContact OE2-NE2 2.76Å; E274-H279 PolarHBondContact OE2-NE2 3.27Å; Q277-H279 PolarHBondContact O-N 2.59Å; H279-R281 VanDerWaalsContact C-N 3.26Å; H279-R281 PolarHBondContact O-N 3.35Å
280	D	93.8	Very high	94.8	Very high	141 Å²	141	77.5 Å²	77.5	75%	0.754	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77	-15.8	-178.9	-59.3	-42.4	0	0	0	113	L278	L278-D280 VanDerWaalsContact C-N 3.33Å; L278-D280 PolarHBondContact O-N 2.69Å
281	R	95.6	Very high	94.3	Very high	45 Å²	45	82.1 Å²	82.1	17%	0.17	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	-24.8	-170	-63.3	-172.4	61.2	-173.5	-6.1	113.8	C249 H252 P253 L255 H256 F257 L278 H279	C249-R281 VanDerWaalsContact CA-NH2 3.35Å; C249-R281 PolarHBondContact O-NH1 3.34Å; C249-R281 PolarHBondContact O-NH2 3.46Å; H252-R281 PolarHBondContact O-NH2 3.24Å; P253-R281 VanDerWaalsContact O-CZ 3.3Å; L255-R281 VanDerWaalsContact O-CZ 3.25Å; L255-R281 PolarHBondContact O-NE 3.39Å; L255-R281 PolarHBondContact O-NH2 3.31Å; H256-R281 CarbonylContact C-O 3.2Å; H256-R281 WeakPolarHBondContact CA-O 3.3Å; F257-R281 PolarHBondContact N-O 3.43Å; L278-R281 PolarHBondContact O-N 2.86Å; H279-R281 VanDerWaalsContact C-N 3.26Å; H279-R281 PolarHBondContact O-N 3.35Å
282	V	97.7	Very high	94	Very high	2 Å²	2	79.3 Å²	79.3	1%	0.012	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	101.2	-177.5	-177.7	0	0	0	0	109	I245 F257 I259 R273 L278 L284	I245-V282 HydrophobicContact CD1-CG1 4.35Å; I245-V282 HydrophobicContact CG2-CG2 3.52Å; F257-V282 HydrophobicContact CB-CG1 4.31Å; F257-V282 HydrophobicContact CB-CG2 4.26Å; F257-V282 HydrophobicContact CD2-CG2 4.37Å; I259-V282 HydrophobicContact CD1-CG1 4Å; R273-V282 WeakPolarHBondContact CD-O 3.14Å; R273-V282 HydrophobicContact CG-CB 4.45Å; L278-V282 HydrophobicContact CB-CB 4.44Å; L278-V282 HydrophobicContact CB-CG2 3.81Å; L278-V282 HydrophobicContact CD1-CG2 4.24Å; L278-V282 PolarHBondContact O-N 2.88Å; V282-L284 HydrophobicContact CG1-CD2 4.27Å
283	R	97.5	Very high	93.9	Very high	146 Å²	146	78.7 Å²	78.7	55%	0.551	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.9	116.6	-180	-66.5	-177.3	68	-172.5	0.6	110.3	F257 L258 I259	F257-R283 PolarHBondContact O-N 2.57Å; L258-R283 HydrophobicContact CD1-CB 3.87Å; I259-R283 PolarHBondContact N-O 3.05Å
284	L	97.6	Very high	93.9	Very high	24 Å²	24	79.6 Å²	79.6	13%	0.126	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	110.7	172.8	-54.2	-177.6	0	0	0	108.9	I259 L269 E270 V282	I259-L284 HydrophobicContact CB-CD2 3.83Å; I259-L284 HydrophobicContact CD1-CD2 3.84Å; I259-L284 HydrophobicContact CG1-CD2 4.3Å; I259-L284 HydrophobicContact CG2-CD2 4.23Å; L269-L284 HydrophobicContact CB-CD1 4.23Å; L269-L284 HydrophobicContact CB-CD2 4.12Å; L269-L284 HydrophobicContact CD1-CD2 4.07Å; E270-L284 HydrophobicContact CG-CD1 3.55Å; V282-L284 HydrophobicContact CG1-CD2 4.27Å
285	L	96.6	Very high	93.8	Very high	64 Å²	64	76.1 Å²	76.1	34%	0.335	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	-19.1	-176.1	-61.2	180	0	0	0	113.5	L258 I259 L288 V296	L258-L285 HydrophobicContact CD1-CD1 3.68Å; L258-L285 HydrophobicContact CD1-CD2 3.77Å; L258-L285 HydrophobicContact CD1-CG 3.75Å; L258-L285 HydrophobicContact CD2-CD1 4.32Å; L258-L285 HydrophobicContact CG-CD1 3.82Å; L258-L285 HydrophobicContact CG-CG 4.34Å; I259-L285 PolarHBondContact O-N 2.73Å; L285-L288 HydrophobicContact CB-CD2 4.21Å; L285-L288 HydrophobicContact CD1-CD1 4.45Å; L285-L288 HydrophobicContact CD1-CD2 4.41Å; L285-V296 HydrophobicContact CD1-CB 4.25Å; L285-V296 HydrophobicContact CD1-CG1 3.6Å; L285-V296 HydrophobicContact CD1-CG2 3.55Å
286	G	94.3	Very high	93.8	Very high	6 Å²	6	69 Å²	69	6%	0.062	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.8	-157.3	-170.9	0	0	0	0	0	113	G261 E262 L288	G261-G286 CarbonylContact C-O 3.49Å; G261-G286 PolarHBondContact N-O 3.06Å; G261-G286 CarbonylContact O-C 3.57Å; G261-G286 WeakPolarHBondContact O-CA 3.48Å; E262-G286 WeakPolarHBondContact OE1-CA 3.21Å; G286-L288 PolarHBondContact O-N 3.07Å
287	A	90.9	Very high	93.9	Very high	77 Å²	77	63.5 Å²	63.5	64%	0.636	32%	0.319	S	S	*	.			trans	-69.8	129.3	-172.7	0	0	0	0	0	110.2	E262	E262-A287 HydrophobicContact CB-CB 4.22Å; E262-A287 HydrophobicContact CG-CB 3.63Å
288	L	89.9	Confident	93.9	Very high	49 Å²	49	55.7 Å²	55.7	26%	0.257	28%	0.283	S	S	.	.			trans	-107.2	133.4	177.8	-61.5	177.2	0	0	0	109.8	I229 L285 G286 V293 V296	I229-L288 HydrophobicContact CD1-CD1 4.3Å; I229-L288 HydrophobicContact CG1-CD1 4.46Å; I229-L288 HydrophobicContact CG2-CD1 4.48Å; L285-L288 HydrophobicContact CB-CD2 4.21Å; L285-L288 HydrophobicContact CD1-CD1 4.45Å; L285-L288 HydrophobicContact CD1-CD2 4.41Å; G286-L288 PolarHBondContact O-N 3.07Å; L288-V293 HydrophobicContact CB-CG2 4.4Å; L288-V296 HydrophobicContact CD1-CB 4.23Å; L288-V296 HydrophobicContact CD1-CG1 4.28Å; L288-V296 HydrophobicContact CD1-CG2 3.79Å; L288-V296 HydrophobicContact CD2-CG2 4.21Å
289	E	86	Confident	93.9	Very high	108 Å²	108	58 Å²	58	51%	0.505	29%	0.293	S	S	.	.			trans	-71.8	151.5	164	-60.8	-174.2	-178.8	0	0	109.5	K291 D292 V293	E289-K291 HydrophobicContact CB-CG 4.22Å; E289-K291 PolarHBondContact O-N 2.84Å; E289-K291 VanDerWaalsContact O-N 3.15Å; E289-K291 WeakPolarHBondContact OE2-CE 3.28Å; E289-K291 IonicContact OE2-NZ 3.92Å; E289-K291 PolarHBondContact OE2-NZ 3.04Å; E289-D292 PolarHBondContact O-N 2.48Å; E289-V293 PolarHBondContact O-N 2.64Å
290	H	84.7	Confident	94	Very high	62 Å²	62	54.4 Å²	54.4	29%	0.287	28%	0.277	S	S	.	.	H	α-helix	trans	-56.1	-37.1	-175.7	-170.4	65.1	0	0	0	113	M43 F212 D292 V293 E318	M43-H290 HydrophobicContact CE-CB 4.27Å; F212-H290 AromaticContact CE2-CE1 3.92Å; F212-H290 AromaticContact CE2-NE2 3.93Å; F212-H290 AromaticContact CZ-CE1 3.58Å; F212-H290 AromaticContact CZ-NE2 3.87Å; H290-D292 PolarHBondContact O-N 2.7Å; H290-V293 WeakPolarHBondContact O-CB 3.48Å; H290-V293 PolarHBondContact O-N 3.48Å; H290-E318 IonicContact CE1-OE1 2.64Å; H290-E318 PolarHBondContact CE1-OE1 3.48Å
291	K	86.4	Confident	94.2	Very high	150 Å²	150	48.7 Å²	48.7	65%	0.652	25%	0.245	S	C	*	.	H	α-helix	trans	-61.9	-27.9	177.3	73.4	-172.3	-168.3	-151.4	0	113.4	E289	E289-K291 HydrophobicContact CB-CG 4.22Å; E289-K291 PolarHBondContact O-N 2.84Å; E289-K291 VanDerWaalsContact O-N 3.15Å; E289-K291 WeakPolarHBondContact OE2-CE 3.28Å; E289-K291 IonicContact OE2-NZ 3.92Å; E289-K291 PolarHBondContact OE2-NZ 3.04Å
292	D	91.6	Very high	94.3	Very high	71 Å²	71	46.6 Å²	46.6	38%	0.38	24%	0.237	S	C	.	.	H	α-helix	trans	-90.4	-15.1	-176.4	-57	-45	0	0	0	112	E289 H290 R294 G295 V296	E289-D292 PolarHBondContact O-N 2.48Å; H290-D292 PolarHBondContact O-N 2.7Å; D292-R294 PolarHBondContact O-N 2.89Å; D292-G295 PolarHBondContact O-N 3.32Å; D292-G295 VanDerWaalsContact O-N 3.13Å; D292-V296 PolarHBondContact O-N 3.47Å
293	V	94	Very high	94.3	Very high	8 Å²	8	46.6 Å²	46.6	5%	0.048	24%	0.237	C	C	.	.	H	α-helix	trans	-57.3	-45.9	-178.3	174.2	0	0	0	0	111.4	F212 I229 L288 E289 H290 G295 V296 L297	F212-V293 HydrophobicContact CE1-CB 4.2Å; F212-V293 HydrophobicContact CE1-CG1 3.86Å; F212-V293 HydrophobicContact CZ-CG1 4.47Å; I229-V293 HydrophobicContact CD1-CG1 3.78Å; I229-V293 HydrophobicContact CG2-CG1 4.47Å; L288-V293 HydrophobicContact CB-CG2 4.4Å; E289-V293 PolarHBondContact O-N 2.64Å; H290-V293 WeakPolarHBondContact O-CB 3.48Å; H290-V293 PolarHBondContact O-N 3.48Å; V293-G295 VanDerWaalsContact C-N 3.3Å; V293-G295 PolarHBondContact O-N 3.22Å; V293-V296 PolarHBondContact O-N 3.47Å; V293-V296 VanDerWaalsContact O-N 3.16Å; V293-L297 HydrophobicContact CG1-CD1 3.77Å; V293-L297 HydrophobicContact CG1-CG 4.13Å; V293-L297 WeakPolarHBondContact O-CG 3.36Å; V293-L297 PolarHBondContact O-N 3.38Å
294	R	95.7	Very high	94.4	Very high	76 Å²	76	39.7 Å²	39.7	29%	0.287	21%	0.211	S	C	.	.	H	α-helix	trans	-55.5	-46.8	177.2	-177.5	-159.8	175.9	-86.7	4.3	111.1	D211 F212 T213 D292 V296 L297 V298	D211-R294 WeakPolarHBondContact O-CD 3.3Å; D211-R294 WeakPolarHBondContact O-CG 3.42Å; F212-R294 HydrophobicContact CD1-CB 4.16Å; F212-R294 HydrophobicContact CE1-CB 4.32Å; T213-R294 PolarHBondContact O-NE 3.32Å; T213-R294 PolarHBondContact O-NH2 2.75Å; T213-R294 PolarHBondContact OG1-NE 2.98Å; T213-R294 VanDerWaalsContact OG1-NE 3.09Å; T213-R294 PolarHBondContact OG1-NH2 2.84Å; D292-R294 PolarHBondContact O-N 2.89Å; R294-V296 PolarHBondContact O-N 2.94Å; R294-L297 PolarHBondContact O-N 3.17Å; R294-V298 HydrophobicContact CG-CG1 4.32Å; R294-V298 WeakPolarHBondContact O-CG1 3.24Å; R294-V298 WeakPolarHBondContact O-CG2 3.36Å; R294-V298 PolarHBondContact O-N 2.96Å
295	G	95.8	Very high	94.4	Very high	35 Å²	35	38.9 Å²	38.9	36%	0.361	21%	0.207	S	C	.	.	H	α-helix	trans	-59.9	-31.3	-178.2	0	0	0	0	0	113.3	D292 V293 Q299	D292-G295 PolarHBondContact O-N 3.32Å; D292-G295 VanDerWaalsContact O-N 3.13Å; V293-G295 VanDerWaalsContact C-N 3.3Å; V293-G295 PolarHBondContact O-N 3.22Å; G295-Q299 PolarHBondContact O-NE2 3.4Å
296	V	96.9	Very high	94.4	Very high	11 Å²	11	36 Å²	36	7%	0.067	19%	0.192	C	C	.	.	H	α-helix	trans	-79.9	-44.8	174.9	176.5	0	0	0	0	111.4	V227 I229 L258 L285 L288 D292 V293 R294 V298 Q299	V227-V296 HydrophobicContact CG1-CG1 4.06Å; I229-V296 HydrophobicContact CD1-CB 4.15Å; I229-V296 HydrophobicContact CD1-CG1 3.9Å; I229-V296 HydrophobicContact CG1-CG1 4.38Å; L258-V296 HydrophobicContact CD2-CG1 3.59Å; L258-V296 HydrophobicContact CG-CG1 3.93Å; L285-V296 HydrophobicContact CD1-CB 4.25Å; L285-V296 HydrophobicContact CD1-CG1 3.6Å; L285-V296 HydrophobicContact CD1-CG2 3.55Å; L288-V296 HydrophobicContact CD1-CB 4.23Å; L288-V296 HydrophobicContact CD1-CG1 4.28Å; L288-V296 HydrophobicContact CD1-CG2 3.79Å; L288-V296 HydrophobicContact CD2-CG2 4.21Å; D292-V296 PolarHBondContact O-N 3.47Å; V293-V296 PolarHBondContact O-N 3.47Å; V293-V296 VanDerWaalsContact O-N 3.16Å; R294-V296 PolarHBondContact O-N 2.94Å; V296-V298 VanDerWaalsContact C-N 3.35Å; V296-V298 PolarHBondContact O-N 2.82Å; V296-Q299 PolarHBondContact O-N 3.37Å
297	L	97.6	Very high	94.4	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-57.7	-45.8	-179.7	-73.1	173.3	0	0	0	111.7	F212 V227 I229 V293 R294 Q299 G300 F303 E318 C322 L324	F212-L297 HydrophobicContact CD1-CD1 3.96Å; F212-L297 HydrophobicContact CE1-CD1 4.11Å; V227-L297 HydrophobicContact CG1-CD2 3.99Å; I229-L297 HydrophobicContact CD1-CD2 3.67Å; I229-L297 HydrophobicContact CD1-CG 3.76Å; I229-L297 HydrophobicContact CG1-CD2 4.5Å; V293-L297 HydrophobicContact CG1-CD1 3.77Å; V293-L297 HydrophobicContact CG1-CG 4.13Å; V293-L297 WeakPolarHBondContact O-CG 3.36Å; V293-L297 PolarHBondContact O-N 3.38Å; R294-L297 PolarHBondContact O-N 3.17Å; L297-Q299 PolarHBondContact O-N 3.06Å; L297-Q299 VanDerWaalsContact O-N 3.13Å; L297-G300 WeakPolarHBondContact O-CA 3.15Å; L297-G300 PolarHBondContact O-N 3.11Å; L297-F303 HydrophobicContact CD2-CD2 3.7Å; L297-F303 HydrophobicContact CD2-CE2 4.06Å; L297-E318 HydrophobicContact CD1-CB 4.01Å; L297-C322 HydrophobicContact CB-CB 3.93Å; L297-C322 HydrophobicContact CD1-CB 4.41Å; L297-L324 HydrophobicContact CD2-CD2 4.36Å; L297-L324 WeakPolarHBondContact O-CD1 3.33Å; L297-L324 WeakPolarHBondContact O-CD2 3.41Å
298	V	97.1	Very high	94.5	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.018	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-18.3	-174.8	-62.9	0	0	0	0	114.4	D215 Q218 R219 R294 V296 G300 C322	D215-V298 HydrophobicContact CB-CB 4.08Å; D215-V298 HydrophobicContact CB-CG1 4.05Å; D215-V298 HydrophobicContact CB-CG2 4.39Å; Q218-V298 HydrophobicContact CB-CB 4.43Å; Q218-V298 HydrophobicContact CB-CG2 3.91Å; Q218-V298 HydrophobicContact CG-CG2 3.94Å; R219-V298 VanDerWaalsContact CG-O 3.25Å; R219-V298 WeakPolarHBondContact CG-O 3.45Å; R294-V298 HydrophobicContact CG-CG1 4.32Å; R294-V298 WeakPolarHBondContact O-CG1 3.24Å; R294-V298 WeakPolarHBondContact O-CG2 3.36Å; R294-V298 PolarHBondContact O-N 2.96Å; V296-V298 VanDerWaalsContact C-N 3.35Å; V296-V298 PolarHBondContact O-N 2.82Å; V298-G300 PolarHBondContact O-N 2.92Å; V298-C322 HydrophobicContact CG1-CB 4.39Å
299	Q	96.9	Very high	94.4	Very high	63 Å²	63	34.2 Å²	34.2	29%	0.294	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-16.3	172.1	-62.8	172	53.8	0	0	112.4	L258 G295 V296 L297	L258-Q299 HydrophobicContact CD2-CB 4.13Å; G295-Q299 PolarHBondContact O-NE2 3.4Å; V296-Q299 PolarHBondContact O-N 3.37Å; L297-Q299 PolarHBondContact O-N 3.06Å; L297-Q299 VanDerWaalsContact O-N 3.13Å
300	G	96.9	Very high	94.6	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.154	C	C	.	.			trans	-89.1	155.2	-176.6	0	0	0	0	0	115	R219 L297 V298	R219-G300 PolarHBondContact NE-O 3Å; L297-G300 WeakPolarHBondContact O-CA 3.15Å; L297-G300 PolarHBondContact O-N 3.11Å; V298-G300 PolarHBondContact O-N 2.92Å
301	H	97.7	Very high	94.7	Very high	22 Å²	22	27.7 Å²	27.7	10%	0.102	14%	0.142	C	C	.	.	S	Bend	trans	-100.8	-37.5	167.1	-64.3	80.2	0	0	0	111.1	R223 I224 T225 Q325 Q364	R223-H301 PolarHBondContact O-CE1 2.82Å; R223-H301 VanDerWaalsContact O-CE1 3.22Å; I224-H301 HydrophobicContact CG2-CB 4.15Å; T225-H301 PolarHBondContact N-ND1 2.95Å; T225-H301 PolarHBondContact O-N 2.96Å; H301-Q325 PolarHBondContact O-N 3.05Å; H301-Q364 HydrophobicContact CB-CG 4.46Å
302	I	98.3	Very high	94.8	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130.6	-174.1	-56.3	172	0	0	0	108.2	I224 T225 I226 V227 Q325 V327 L357 V360 I361	I224-I302 HydrophobicContact CG2-CD1 4.17Å; T225-I302 PolarHBondContact O-N 3.42Å; I226-I302 CarbonylContact C-O 3.58Å; I226-I302 WeakPolarHBondContact CA-O 3.49Å; I226-I302 HydrophobicContact CG1-CB 4.16Å; I226-I302 HydrophobicContact CG1-CD1 4.32Å; V227-I302 PolarHBondContact N-O 3.37Å; I302-Q325 CarbonylContact C-O 3.33Å; I302-Q325 VanDerWaalsContact CA-O 3.28Å; I302-Q325 WeakPolarHBondContact CA-O 3.24Å; I302-Q325 HydrophobicContact CG1-CB 4.39Å; I302-V327 HydrophobicContact CG2-CB 4.5Å; I302-V327 HydrophobicContact CG2-CG2 3.98Å; I302-L357 HydrophobicContact CG2-CD2 3.95Å; I302-V360 HydrophobicContact CD1-CB 4.36Å; I302-V360 HydrophobicContact CD1-CG1 3.75Å; I302-V360 HydrophobicContact CG1-CG1 3.84Å; I302-V360 HydrophobicContact CG2-CG1 4.42Å; I302-I361 HydrophobicContact CD1-CG1 3.67Å
303	F	98.6	Very high	94.7	Very high	3 Å²	3	17.9 Å²	17.9	1%	0.013	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	126.9	167.6	-179.5	-98.4	0	0	0	108.9	V227 I229 L297 N305 A315 I316 L324 Q325 V326 V327	V227-F303 WeakPolarHBondContact O-CA 3.3Å; I229-F303 HydrophobicContact CB-CE2 4.36Å; L297-F303 HydrophobicContact CD2-CD2 3.7Å; L297-F303 HydrophobicContact CD2-CE2 4.06Å; F303-N305 HydrophobicContact CE1-CB 4.04Å; F303-A315 HydrophobicContact CE1-CB 4.45Å; F303-A315 HydrophobicContact CE2-CB 4.45Å; F303-A315 HydrophobicContact CZ-CB 3.71Å; F303-A315 WeakPolarHBondContact CZ-O 3.47Å; F303-I316 HydrophobicContact CD1-CG1 4.49Å; F303-I316 HydrophobicContact CE1-CG1 3.95Å; F303-L324 HydrophobicContact CB-CB 4.1Å; F303-L324 HydrophobicContact CB-CD2 3.92Å; F303-Q325 PolarHBondContact N-O 2.87Å; F303-V326 HydrophobicContact CD1-CG1 4.33Å; F303-V327 PolarHBondContact O-N 2.97Å
304	L	98.6	Very high	94.6	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	125.4	-179.3	173.3	65.2	0	0	0	110.9	I226 V227 V228 L241 F257 T306 V327 L353 L357	I226-L304 HydrophobicContact CG2-CB 3.56Å; I226-L304 HydrophobicContact CG2-CD2 4.06Å; I226-L304 HydrophobicContact CG2-CG 4.48Å; V227-L304 PolarHBondContact O-N 2.7Å; V228-L304 HydrophobicContact CG2-CB 3.94Å; V228-L304 HydrophobicContact CG2-CD2 4.15Å; V228-L304 HydrophobicContact CG2-CG 4.25Å; L241-L304 HydrophobicContact CD1-CD2 3.88Å; F257-L304 HydrophobicContact CE1-CD2 4.44Å; L304-T306 HydrophobicContact CD1-CG2 3.97Å; L304-T306 HydrophobicContact CD2-CG2 4.11Å; L304-T306 HydrophobicContact CG-CG2 3.92Å; L304-V327 WeakPolarHBondContact CA-O 3.21Å; L304-V327 HydrophobicContact CD1-CB 4.2Å; L304-V327 HydrophobicContact CD1-CG1 4.06Å; L304-L353 HydrophobicContact CD1-CD2 4.3Å; L304-L357 HydrophobicContact CD1-CD1 4.07Å; L304-L357 HydrophobicContact CD1-CD2 4.27Å; L304-L357 HydrophobicContact CD1-CG 4.39Å; L304-L357 HydrophobicContact CD2-CD1 3.87Å
305	N	97.9	Very high	94.4	Very high	7 Å²	7	16 Å²	16	4%	0.037	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	120.4	170.2	172.3	56.9	0	0	0	110.9	F303 S307 I316 V327 S328 T329 I334	F303-N305 HydrophobicContact CE1-CB 4.04Å; N305-S307 WeakPolarHBondContact OD1-CB 3.37Å; N305-S307 PolarHBondContact OD1-N 2.86Å; N305-S307 PolarHBondContact OD1-OG 3.33Å; N305-I316 HydrophobicContact CB-CD1 4.42Å; N305-I316 HydrophobicContact CB-CG1 4.3Å; N305-V327 PolarHBondContact N-O 3.22Å; N305-S328 PolarHBondContact ND2-OG 3.24Å; N305-S328 VanDerWaalsContact O-CA 3.29Å; N305-S328 WeakPolarHBondContact O-CA 3.39Å; N305-T329 PolarHBondContact O-N 3.45Å; N305-T329 VanDerWaalsContact O-N 3.14Å; N305-I334 WeakPolarHBondContact ND2-CD1 3.33Å
306	T	96.9	Very high	94.4	Very high	2 Å²	2	14.3 Å²	14.3	1%	0.012	8%	0.078	C	C	.	.			trans	-107	18	-177.8	56.3	0	0	0	0	113.3	K236 G237 L241 I244 L304 L353	K236-T306 CarbonylContact O-C 3.22Å; K236-T306 PolarHBondContact O-OG1 3.27Å; K236-T306 VanDerWaalsContact O-OG1 3.08Å; G237-T306 VanDerWaalsContact CA-O 3.32Å; G237-T306 WeakPolarHBondContact CA-O 3.46Å; G237-T306 PolarHBondContact O-OG1 3.32Å; L241-T306 HydrophobicContact CB-CG2 4.47Å; I244-T306 HydrophobicContact CD1-CG2 3.92Å; L304-T306 HydrophobicContact CD1-CG2 3.97Å; L304-T306 HydrophobicContact CD2-CG2 4.11Å; L304-T306 HydrophobicContact CG-CG2 3.92Å; T306-L353 HydrophobicContact CG2-CD1 4.04Å
307	S	94.4	Very high	94.3	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.075	C	C	.	.			trans	-57.1	144.4	-173.6	-64.1	0	0	0	0	113.1	K236 N305 T329 V331	K236-S307 VanDerWaalsContact CD-OG 3.28Å; K236-S307 WeakPolarHBondContact CD-OG 3.42Å; K236-S307 PolarHBondContact O-N 2.83Å; N305-S307 WeakPolarHBondContact OD1-CB 3.37Å; N305-S307 PolarHBondContact OD1-N 2.86Å; N305-S307 PolarHBondContact OD1-OG 3.33Å; S307-T329 WeakPolarHBondContact O-CB 3.44Å; S307-T329 PolarHBondContact O-OG1 3.1Å; S307-V331 VanDerWaalsContact O-CG2 3.25Å; S307-V331 WeakPolarHBondContact O-CG2 3.24Å
308	L	92.1	Very high	94.2	Very high	57 Å²	57	14.5 Å²	14.5	30%	0.298	8%	0.078	S	C	.	.	S	Bend	trans	-89.5	-21.4	177	-60.6	178.3	0	0	0	112.2	Y234 R235 L240 P348	Y234-L308 HydrophobicContact CD1-CD1 4.4Å; Y234-L308 HydrophobicContact CE1-CD1 3.93Å; Y234-L308 HydrophobicContact CE2-CD1 4.33Å; R235-L308 PolarHBondContact O-N 2.79Å; L240-L308 HydrophobicContact CD1-CD2 3.7Å; L240-L308 HydrophobicContact CG-CD2 4.44Å; L308-P348 HydrophobicContact CD2-CB 4.12Å
309	T	89.1	Confident	94.2	Very high	38 Å²	38	14.3 Å²	14.3	23%	0.233	8%	0.077	C	C	.	.			trans	-153.8	134.8	175.8	173.2	0	0	0	0	109.3	L153 R235	L153-T309 PolarHBondContact O-OG1 2.93Å; R235-T309 HydrophobicContact CB-CG2 4.23Å; R235-T309 HydrophobicContact CG-CG2 4.19Å
310	E	89.3	Confident	94.2	Very high	27 Å²	27	11.4 Å²	11.4	13%	0.126	6%	0.063	C	C	.	.			trans	-150.2	137.4	179.4	-90.8	-59.9	153.7	0	0	111.2	L153 K236 C313 G332 G333 I334	L153-E310 WeakPolarHBondContact CD2-O 3.46Å; K236-E310 IonicContact NZ-OE1 2.75Å; K236-E310 PolarHBondContact NZ-OE1 3.47Å; E310-C313 HydrophobicContact CB-CB 4.34Å; E310-C313 HydrophobicContact CG-CB 3.85Å; E310-C313 WeakPolarHBondContact OE2-CA 3.32Å; E310-C313 PolarHBondContact OE2-N 3.39Å; E310-G332 CarbonylContact O-C 3.59Å; E310-G332 VanDerWaalsContact O-CA 3.31Å; E310-G332 WeakPolarHBondContact O-CA 3.29Å; E310-G333 PolarHBondContact O-N 3.14Å; E310-I334 HydrophobicContact CB-CD1 3.73Å; E310-I334 HydrophobicContact CB-CG1 3.64Å; E310-I334 HydrophobicContact CG-CD1 3.99Å; E310-I334 HydrophobicContact CG-CG1 4.28Å
311	A	86.9	Confident	94.1	Very high	6 Å²	6	11.4 Å²	11.4	5%	0.05	6%	0.063	C	C	.	.	S	Bend	trans	-83.4	-36	174.1	0	0	0	0	0	111.8	L153 V181 S182	L153-A311 HydrophobicContact CB-CB 4.14Å; V181-A311 HydrophobicContact CG2-CB 3.5Å; V181-A311 VanDerWaalsContact CG2-CB 3.5Å; S182-A311 WeakPolarHBondContact CB-O 3.28Å; S182-A311 PolarHBondContact OG-O 2.88Å
312	F	88.5	Confident	94	Very high	4 Å²	4	10.3 Å²	10.3	2%	0.018	6%	0.059	C	C	.	.			trans	-157.8	-29.2	179.7	-175.6	-94.8	0	0	0	113.8	V181 P204 N205 M314 V317 V337 Y383	V181-F312 HydrophobicContact CB-CB 4.19Å; V181-F312 HydrophobicContact CG2-CB 3.92Å; V181-F312 WeakPolarHBondContact O-CD2 3.41Å; P204-F312 HydrophobicContact CB-CD2 4.08Å; P204-F312 HydrophobicContact CB-CE2 3.51Å; P204-F312 HydrophobicContact CB-CZ 3.99Å; N205-F312 HydrophobicContact CB-CD1 3.64Å; N205-F312 HydrophobicContact CB-CE1 3.85Å; N205-F312 HydrophobicContact CB-CG 4.31Å; N205-F312 WeakPolarHBondContact O-CZ 3.09Å; F312-M314 HydrophobicContact CD1-CG 4.34Å; F312-V317 HydrophobicContact CE1-CG2 3.87Å; F312-V317 HydrophobicContact CZ-CG2 4.11Å; F312-V337 HydrophobicContact CD2-CG2 3.96Å; F312-V337 HydrophobicContact CE1-CG1 4.36Å; F312-V337 HydrophobicContact CE2-CG1 4.34Å; F312-V337 HydrophobicContact CE2-CG2 4.16Å; F312-V337 HydrophobicContact CG-CG2 4.29Å; F312-V337 HydrophobicContact CZ-CG1 4.15Å; F312-V337 WeakPolarHBondContact O-CG2 3.31Å; F312-Y383 HydrophobicContact CE2-CD1 4.12Å; F312-Y383 AromaticContact CE2-CE1 3.68Å; F312-Y383 HydrophobicContact CE2-CE1 3.68Å; F312-Y383 AromaticContact CZ-CD1 3.62Å; F312-Y383 HydrophobicContact CZ-CD1 3.62Å; F312-Y383 HydrophobicContact CZ-CD2 4.22Å; F312-Y383 AromaticContact CZ-CE1 3.58Å; F312-Y383 HydrophobicContact CZ-CE1 3.58Å; F312-Y383 HydrophobicContact CZ-CE2 4.22Å; F312-Y383 AromaticContact CZ-CG 3.95Å; F312-Y383 HydrophobicContact CZ-CG 3.95Å; F312-Y383 AromaticContact CZ-CZ 3.91Å
313	C	89.5	Confident	93.9	Very high	11 Å²	11	10.4 Å²	10.4	7%	0.074	6%	0.059	C	C	.	.			trans	51.2	83.5	-178.9	-161.7	0	0	0	0	115.9	E310 A315 I316	E310-C313 HydrophobicContact CB-CB 4.34Å; E310-C313 HydrophobicContact CG-CB 3.85Å; E310-C313 WeakPolarHBondContact OE2-CA 3.32Å; E310-C313 PolarHBondContact OE2-N 3.39Å; C313-A315 PolarHBondContact O-N 2.89Å; C313-A315 VanDerWaalsContact O-N 3.16Å; C313-I316 HydrophobicContact CB-CD1 3.96Å; C313-I316 HydrophobicContact CB-CG1 4.25Å; C313-I316 WeakPolarHBondContact O-CB 3.22Å; C313-I316 PolarHBondContact O-N 3.49Å; C313-I316 VanDerWaalsContact O-N 3.15Å
314	M	91.5	Very high	93.9	Very high	25 Å²	25	10.3 Å²	10.3	12%	0.123	6%	0.059	C	C	.	.	H	α-helix	trans	-57.7	-31.6	177.8	-60.3	-175.2	-41.9	0	0	113.6	N205 V207 F312 I316 V317 E318	N205-M314 HydrophobicContact CB-CG 3.89Å; N205-M314 HydrophobicContact CB-SD 4Å; V207-M314 HydrophobicContact CG1-CB 4.21Å; F312-M314 HydrophobicContact CD1-CG 4.34Å; M314-I316 PolarHBondContact O-N 3.11Å; M314-V317 WeakPolarHBondContact O-CA 3.31Å; M314-V317 WeakPolarHBondContact O-CB 3.46Å; M314-V317 PolarHBondContact O-N 2.84Å; M314-E318 WeakPolarHBondContact O-CG 3.37Å; M314-E318 PolarHBondContact O-N 2.94Å
315	A	92.8	Very high	93.8	Very high	19 Å²	19	11.4 Å²	11.4	16%	0.157	6%	0.064	C	C	.	.	H	α-helix	trans	-60.1	-27.8	-179.9	0	0	0	0	0	113.5	F303 C313 G319	F303-A315 HydrophobicContact CE1-CB 4.45Å; F303-A315 HydrophobicContact CE2-CB 4.45Å; F303-A315 HydrophobicContact CZ-CB 3.71Å; F303-A315 WeakPolarHBondContact CZ-O 3.47Å; C313-A315 PolarHBondContact O-N 2.89Å; C313-A315 VanDerWaalsContact O-N 3.16Å; A315-G319 PolarHBondContact O-N 2.94Å
316	I	95.5	Very high	93.8	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-64.1	-44.7	172	-74.5	174.5	0	0	0	110.4	F303 N305 C313 M314 G319 A320 V326 I334 V337 L338 I343	F303-I316 HydrophobicContact CD1-CG1 4.49Å; F303-I316 HydrophobicContact CE1-CG1 3.95Å; N305-I316 HydrophobicContact CB-CD1 4.42Å; N305-I316 HydrophobicContact CB-CG1 4.3Å; C313-I316 HydrophobicContact CB-CD1 3.96Å; C313-I316 HydrophobicContact CB-CG1 4.25Å; C313-I316 WeakPolarHBondContact O-CB 3.22Å; C313-I316 PolarHBondContact O-N 3.49Å; C313-I316 VanDerWaalsContact O-N 3.15Å; M314-I316 PolarHBondContact O-N 3.11Å; I316-G319 PolarHBondContact O-N 3.2Å; I316-A320 WeakPolarHBondContact O-CB 3.42Å; I316-A320 PolarHBondContact O-N 3.38Å; I316-V326 HydrophobicContact CG1-CG1 4.36Å; I316-V326 HydrophobicContact CG2-CG1 3.99Å; I316-I334 HydrophobicContact CD1-CD1 4.45Å; I316-I334 HydrophobicContact CD1-CG1 4.21Å; I316-I334 HydrophobicContact CD1-CG2 3.74Å; I316-V337 HydrophobicContact CB-CG1 4.23Å; I316-V337 HydrophobicContact CG2-CG1 3.82Å; I316-L338 HydrophobicContact CG2-CD1 3.39Å; I316-L338 HydrophobicContact CG2-CG 3.88Å; I316-I343 HydrophobicContact CD1-CD1 4.37Å; I316-I343 HydrophobicContact CG2-CD1 4.2Å
317	V	95	Very high	93.9	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-70.2	-38.8	179.3	-165.5	0	0	0	0	110.5	V207 F312 M314 S321 V337 V379 Y383	V207-V317 HydrophobicContact CB-CG1 4.48Å; V207-V317 HydrophobicContact CG1-CB 3.96Å; V207-V317 HydrophobicContact CG1-CG1 4.21Å; V207-V317 HydrophobicContact CG2-CB 4.1Å; V207-V317 HydrophobicContact CG2-CG1 3.44Å; V207-V317 VanDerWaalsContact CG2-CG1 3.44Å; F312-V317 HydrophobicContact CE1-CG2 3.87Å; F312-V317 HydrophobicContact CZ-CG2 4.11Å; M314-V317 WeakPolarHBondContact O-CA 3.31Å; M314-V317 WeakPolarHBondContact O-CB 3.46Å; M314-V317 PolarHBondContact O-N 2.84Å; V317-S321 VanDerWaalsContact O-CB 3.22Å; V317-S321 WeakPolarHBondContact O-CB 3.35Å; V317-S321 PolarHBondContact O-N 2.83Å; V317-S321 PolarHBondContact O-OG 3.44Å; V317-V337 HydrophobicContact CG2-CG1 3.43Å; V317-V337 VanDerWaalsContact CG2-CG1 3.43Å; V317-V379 HydrophobicContact CG1-CG1 3.69Å; V317-Y383 HydrophobicContact CG1-CD2 3.9Å; V317-Y383 HydrophobicContact CG2-CD2 4.18Å; V317-Y383 HydrophobicContact CG2-CE2 4.48Å
318	E	95.3	Very high	94.1	Very high	16 Å²	16	11.1 Å²	11.1	8%	0.075	6%	0.063	C	C	.	.	H	α-helix	trans	-59.7	-49.4	173.3	-64.2	169.6	179.5	0	0	111.1	V207 F212 H290 L297 M314 S321 C322	V207-E318 HydrophobicContact CG1-CG 3.9Å; F212-E318 HydrophobicContact CD1-CB 3.99Å; F212-E318 HydrophobicContact CD1-CG 4.34Å; F212-E318 HydrophobicContact CD2-CB 4.42Å; F212-E318 HydrophobicContact CD2-CG 4.06Å; F212-E318 HydrophobicContact CE1-CB 3.96Å; F212-E318 HydrophobicContact CE1-CG 4.02Å; F212-E318 HydrophobicContact CE2-CB 4.41Å; F212-E318 HydrophobicContact CE2-CG 3.73Å; F212-E318 HydrophobicContact CG-CB 4.23Å; F212-E318 HydrophobicContact CG-CG 4.37Å; F212-E318 HydrophobicContact CZ-CB 4.18Å; F212-E318 HydrophobicContact CZ-CG 3.7Å; H290-E318 IonicContact CE1-OE1 2.64Å; H290-E318 PolarHBondContact CE1-OE1 3.48Å; L297-E318 HydrophobicContact CD1-CB 4.01Å; M314-E318 WeakPolarHBondContact O-CG 3.37Å; M314-E318 PolarHBondContact O-N 2.94Å; E318-S321 PolarHBondContact O-N 3.03Å; E318-C322 PolarHBondContact O-N 3.17Å
319	G	96.1	Very high	94.3	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-62	-44.9	178	0	0	0	0	0	113	A315 I316 S321 C322 G323 L324	A315-G319 PolarHBondContact O-N 2.94Å; I316-G319 PolarHBondContact O-N 3.2Å; G319-S321 VanDerWaalsContact C-N 3.34Å; G319-C322 PolarHBondContact O-N 3.35Å; G319-G323 PolarHBondContact O-N 2.76Å; G319-L324 WeakPolarHBondContact O-CB 3.41Å; G319-L324 PolarHBondContact O-N 2.75Å; G319-L324 VanDerWaalsContact O-N 3.16Å
320	A	96.3	Very high	94.7	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.008	6%	0.058	C	C	.	.	H	α-helix	trans	-66.5	-36.1	175.5	0	0	0	0	0	112.1	I316 C322 G323 V326 L338 I375 V379	I316-A320 WeakPolarHBondContact O-CB 3.42Å; I316-A320 PolarHBondContact O-N 3.38Å; A320-C322 VanDerWaalsContact C-N 3.3Å; A320-C322 PolarHBondContact O-N 2.9Å; A320-G323 WeakPolarHBondContact O-CA 3.18Å; A320-G323 PolarHBondContact O-N 2.7Å; A320-V326 HydrophobicContact CB-CG2 3.91Å; A320-L338 HydrophobicContact CB-CD1 3.73Å; A320-L338 HydrophobicContact CB-CD2 4.14Å; A320-I375 HydrophobicContact CB-CG2 4.4Å; A320-I375 VanDerWaalsContact O-CG2 3.22Å; A320-I375 WeakPolarHBondContact O-CG2 3.21Å; A320-V379 HydrophobicContact CB-CG1 4.46Å; A320-V379 HydrophobicContact CB-CG2 3.95Å
321	S	95.8	Very high	94.8	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-63.7	-36.2	175	-61	0	0	0	0	111.6	F212 V317 E318 G319 G323 H376 V379	F212-S321 CarbonylContact O-C 3.59Å; F212-S321 WeakPolarHBondContact O-CB 3.41Å; F212-S321 VanDerWaalsContact O-O 3.04Å; V317-S321 VanDerWaalsContact O-CB 3.22Å; V317-S321 WeakPolarHBondContact O-CB 3.35Å; V317-S321 PolarHBondContact O-N 2.83Å; V317-S321 PolarHBondContact O-OG 3.44Å; E318-S321 PolarHBondContact O-N 3.03Å; G319-S321 VanDerWaalsContact C-N 3.34Å; S321-G323 PolarHBondContact O-N 3.05Å; S321-H376 WeakPolarHBondContact O-CB 3.4Å; S321-H376 PolarHBondContact O-ND1 3.05Å; S321-V379 WeakPolarHBondContact OG-CG1 3.44Å
322	C	96.6	Very high	95	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	2.7	169.9	-71.8	0	0	0	0	114.1	P214 L297 V298 E318 G319 A320 L324	P214-C322 WeakPolarHBondContact CA-O 3.3Å; P214-C322 WeakPolarHBondContact CB-O 3.5Å; L297-C322 HydrophobicContact CB-CB 3.93Å; L297-C322 HydrophobicContact CD1-CB 4.41Å; V298-C322 HydrophobicContact CG1-CB 4.39Å; E318-C322 PolarHBondContact O-N 3.17Å; G319-C322 PolarHBondContact O-N 3.35Å; A320-C322 VanDerWaalsContact C-N 3.3Å; A320-C322 PolarHBondContact O-N 2.9Å; C322-L324 HydrophobicContact CB-CD1 3.65Å; C322-L324 WeakPolarHBondContact O-CD1 3.09Å
323	G	95.6	Very high	95.2	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.01	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	75	30	175.2	0	0	0	0	0	114.6	R219 G319 A320 S321	R219-G323 PolarHBondContact NH2-O 3.34Å; G319-G323 PolarHBondContact O-N 2.76Å; A320-G323 WeakPolarHBondContact O-CA 3.18Å; A320-G323 PolarHBondContact O-N 2.7Å; S321-G323 PolarHBondContact O-N 3.05Å
324	L	97.4	Very high	95.4	Very high	1 Å²	1	12 Å²	12	1%	0.005	6%	0.063	C	C	.	.	P	Polyproline II helix	trans	-88	150.2	173.4	-75.6	66.1	0	0	0	110	V227 L297 F303 G319 C322	V227-L324 HydrophobicContact CB-CD2 4.26Å; V227-L324 HydrophobicContact CG2-CD2 4.36Å; L297-L324 HydrophobicContact CD2-CD2 4.36Å; L297-L324 WeakPolarHBondContact O-CD1 3.33Å; L297-L324 WeakPolarHBondContact O-CD2 3.41Å; F303-L324 HydrophobicContact CB-CB 4.1Å; F303-L324 HydrophobicContact CB-CD2 3.92Å; G319-L324 WeakPolarHBondContact O-CB 3.41Å; G319-L324 PolarHBondContact O-N 2.75Å; G319-L324 VanDerWaalsContact O-N 3.16Å; C322-L324 HydrophobicContact CB-CD1 3.65Å; C322-L324 WeakPolarHBondContact O-CD1 3.09Å
325	Q	97.6	Very high	95.6	Very high	25 Å²	25	13.2 Å²	13.2	12%	0.117	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	132	165.8	-58.4	-56.7	-58	0	0	109	H301 I302 F303 V360 V369	H301-Q325 PolarHBondContact O-N 3.05Å; I302-Q325 CarbonylContact C-O 3.33Å; I302-Q325 VanDerWaalsContact CA-O 3.28Å; I302-Q325 WeakPolarHBondContact CA-O 3.24Å; I302-Q325 HydrophobicContact CG1-CB 4.39Å; F303-Q325 PolarHBondContact N-O 2.87Å; Q325-V360 HydrophobicContact CB-CG1 3.53Å; Q325-V360 HydrophobicContact CG-CG1 3.94Å; Q325-V369 HydrophobicContact CG-CB 4.34Å; Q325-V369 HydrophobicContact CG-CG1 3.91Å
326	V	98.2	Very high	95.6	Very high	3 Å²	3	15.1 Å²	15.1	2%	0.018	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.4	-179.5	-177.8	0	0	0	0	110.7	F303 I316 A320 L338 I343 T344	F303-V326 HydrophobicContact CD1-CG1 4.33Å; I316-V326 HydrophobicContact CG1-CG1 4.36Å; I316-V326 HydrophobicContact CG2-CG1 3.99Å; A320-V326 HydrophobicContact CB-CG2 3.91Å; V326-L338 HydrophobicContact CB-CD1 4.28Å; V326-L338 HydrophobicContact CG2-CD1 3.87Å; V326-I343 HydrophobicContact CB-CB 4.4Å; V326-I343 HydrophobicContact CB-CG1 4.14Å; V326-I343 HydrophobicContact CG1-CB 4.48Å; V326-I343 HydrophobicContact CG1-CD1 3.75Å; V326-I343 HydrophobicContact CG1-CG1 3.74Å; V326-T344 PolarHBondContact O-N 2.89Å
327	V	98.4	Very high	95.6	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	127.1	164.5	-179.2	0	0	0	0	108.3	I302 F303 L304 N305 T344 L357 V360	I302-V327 HydrophobicContact CG2-CB 4.5Å; I302-V327 HydrophobicContact CG2-CG2 3.98Å; F303-V327 PolarHBondContact O-N 2.97Å; L304-V327 WeakPolarHBondContact CA-O 3.21Å; L304-V327 HydrophobicContact CD1-CB 4.2Å; L304-V327 HydrophobicContact CD1-CG1 4.06Å; N305-V327 PolarHBondContact N-O 3.22Å; V327-T344 WeakPolarHBondContact CA-O 3.22Å; V327-L357 HydrophobicContact CB-CD2 4.06Å; V327-L357 HydrophobicContact CB-CG 4.5Å; V327-L357 HydrophobicContact CG1-CD2 4.24Å; V327-L357 HydrophobicContact CG1-CG 4.12Å; V327-L357 HydrophobicContact CG2-CD2 3.96Å; V327-V360 HydrophobicContact CG2-CB 4.06Å; V327-V360 HydrophobicContact CG2-CG1 4.41Å; V327-V360 HydrophobicContact CG2-CG2 3.61Å
328	S	98.2	Very high	95.5	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	156.8	-177.7	-172.5	0	0	0	0	112.3	N305 T344 L345 C346	N305-S328 PolarHBondContact ND2-OG 3.24Å; N305-S328 VanDerWaalsContact O-CA 3.29Å; N305-S328 WeakPolarHBondContact O-CA 3.39Å; S328-T344 PolarHBondContact N-O 3.43Å; S328-L345 CarbonylContact O-C 3.59Å; S328-L345 WeakPolarHBondContact O-CA 3.41Å; S328-C346 PolarHBondContact O-N 2.86Å
329	T	97.5	Very high	95.4	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	144.9	164.3	49.2	0	0	0	0	111.9	N305 S307 V331 I334 C346 P348 L353	N305-T329 PolarHBondContact O-N 3.45Å; N305-T329 VanDerWaalsContact O-N 3.14Å; S307-T329 WeakPolarHBondContact O-CB 3.44Å; S307-T329 PolarHBondContact O-OG1 3.1Å; T329-V331 VanDerWaalsContact C-N 3.32Å; T329-V331 PolarHBondContact O-N 2.87Å; T329-I334 WeakPolarHBondContact O-CD1 3.4Å; T329-I334 WeakPolarHBondContact O-CG2 3.23Å; T329-C346 CarbonylContact C-O 3.58Å; T329-C346 VanDerWaalsContact CA-O 3.25Å; T329-C346 WeakPolarHBondContact CA-O 3.42Å; T329-P348 HydrophobicContact CG2-CB 4.02Å; T329-L353 HydrophobicContact CG2-CD1 3.91Å; T329-L353 HydrophobicContact CG2-CD2 3.99Å; T329-L353 HydrophobicContact CG2-CG 4.37Å
330	R	96.1	Very high	95.2	Very high	118 Å²	118	25.1 Å²	25.1	45%	0.445	13%	0.129	S	C	.	.			trans	-87.2	67.9	174.3	-171.1	-172	-69.4	-81.6	-1.3	109.7	P335 L345 C346	R330-P335 HydrophobicContact CG-CG 3.91Å; R330-L345 HydrophobicContact CB-CB 4.18Å; R330-L345 HydrophobicContact CG-CB 4.49Å; R330-C346 PolarHBondContact N-O 3.44Å
331	V	92.9	Very high	95	Very high	19 Å²	19	29.8 Å²	29.8	12%	0.115	15%	0.154	C	C	.	.			trans	-127.2	147.2	-179.8	-60.8	0	0	0	0	111.4	S307 T329 G333 I334 P348	S307-V331 VanDerWaalsContact O-CG2 3.25Å; S307-V331 WeakPolarHBondContact O-CG2 3.24Å; T329-V331 VanDerWaalsContact C-N 3.32Å; T329-V331 PolarHBondContact O-N 2.87Å; V331-G333 PolarHBondContact O-N 3Å; V331-I334 HydrophobicContact CG2-CD1 3.7Å; V331-I334 WeakPolarHBondContact O-CB 3.12Å; V331-I334 WeakPolarHBondContact O-CG1 3.38Å; V331-I334 PolarHBondContact O-N 2.83Å; V331-P348 HydrophobicContact CG1-CB 4.21Å; V331-P348 HydrophobicContact CG1-CG 4.09Å
332	G	90.6	Very high	95	Very high	24 Å²	24	30.2 Å²	30.2	25%	0.247	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	-135.9	176.8	0	0	0	0	0	112.9	T184 E310 I334 P335	T184-G332 PolarHBondContact OG1-O 3.36Å; E310-G332 CarbonylContact O-C 3.59Å; E310-G332 VanDerWaalsContact O-CA 3.31Å; E310-G332 WeakPolarHBondContact O-CA 3.29Å; G332-I334 VanDerWaalsContact C-N 3.29Å; G332-I334 PolarHBondContact O-N 2.85Å; G332-P335 VanDerWaalsContact O-CD 3.3Å; G332-P335 WeakPolarHBondContact O-CD 3.02Å
333	G	92.4	Very high	95	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	1.4	-178.3	0	0	0	0	0	115.4	E310 V331 P335 E336 V337	E310-G333 PolarHBondContact O-N 3.14Å; V331-G333 PolarHBondContact O-N 3Å; G333-P335 VanDerWaalsContact C-CD 3.41Å; G333-E336 WeakPolarHBondContact O-CB 3.39Å; G333-E336 PolarHBondContact O-N 2.87Å; G333-E336 VanDerWaalsContact O-N 3.08Å; G333-V337 WeakPolarHBondContact O-CG2 3.26Å
334	I	94.7	Very high	95.1	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-54.6	-41.9	-177.7	-66.5	172.7	0	0	0	113.6	N305 E310 I316 T329 V331 G332 E336 V337 I343 L345	N305-I334 WeakPolarHBondContact ND2-CD1 3.33Å; E310-I334 HydrophobicContact CB-CD1 3.73Å; E310-I334 HydrophobicContact CB-CG1 3.64Å; E310-I334 HydrophobicContact CG-CD1 3.99Å; E310-I334 HydrophobicContact CG-CG1 4.28Å; I316-I334 HydrophobicContact CD1-CD1 4.45Å; I316-I334 HydrophobicContact CD1-CG1 4.21Å; I316-I334 HydrophobicContact CD1-CG2 3.74Å; T329-I334 WeakPolarHBondContact O-CD1 3.4Å; T329-I334 WeakPolarHBondContact O-CG2 3.23Å; V331-I334 HydrophobicContact CG2-CD1 3.7Å; V331-I334 WeakPolarHBondContact O-CB 3.12Å; V331-I334 WeakPolarHBondContact O-CG1 3.38Å; V331-I334 PolarHBondContact O-N 2.83Å; G332-I334 VanDerWaalsContact C-N 3.29Å; G332-I334 PolarHBondContact O-N 2.85Å; I334-E336 PolarHBondContact O-N 2.88Å; I334-V337 WeakPolarHBondContact O-CB 3.46Å; I334-V337 WeakPolarHBondContact O-CG2 3.22Å; I334-V337 PolarHBondContact O-N 3.34Å; I334-V337 VanDerWaalsContact O-N 3.08Å; I334-I343 HydrophobicContact CG2-CD1 4.04Å; I334-L345 HydrophobicContact CG2-CD2 3.7Å
335	P	94.9	Very high	95.1	Very high	51 Å²	51	33.7 Å²	33.7	33%	0.331	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-60.4	-17.4	-179.9	-25.2	36.9	0	0	0	114.3	R330 G332 G333 L345	R330-P335 HydrophobicContact CG-CG 3.91Å; G332-P335 VanDerWaalsContact O-CD 3.3Å; G332-P335 WeakPolarHBondContact O-CD 3.02Å; G333-P335 VanDerWaalsContact C-CD 3.41Å; P335-L345 HydrophobicContact CB-CD1 3.95Å; P335-L345 HydrophobicContact CG-CD1 4.24Å
336	E	93.6	Very high	95.2	Very high	59 Å²	59	32.8 Å²	32.8	28%	0.276	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-93	-6.7	-178.5	-52.5	172.7	-140	0	0	113.1	S182 Y183 T184 G333 I334 Y383	S182-E336 WeakPolarHBondContact CB-OE2 3.33Å; Y183-E336 WeakPolarHBondContact CB-OE2 3.36Å; Y183-E336 WeakPolarHBondContact CD2-OE2 3.34Å; Y183-E336 PolarHBondContact N-OE1 3Å; Y183-E336 PolarHBondContact N-OE2 3.31Å; T184-E336 WeakPolarHBondContact CB-OE1 3.38Å; T184-E336 PolarHBondContact N-OE1 3.43Å; T184-E336 PolarHBondContact OG1-OE1 3.16Å; G333-E336 WeakPolarHBondContact O-CB 3.39Å; G333-E336 PolarHBondContact O-N 2.87Å; G333-E336 VanDerWaalsContact O-N 3.08Å; I334-E336 PolarHBondContact O-N 2.88Å; E336-Y383 PolarHBondContact O-OH 3.35Å
337	V	93.6	Very high	95.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-31.9	-168	-178.1	0	0	0	0	112.7	F312 I316 V317 G333 I334 Y383	F312-V337 HydrophobicContact CD2-CG2 3.96Å; F312-V337 HydrophobicContact CE1-CG1 4.36Å; F312-V337 HydrophobicContact CE2-CG1 4.34Å; F312-V337 HydrophobicContact CE2-CG2 4.16Å; F312-V337 HydrophobicContact CG-CG2 4.29Å; F312-V337 HydrophobicContact CZ-CG1 4.15Å; F312-V337 WeakPolarHBondContact O-CG2 3.31Å; I316-V337 HydrophobicContact CB-CG1 4.23Å; I316-V337 HydrophobicContact CG2-CG1 3.82Å; V317-V337 HydrophobicContact CG2-CG1 3.43Å; V317-V337 VanDerWaalsContact CG2-CG1 3.43Å; G333-V337 WeakPolarHBondContact O-CG2 3.26Å; I334-V337 WeakPolarHBondContact O-CB 3.46Å; I334-V337 WeakPolarHBondContact O-CG2 3.22Å; I334-V337 PolarHBondContact O-N 3.34Å; I334-V337 VanDerWaalsContact O-N 3.08Å; V337-Y383 WeakPolarHBondContact O-CE2 3.34Å; V337-Y383 PolarHBondContact O-OH 3.43Å
338	L	94.4	Very high	95	Very high	7 Å²	7	39.5 Å²	39.5	4%	0.037	21%	0.207	C	C	.	.	S	Bend	trans	-138.7	149.5	178.8	-72.1	176.1	0	0	0	109.5	I316 A320 V326 L342 I343 V379 L382	I316-L338 HydrophobicContact CG2-CD1 3.39Å; I316-L338 HydrophobicContact CG2-CG 3.88Å; A320-L338 HydrophobicContact CB-CD1 3.73Å; A320-L338 HydrophobicContact CB-CD2 4.14Å; V326-L338 HydrophobicContact CB-CD1 4.28Å; V326-L338 HydrophobicContact CG2-CD1 3.87Å; L338-L342 HydrophobicContact CB-CB 4.44Å; L338-I343 HydrophobicContact CB-CB 4.14Å; L338-I343 HydrophobicContact CB-CG2 4.02Å; L338-I343 HydrophobicContact CD1-CB 4.33Å; L338-I343 HydrophobicContact CD1-CD1 4.49Å; L338-V379 HydrophobicContact CD2-CG1 4.42Å; L338-V379 HydrophobicContact CD2-CG2 4.04Å; L338-L382 HydrophobicContact CD2-CD1 4.49Å
339	P	93.7	Very high	95	Very high	47 Å²	47	42.6 Å²	42.6	31%	0.305	23%	0.226	S	C	.	.			trans	-51	143.3	167.6	-26.1	34.6	0	0	0	111.9	D341 L342 L382	P339-D341 VanDerWaalsContact CB-OD1 3.32Å; P339-D341 WeakPolarHBondContact CB-OD1 3.44Å; P339-D341 PolarHBondContact O-N 3.28Å; P339-L342 HydrophobicContact CG-CD1 4.25Å; P339-L342 PolarHBondContact O-N 3.46Å; P339-L382 HydrophobicContact CG-CD1 4.4Å
340	E	91.8	Very high	95	Very high	172 Å²	172	44.5 Å²	44.5	80%	0.804	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-27.2	-173.9	-64.9	-172.1	162.6	0	0	114.1	I343	E340-I343 VanDerWaalsContact O-O 3.06Å
341	D	92.3	Very high	95.1	Very high	98 Å²	98	49.2 Å²	49.2	52%	0.524	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-11	-179.9	71.2	-58.2	0	0	0	113.9	P339 R378	P339-D341 VanDerWaalsContact CB-OD1 3.32Å; P339-D341 WeakPolarHBondContact CB-OD1 3.44Å; P339-D341 PolarHBondContact O-N 3.28Å; D341-R378 VanDerWaalsContact CG-NH2 3.26Å; D341-R378 IonicContact OD1-CZ 3.79Å; D341-R378 IonicContact OD1-NH1 2.82Å; D341-R378 IonicContact OD1-NH2 3.81Å; D341-R378 PolarHBondContact OD1-NH2 3.21Å; D341-R378 IonicContact OD2-CZ 3.59Å; D341-R378 IonicContact OD2-NH1 2.89Å; D341-R378 PolarHBondContact OD2-NH1 3.25Å; D341-R378 IonicContact OD2-NH2 3.19Å; D341-R378 PolarHBondContact OD2-NH2 3.23Å
342	L	94.4	Very high	95.3	Very high	9 Å²	9	50 Å²	50	5%	0.047	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-5	176.7	-66.7	-175.7	0	0	0	113.6	L338 P339 I375 R378 V379	L338-L342 HydrophobicContact CB-CB 4.44Å; P339-L342 HydrophobicContact CG-CD1 4.25Å; P339-L342 PolarHBondContact O-N 3.46Å; L342-I375 HydrophobicContact CD2-CG1 4.33Å; L342-I375 HydrophobicContact CD2-CG2 4.31Å; L342-R378 HydrophobicContact CD1-CB 4.24Å; L342-V379 HydrophobicContact CD1-CG2 4.02Å
343	I	97	Very high	95.7	Very high	9 Å²	9	48.9 Å²	48.9	5%	0.046	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	130.3	-177.7	-172.5	163.3	0	0	0	111.9	I316 V326 I334 L338 E340 L345	I316-I343 HydrophobicContact CD1-CD1 4.37Å; I316-I343 HydrophobicContact CG2-CD1 4.2Å; V326-I343 HydrophobicContact CB-CB 4.4Å; V326-I343 HydrophobicContact CB-CG1 4.14Å; V326-I343 HydrophobicContact CG1-CB 4.48Å; V326-I343 HydrophobicContact CG1-CD1 3.75Å; V326-I343 HydrophobicContact CG1-CG1 3.74Å; I334-I343 HydrophobicContact CG2-CD1 4.04Å; L338-I343 HydrophobicContact CB-CB 4.14Å; L338-I343 HydrophobicContact CB-CG2 4.02Å; L338-I343 HydrophobicContact CD1-CB 4.33Å; L338-I343 HydrophobicContact CD1-CD1 4.49Å; E340-I343 VanDerWaalsContact O-O 3.06Å; I343-L345 HydrophobicContact CD1-CD2 3.7Å; I343-L345 HydrophobicContact CG1-CD2 3.84Å; I343-L345 HydrophobicContact CG1-CG 4.2Å; I343-L345 HydrophobicContact CG2-CD2 4.45Å; I343-L345 HydrophobicContact CG2-CG 4.2Å
344	T	97.8	Very high	95.9	Very high	36 Å²	36	49 Å²	49	22%	0.221	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	109.5	169.4	-60.2	0	0	0	0	109	V326 V327 S328 V360	V326-T344 PolarHBondContact O-N 2.89Å; V327-T344 WeakPolarHBondContact CA-O 3.22Å; S328-T344 PolarHBondContact N-O 3.43Å; T344-V360 HydrophobicContact CG2-CG2 4.44Å; T344-V360 WeakPolarHBondContact OG1-CG2 3.42Å
345	L	98.1	Very high	96.1	Very high	30 Å²	30	51.5 Å²	51.5	16%	0.157	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	126	-179.2	-65.8	173.1	0	0	0	111.3	S328 R330 I334 P335 I343	S328-L345 CarbonylContact O-C 3.59Å; S328-L345 WeakPolarHBondContact O-CA 3.41Å; R330-L345 HydrophobicContact CB-CB 4.18Å; R330-L345 HydrophobicContact CG-CB 4.49Å; I334-L345 HydrophobicContact CG2-CD2 3.7Å; P335-L345 HydrophobicContact CB-CD1 3.95Å; P335-L345 HydrophobicContact CG-CD1 4.24Å; I343-L345 HydrophobicContact CD1-CD2 3.7Å; I343-L345 HydrophobicContact CG1-CD2 3.84Å; I343-L345 HydrophobicContact CG1-CG 4.2Å; I343-L345 HydrophobicContact CG2-CD2 4.45Å; I343-L345 HydrophobicContact CG2-CG 4.2Å
346	C	97.8	Very high	96.2	Very high	7 Å²	7	49.4 Å²	49.4	5%	0.047	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	156.4	-178.4	-62.4	0	0	0	0	111.9	S328 T329 R330 S352 L353	S328-C346 PolarHBondContact O-N 2.86Å; T329-C346 CarbonylContact C-O 3.58Å; T329-C346 VanDerWaalsContact CA-O 3.25Å; T329-C346 WeakPolarHBondContact CA-O 3.42Å; R330-C346 PolarHBondContact N-O 3.44Å; C346-S352 WeakPolarHBondContact CB-OG 3.34Å; C346-S352 PolarHBondContact SG-O 3.03Å; C346-S352 VanDerWaalsContact SG-O 3.34Å; C346-L353 HydrophobicContact CB-CD2 3.78Å; C346-L353 HydrophobicContact CB-CG 4.13Å
347	E	97.6	Very high	96.5	Very high	100 Å²	100	46.6 Å²	46.6	47%	0.467	25%	0.246	S	C	.	.			trans	-66.7	151.3	167.9	-66.9	-54.4	129.9	0	0	110.3	T349 S352	E347-T349 PolarHBondContact O-N 3.28Å; E347-S352 PolarHBondContact N-OG 2.85Å
348	P	95.7	Very high	96.7	Very high	43 Å²	43	49.4 Å²	49.4	28%	0.279	26%	0.26	S	S	.	.	S	Bend	trans	-74.4	57.9	-177.6	32.6	-36.7	0	0	0	112.5	L240 L308 T329 V331	L240-P348 HydrophobicContact CD1-CB 4.27Å; L308-P348 HydrophobicContact CD2-CB 4.12Å; T329-P348 HydrophobicContact CG2-CB 4.02Å; V331-P348 HydrophobicContact CG1-CB 4.21Å; V331-P348 HydrophobicContact CG1-CG 4.09Å
349	T	97.8	Very high	96.8	Very high	66 Å²	66	54.8 Å²	54.8	41%	0.405	28%	0.283	S	S	.	.	S	Bend	trans	-134.8	147	178.7	64.7	0	0	0	0	109.5	E347 R351 S352 L353	E347-T349 PolarHBondContact O-N 3.28Å; T349-R351 VanDerWaalsContact C-N 3.29Å; T349-R351 PolarHBondContact O-N 3.04Å; T349-S352 PolarHBondContact O-N 3.12Å; T349-S352 VanDerWaalsContact OG1-CB 3.23Å; T349-S352 WeakPolarHBondContact OG1-CB 3.45Å; T349-S352 PolarHBondContact OG1-N 3.09Å; T349-L353 PolarHBondContact O-N 2.64Å
350	V	97.6	Very high	96.9	Very high	39 Å²	39	52.8 Å²	52.8	24%	0.236	27%	0.27	C	S	.	.	H	α-helix	trans	-54.1	-48.8	178.2	175.3	0	0	0	0	110.5	L240 I244 S352 L353 C354	L240-V350 HydrophobicContact CD2-CG2 4.08Å; I244-V350 HydrophobicContact CG1-CB 4.48Å; I244-V350 HydrophobicContact CG1-CG1 4.03Å; V350-S352 PolarHBondContact O-N 2.97Å; V350-L353 PolarHBondContact O-N 2.92Å; V350-C354 WeakPolarHBondContact O-CB 3.41Å; V350-C354 PolarHBondContact O-N 2.71Å; V350-C354 PolarHBondContact O-SG 2.8Å
351	R	98	Very high	97.2	Very high	217 Å²	217	44.6 Å²	44.6	82%	0.819	23%	0.231	S	C	*	.	H	α-helix	trans	-56.7	-47.1	-179.9	-175.8	-179.6	177.4	-178.9	0.2	113.2	T349 A355	T349-R351 VanDerWaalsContact C-N 3.29Å; T349-R351 PolarHBondContact O-N 3.04Å; R351-A355 WeakPolarHBondContact O-CB 3.32Å; R351-A355 PolarHBondContact O-N 2.82Å; R351-A355 VanDerWaalsContact O-N 3.07Å
352	S	98.1	Very high	97.4	Very high	36 Å²	36	43 Å²	43	25%	0.252	23%	0.228	S	C	.	.	H	α-helix	trans	-69.9	-38.9	-178.5	-174.2	0	0	0	0	111.9	C346 E347 T349 V350 A355 G356	C346-S352 WeakPolarHBondContact CB-OG 3.34Å; C346-S352 PolarHBondContact SG-O 3.03Å; C346-S352 VanDerWaalsContact SG-O 3.34Å; E347-S352 PolarHBondContact N-OG 2.85Å; T349-S352 PolarHBondContact O-N 3.12Å; T349-S352 VanDerWaalsContact OG1-CB 3.23Å; T349-S352 WeakPolarHBondContact OG1-CB 3.45Å; T349-S352 PolarHBondContact OG1-N 3.09Å; V350-S352 PolarHBondContact O-N 2.97Å; S352-A355 PolarHBondContact O-N 2.92Å; S352-G356 PolarHBondContact O-N 2.73Å
353	L	98.2	Very high	97.4	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-67.6	-42.7	176.7	-74.1	161.8	0	0	0	112	L240 I244 L304 T306 T329 C346 T349 V350 G356 L357	L240-L353 HydrophobicContact CB-CD1 4.34Å; L240-L353 HydrophobicContact CD1-CD1 4.02Å; I244-L353 HydrophobicContact CD1-CB 3.53Å; I244-L353 HydrophobicContact CD1-CD1 3.64Å; I244-L353 HydrophobicContact CD1-CG 4.17Å; I244-L353 HydrophobicContact CG1-CB 4.16Å; L304-L353 HydrophobicContact CD1-CD2 4.3Å; T306-L353 HydrophobicContact CG2-CD1 4.04Å; T329-L353 HydrophobicContact CG2-CD1 3.91Å; T329-L353 HydrophobicContact CG2-CD2 3.99Å; T329-L353 HydrophobicContact CG2-CG 4.37Å; C346-L353 HydrophobicContact CB-CD2 3.78Å; C346-L353 HydrophobicContact CB-CG 4.13Å; T349-L353 PolarHBondContact O-N 2.64Å; V350-L353 PolarHBondContact O-N 2.92Å; L353-G356 PolarHBondContact O-N 3.08Å; L353-L357 WeakPolarHBondContact O-CB 3.3Å; L353-L357 WeakPolarHBondContact O-CG 3.35Å; L353-L357 PolarHBondContact O-N 3.12Å
354	C	98.3	Very high	97.3	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.014	25%	0.252	C	S	.	.	H	α-helix	trans	-58	-48.9	172.9	-71.6	0	0	0	0	111.1	E247 L248 V350 G356 L357 E358	E247-C354 PolarHBondContact OE2-SG 2.6Å; L248-C354 HydrophobicContact CD2-CB 4.21Å; V350-C354 WeakPolarHBondContact O-CB 3.41Å; V350-C354 PolarHBondContact O-N 2.71Å; V350-C354 PolarHBondContact O-SG 2.8Å; C354-G356 VanDerWaalsContact C-N 3.34Å; C354-G356 PolarHBondContact O-N 2.72Å; C354-L357 PolarHBondContact O-N 3.48Å; C354-E358 WeakPolarHBondContact O-CB 3.11Å; C354-E358 WeakPolarHBondContact O-CG 3.44Å; C354-E358 PolarHBondContact O-N 3.16Å
355	A	98.1	Very high	97.1	Very high	53 Å²	53	52.8 Å²	52.8	44%	0.438	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-39.9	178	0	0	0	0	0	112.9	R351 S352 K359	R351-A355 WeakPolarHBondContact O-CB 3.32Å; R351-A355 PolarHBondContact O-N 2.82Å; R351-A355 VanDerWaalsContact O-N 3.07Å; S352-A355 PolarHBondContact O-N 2.92Å; A355-K359 PolarHBondContact O-N 3.39Å; A355-K359 VanDerWaalsContact O-N 3.09Å
356	G	97.7	Very high	96.9	Very high	7 Å²	7	54.8 Å²	54.8	7%	0.072	28%	0.281	C	S	.	.	H	α-helix	trans	-64.5	-43.8	174.7	0	0	0	0	0	112.7	S352 L353 C354 K359 V360	S352-G356 PolarHBondContact O-N 2.73Å; L353-G356 PolarHBondContact O-N 3.08Å; C354-G356 VanDerWaalsContact C-N 3.34Å; C354-G356 PolarHBondContact O-N 2.72Å; G356-K359 PolarHBondContact O-N 3.14Å; G356-V360 WeakPolarHBondContact O-CG2 3.42Å; G356-V360 PolarHBondContact O-N 2.7Å; G356-V360 VanDerWaalsContact O-N 3.12Å
357	L	98.2	Very high	96.6	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-63.1	-46.1	175.4	-77.1	163.5	0	0	0	111.5	I226 I244 L248 I302 L304 V327 L353 C354 K359 V360 I361	I226-L357 HydrophobicContact CD1-CD2 3.9Å; I226-L357 HydrophobicContact CG1-CD2 4.46Å; I244-L357 HydrophobicContact CG2-CD1 3.64Å; L248-L357 HydrophobicContact CD1-CB 3.75Å; L248-L357 HydrophobicContact CD1-CD1 3.44Å; L248-L357 VanDerWaalsContact CD1-CD1 3.44Å; L248-L357 HydrophobicContact CD1-CG 4.18Å; I302-L357 HydrophobicContact CG2-CD2 3.95Å; L304-L357 HydrophobicContact CD1-CD1 4.07Å; L304-L357 HydrophobicContact CD1-CD2 4.27Å; L304-L357 HydrophobicContact CD1-CG 4.39Å; L304-L357 HydrophobicContact CD2-CD1 3.87Å; V327-L357 HydrophobicContact CB-CD2 4.06Å; V327-L357 HydrophobicContact CB-CG 4.5Å; V327-L357 HydrophobicContact CG1-CD2 4.24Å; V327-L357 HydrophobicContact CG1-CG 4.12Å; V327-L357 HydrophobicContact CG2-CD2 3.96Å; L353-L357 WeakPolarHBondContact O-CB 3.3Å; L353-L357 WeakPolarHBondContact O-CG 3.35Å; L353-L357 PolarHBondContact O-N 3.12Å; C354-L357 PolarHBondContact O-N 3.48Å; L357-K359 VanDerWaalsContact C-N 3.3Å; L357-K359 PolarHBondContact O-N 3.08Å; L357-V360 CarbonylContact O-C 3.38Å; L357-V360 PolarHBondContact O-N 3.29Å; L357-I361 HydrophobicContact CB-CD1 4.41Å; L357-I361 WeakPolarHBondContact O-CB 3.5Å; L357-I361 WeakPolarHBondContact O-CD1 3.25Å; L357-I361 WeakPolarHBondContact O-CG1 3.06Å; L357-I361 PolarHBondContact O-N 3.27Å
358	E	97.8	Very high	96.3	Very high	60 Å²	60	56.6 Å²	56.6	28%	0.28	31%	0.313	S	S	.	.	H	α-helix	trans	-58	-40.8	176.5	-74.6	172.5	171.6	0	0	111.9	L248 K251 C354 V360 I361 S362	L248-E358 HydrophobicContact CD2-CG 3.85Å; K251-E358 WeakPolarHBondContact CD-OE1 3.45Å; K251-E358 IonicContact NZ-OE1 3.47Å; K251-E358 PolarHBondContact NZ-OE1 2.91Å; C354-E358 WeakPolarHBondContact O-CB 3.11Å; C354-E358 WeakPolarHBondContact O-CG 3.44Å; C354-E358 PolarHBondContact O-N 3.16Å; E358-V360 VanDerWaalsContact C-N 3.35Å; E358-V360 PolarHBondContact O-N 3.15Å; E358-I361 PolarHBondContact O-N 3.17Å; E358-S362 WeakPolarHBondContact O-CB 3.37Å; E358-S362 PolarHBondContact O-N 2.84Å; E358-S362 PolarHBondContact O-OG 3.4Å
359	K	96.9	Very high	96.1	Very high	120 Å²	120	55.9 Å²	55.9	52%	0.522	31%	0.308	S	S	.	.	H	α-helix	trans	-62.5	-39.9	174.2	-175.2	-178.8	-179.7	-178.6	0	112.3	A355 G356 L357 S362 K363	A355-K359 PolarHBondContact O-N 3.39Å; A355-K359 VanDerWaalsContact O-N 3.09Å; G356-K359 PolarHBondContact O-N 3.14Å; L357-K359 VanDerWaalsContact C-N 3.3Å; L357-K359 PolarHBondContact O-N 3.08Å; K359-S362 WeakPolarHBondContact CA-OG 3.41Å; K359-S362 PolarHBondContact O-OG 2.82Å; K359-K363 WeakPolarHBondContact O-CG 3.23Å; K359-K363 PolarHBondContact O-N 3.24Å
360	V	97.1	Very high	95.8	Very high	5 Å²	5	55 Å²	55	3%	0.03	30%	0.304	C	S	.	.	H	α-helix	trans	-75.6	-39.6	178.3	175.8	0	0	0	0	111.5	I302 Q325 V327 T344 G356 L357 E358 S362 K363 Q364	I302-V360 HydrophobicContact CD1-CB 4.36Å; I302-V360 HydrophobicContact CD1-CG1 3.75Å; I302-V360 HydrophobicContact CG1-CG1 3.84Å; I302-V360 HydrophobicContact CG2-CG1 4.42Å; Q325-V360 HydrophobicContact CB-CG1 3.53Å; Q325-V360 HydrophobicContact CG-CG1 3.94Å; V327-V360 HydrophobicContact CG2-CB 4.06Å; V327-V360 HydrophobicContact CG2-CG1 4.41Å; V327-V360 HydrophobicContact CG2-CG2 3.61Å; T344-V360 HydrophobicContact CG2-CG2 4.44Å; T344-V360 WeakPolarHBondContact OG1-CG2 3.42Å; G356-V360 WeakPolarHBondContact O-CG2 3.42Å; G356-V360 PolarHBondContact O-N 2.7Å; G356-V360 VanDerWaalsContact O-N 3.12Å; L357-V360 CarbonylContact O-C 3.38Å; L357-V360 PolarHBondContact O-N 3.29Å; E358-V360 VanDerWaalsContact C-N 3.35Å; E358-V360 PolarHBondContact O-N 3.15Å; V360-S362 PolarHBondContact O-N 3.37Å; V360-K363 PolarHBondContact O-N 3.46Å; V360-Q364 WeakPolarHBondContact O-CB 3.21Å; V360-Q364 PolarHBondContact O-N 3.3Å
361	I	97	Very high	95.6	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-45.7	175.5	-68.3	163.4	0	0	0	110.3	I224 L255 I302 L357 E358 K363 Q364 R365	I224-I361 HydrophobicContact CD1-CG2 3.77Å; L255-I361 HydrophobicContact CD1-CD1 3.94Å; L255-I361 HydrophobicContact CD1-CG1 4.39Å; L255-I361 HydrophobicContact CD2-CD1 4.17Å; I302-I361 HydrophobicContact CD1-CG1 3.67Å; L357-I361 HydrophobicContact CB-CD1 4.41Å; L357-I361 WeakPolarHBondContact O-CB 3.5Å; L357-I361 WeakPolarHBondContact O-CD1 3.25Å; L357-I361 WeakPolarHBondContact O-CG1 3.06Å; L357-I361 PolarHBondContact O-N 3.27Å; E358-I361 PolarHBondContact O-N 3.17Å; I361-K363 PolarHBondContact O-N 2.85Å; I361-Q364 WeakPolarHBondContact O-CB 3.4Å; I361-Q364 PolarHBondContact O-N 3.04Å; I361-R365 WeakPolarHBondContact O-CG 3.48Å; I361-R365 PolarHBondContact O-N 3.32Å
362	S	96.3	Very high	95.5	Very high	65 Å²	65	47 Å²	47	46%	0.455	28%	0.282	S	S	.	.	H	α-helix	trans	-61.6	-44.3	176.9	53.6	0	0	0	0	112.4	E358 K359 V360 Q364 R365 S366	E358-S362 WeakPolarHBondContact O-CB 3.37Å; E358-S362 PolarHBondContact O-N 2.84Å; E358-S362 PolarHBondContact O-OG 3.4Å; K359-S362 WeakPolarHBondContact CA-OG 3.41Å; K359-S362 PolarHBondContact O-OG 2.82Å; V360-S362 PolarHBondContact O-N 3.37Å; S362-Q364 VanDerWaalsContact C-N 3.33Å; S362-Q364 PolarHBondContact O-N 3.42Å; S362-R365 PolarHBondContact O-N 3.01Å; S362-S366 PolarHBondContact O-N 2.91Å; S362-S366 PolarHBondContact O-OG 3.36Å
363	K	95.4	Very high	95.4	Very high	96 Å²	96	48.3 Å²	48.3	42%	0.417	30%	0.295	S	S	.	.	H	α-helix	trans	-62.2	-38.8	173.1	-74.1	-179.9	174.2	-167.2	0	113.1	K359 V360 I361 R365 S366 G367 S368 V369	K359-K363 WeakPolarHBondContact O-CG 3.23Å; K359-K363 PolarHBondContact O-N 3.24Å; V360-K363 PolarHBondContact O-N 3.46Å; I361-K363 PolarHBondContact O-N 2.85Å; K363-R365 VanDerWaalsContact C-N 3.32Å; K363-S366 WeakPolarHBondContact CA-OG 2.89Å; K363-S366 PolarHBondContact O-N 3.05Å; K363-S366 PolarHBondContact O-OG 3.44Å; K363-S366 VanDerWaalsContact O-OG 3.1Å; K363-G367 PolarHBondContact O-N 2.72Å; K363-S368 PolarHBondContact O-N 3.01Å; K363-V369 HydrophobicContact CB-CG1 3.86Å
364	Q	94.2	Very high	95.2	Very high	39 Å²	39	51 Å²	51	18%	0.182	31%	0.314	C	S	.	.	H	α-helix	trans	-62.8	-42.4	177.5	-175.9	64	42.6	0	0	110.3	I224 H301 V360 I361 S362 G367 V369	I224-Q364 HydrophobicContact CD1-CG 4.41Å; H301-Q364 HydrophobicContact CB-CG 4.46Å; V360-Q364 WeakPolarHBondContact O-CB 3.21Å; V360-Q364 PolarHBondContact O-N 3.3Å; I361-Q364 WeakPolarHBondContact O-CB 3.4Å; I361-Q364 PolarHBondContact O-N 3.04Å; S362-Q364 VanDerWaalsContact C-N 3.33Å; S362-Q364 PolarHBondContact O-N 3.42Å; Q364-G367 PolarHBondContact O-N 3.42Å; Q364-V369 HydrophobicContact CB-CG1 4.45Å
365	R	94.1	Very high	95	Very high	123 Å²	123	51.1 Å²	51.1	46%	0.464	31%	0.314	S	S	.	.	H	α-helix	trans	-69	-37.3	177.1	-70.8	176.5	177.7	177.1	-0.7	113.2	I224 H252 D254 I361 S362 K363 G367	I224-R365 HydrophobicContact CD1-CG 3.74Å; H252-R365 PolarHBondContact ND1-NH1 3.1Å; H252-R365 PolarHBondContact ND1-NH2 3.12Å; D254-R365 IonicContact OD1-CZ 2.77Å; D254-R365 IonicContact OD1-NH2 2.62Å; D254-R365 PolarHBondContact OD1-NH2 3.36Å; D254-R365 IonicContact OD2-CZ 3.07Å; D254-R365 IonicContact OD2-NE 3.64Å; D254-R365 IonicContact OD2-NH2 3.39Å; D254-R365 PolarHBondContact OD2-NH2 3.12Å; I361-R365 WeakPolarHBondContact O-CG 3.48Å; I361-R365 PolarHBondContact O-N 3.32Å; S362-R365 PolarHBondContact O-N 3.01Å; K363-R365 VanDerWaalsContact C-N 3.32Å; R365-G367 PolarHBondContact O-N 3.3Å
366	S	94.1	Very high	94.9	Very high	73 Å²	73	50.1 Å²	50.1	51%	0.51	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-2.2	177.7	68.8	0	0	0	0	113.6	S362 K363 S368	S362-S366 PolarHBondContact O-N 2.91Å; S362-S366 PolarHBondContact O-OG 3.36Å; K363-S366 WeakPolarHBondContact CA-OG 2.89Å; K363-S366 PolarHBondContact O-N 3.05Å; K363-S366 PolarHBondContact O-OG 3.44Å; K363-S366 VanDerWaalsContact O-OG 3.1Å; S366-S368 PolarHBondContact O-N 3.09Å; S366-S368 PolarHBondContact O-OG 3.34Å; S366-S368 WeakPolarHBondContact OG-CB 2.92Å; S366-S368 PolarHBondContact OG-OG 2.73Å
367	G	89.8	Confident	94.7	Very high	59 Å²	59	52.7 Å²	52.7	61%	0.608	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.1	14.8	-175.2	0	0	0	0	0	113.7	K363 Q364 R365 V369	K363-G367 PolarHBondContact O-N 2.72Å; Q364-G367 PolarHBondContact O-N 3.42Å; R365-G367 PolarHBondContact O-N 3.3Å; G367-V369 PolarHBondContact O-N 3.03Å
368	S	91.3	Very high	94.5	Very high	85 Å²	85	57.4 Å²	57.4	59%	0.594	34%	0.335	S	S	*	.			trans	-88	13.7	-176.6	-47.4	0	0	0	0	113.1	K363 S366	K363-S368 PolarHBondContact O-N 3.01Å; S366-S368 PolarHBondContact O-N 3.09Å; S366-S368 PolarHBondContact O-OG 3.34Å; S366-S368 WeakPolarHBondContact OG-CB 2.92Å; S366-S368 PolarHBondContact OG-OG 2.73Å
369	V	91.6	Very high	94.2	Very high	28 Å²	28	54.6 Å²	54.6	17%	0.17	32%	0.322	C	S	.	.	S	Bend	trans	-90.2	147.2	175.4	-69.9	0	0	0	0	110.6	Q325 K363 Q364 G367	Q325-V369 HydrophobicContact CG-CB 4.34Å; Q325-V369 HydrophobicContact CG-CG1 3.91Å; K363-V369 HydrophobicContact CB-CG1 3.86Å; Q364-V369 HydrophobicContact CB-CG1 4.45Å; G367-V369 PolarHBondContact O-N 3.03Å
370	P	92.4	Very high	93.9	Very high	49 Å²	49	52.5 Å²	52.5	32%	0.318	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-58.5	147	170.5	-21.5	32.4	0	0	0	111.4	I375	P370-I375 HydrophobicContact CB-CD1 4.27Å; P370-I375 HydrophobicContact CB-CG1 3.87Å
371	S	94.1	Very high	93.5	Very high	66 Å²	66	58 Å²	58	46%	0.462	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-63.9	148.2	176.9	72.7	0	0	0	0	111.1	A373 S374 I375	S371-A373 PolarHBondContact O-N 2.91Å; S371-S374 WeakPolarHBondContact O-CB 3.37Å; S371-S374 PolarHBondContact O-N 2.98Å; S371-S374 VanDerWaalsContact OG-CB 3.31Å; S371-S374 WeakPolarHBondContact OG-CB 3.4Å; S371-S374 PolarHBondContact OG-N 2.95Å; S371-I375 PolarHBondContact O-N 2.71Å; S371-I375 VanDerWaalsContact O-N 3.08Å
372	P	95.1	Very high	93.1	Very high	22 Å²	22	61.4 Å²	61.4	14%	0.143	36%	0.36	C	S	.	.	H	α-helix	trans	-53.9	-39	178.1	-30.7	38.8	0	0	0	113.5	P214 P216 R219 I375 H376	P214-P372 HydrophobicContact CB-CB 3.79Å; P216-P372 HydrophobicContact CG-CB 4.07Å; P216-P372 HydrophobicContact CG-CG 3.99Å; R219-P372 VanDerWaalsContact NH1-CG 3.28Å; P372-I375 PolarHBondContact O-N 3.45Å; P372-H376 WeakPolarHBondContact O-CB 3.12Å; P372-H376 PolarHBondContact O-N 3.49Å
373	A	95	Very high	92.7	Very high	63 Å²	63	59.9 Å²	59.9	52%	0.521	35%	0.345	S	S	.	.	H	α-helix	trans	-65.5	-38.4	176.4	0	0	0	0	0	112.7	S371 S377	S371-A373 PolarHBondContact O-N 2.91Å; A373-S377 WeakPolarHBondContact O-CB 3.4Å; A373-S377 PolarHBondContact O-N 3.39Å
374	S	95.1	Very high	92.5	Very high	55 Å²	55	57.1 Å²	57.1	39%	0.385	34%	0.336	S	S	.	.	H	α-helix	trans	-65.1	-41.5	176.3	-178.4	0	0	0	0	111.7	S371 R378	S371-S374 WeakPolarHBondContact O-CB 3.37Å; S371-S374 PolarHBondContact O-N 2.98Å; S371-S374 VanDerWaalsContact OG-CB 3.31Å; S371-S374 WeakPolarHBondContact OG-CB 3.4Å; S371-S374 PolarHBondContact OG-N 2.95Å; S374-R378 WeakPolarHBondContact O-CG 3.43Å; S374-R378 PolarHBondContact O-N 2.77Å
375	I	94.7	Very high	92.5	Very high	5 Å²	5	56.1 Å²	56.1	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-64.8	-51.3	177.4	-58.8	168	0	0	0	109.5	A320 L342 P370 S371 P372 S377 R378 V379	A320-I375 HydrophobicContact CB-CG2 4.4Å; A320-I375 VanDerWaalsContact O-CG2 3.22Å; A320-I375 WeakPolarHBondContact O-CG2 3.21Å; L342-I375 HydrophobicContact CD2-CG1 4.33Å; L342-I375 HydrophobicContact CD2-CG2 4.31Å; P370-I375 HydrophobicContact CB-CD1 4.27Å; P370-I375 HydrophobicContact CB-CG1 3.87Å; S371-I375 PolarHBondContact O-N 2.71Å; S371-I375 VanDerWaalsContact O-N 3.08Å; P372-I375 PolarHBondContact O-N 3.45Å; I375-S377 VanDerWaalsContact C-N 3.3Å; I375-S377 PolarHBondContact O-N 3.21Å; I375-R378 PolarHBondContact O-N 3.11Å; I375-V379 HydrophobicContact CG2-CG2 4.25Å; I375-V379 WeakPolarHBondContact O-CG2 3.24Å; I375-V379 PolarHBondContact O-N 3.07Å
376	H	95.1	Very high	92.4	Very high	33 Å²	33	57.1 Å²	57.1	15%	0.153	34%	0.338	C	S	.	.	H	α-helix	trans	-54.3	-46.2	177.9	177.4	80.1	0	0	0	111.9	P209 F212 P214 S321 P372 R378 V379 K380	P209-H376 PolarHBondContact O-CE1 3.29Å; F212-H376 PolarHBondContact O-CE1 2.96Å; F212-H376 PolarHBondContact O-ND1 3.1Å; P214-H376 HydrophobicContact CG-CB 3.92Å; S321-H376 WeakPolarHBondContact O-CB 3.4Å; S321-H376 PolarHBondContact O-ND1 3.05Å; P372-H376 WeakPolarHBondContact O-CB 3.12Å; P372-H376 PolarHBondContact O-N 3.49Å; H376-R378 PolarHBondContact O-N 2.91Å; H376-V379 PolarHBondContact O-N 3.38Å; H376-K380 WeakPolarHBondContact O-CB 3.24Å; H376-K380 PolarHBondContact O-N 3.42Å
377	S	94.1	Very high	92.4	Very high	61 Å²	61	56.7 Å²	56.7	43%	0.427	33%	0.33	S	S	.	.	H	α-helix	trans	-63.6	-28.1	-179.6	-169.5	0	0	0	0	113.6	A373 I375	A373-S377 WeakPolarHBondContact O-CB 3.4Å; A373-S377 PolarHBondContact O-N 3.39Å; I375-S377 VanDerWaalsContact C-N 3.3Å; I375-S377 PolarHBondContact O-N 3.21Å
378	R	93	Very high	92.6	Very high	98 Å²	98	54 Å²	54	37%	0.37	30%	0.302	S	S	.	.	H	α-helix	trans	-79.4	-37.7	175.2	-71.6	178	64	-164.9	-2.5	112	D341 L342 S374 I375 H376 L382	D341-R378 VanDerWaalsContact CG-NH2 3.26Å; D341-R378 IonicContact OD1-CZ 3.79Å; D341-R378 IonicContact OD1-NH1 2.82Å; D341-R378 IonicContact OD1-NH2 3.81Å; D341-R378 PolarHBondContact OD1-NH2 3.21Å; D341-R378 IonicContact OD2-CZ 3.59Å; D341-R378 IonicContact OD2-NH1 2.89Å; D341-R378 PolarHBondContact OD2-NH1 3.25Å; D341-R378 IonicContact OD2-NH2 3.19Å; D341-R378 PolarHBondContact OD2-NH2 3.23Å; L342-R378 HydrophobicContact CD1-CB 4.24Å; S374-R378 WeakPolarHBondContact O-CG 3.43Å; S374-R378 PolarHBondContact O-N 2.77Å; I375-R378 PolarHBondContact O-N 3.11Å; H376-R378 PolarHBondContact O-N 2.91Å; R378-L382 WeakPolarHBondContact O-CG 3.18Å
379	V	92.5	Very high	92.9	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-80.8	-34.1	-175.5	179.3	0	0	0	0	112.6	V317 A320 S321 L338 L342 I375 H376 N381 L382	V317-V379 HydrophobicContact CG1-CG1 3.69Å; A320-V379 HydrophobicContact CB-CG1 4.46Å; A320-V379 HydrophobicContact CB-CG2 3.95Å; S321-V379 WeakPolarHBondContact OG-CG1 3.44Å; L338-V379 HydrophobicContact CD2-CG1 4.42Å; L338-V379 HydrophobicContact CD2-CG2 4.04Å; L342-V379 HydrophobicContact CD1-CG2 4.02Å; I375-V379 HydrophobicContact CG2-CG2 4.25Å; I375-V379 WeakPolarHBondContact O-CG2 3.24Å; I375-V379 PolarHBondContact O-N 3.07Å; H376-V379 PolarHBondContact O-N 3.38Å; V379-N381 PolarHBondContact O-N 2.94Å; V379-L382 WeakPolarHBondContact O-CB 3.32Å; V379-L382 PolarHBondContact O-N 3.34Å
380	K	90.7	Very high	93	Very high	75 Å²	75	53 Å²	53	33%	0.326	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-27.7	-170.9	68.7	179.9	-177.8	-175	0	115.5	P209 H376 T384	P209-K380 HydrophobicContact CB-CB 3.71Å; P209-K380 HydrophobicContact CG-CB 4.2Å; P209-K380 WeakPolarHBondContact CG-O 3.33Å; H376-K380 WeakPolarHBondContact O-CB 3.24Å; H376-K380 PolarHBondContact O-N 3.42Å; K380-T384 WeakPolarHBondContact O-CG2 3.38Å
381	N	87.8	Confident	93.2	Very high	121 Å²	121	54.7 Å²	54.7	65%	0.647	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-4.5	-177.2	-67.3	-27.5	0	0	0	113.4	V379	V379-N381 PolarHBondContact O-N 2.94Å
382	L	87.9	Confident	93.4	Very high	71 Å²	71	51.7 Å²	51.7	37%	0.372	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-44.8	-176	-63.5	178.9	0	0	0	111.9	L338 P339 R378 V379	L338-L382 HydrophobicContact CD2-CD1 4.49Å; P339-L382 HydrophobicContact CG-CD1 4.4Å; R378-L382 WeakPolarHBondContact O-CG 3.18Å; V379-L382 WeakPolarHBondContact O-CB 3.32Å; V379-L382 PolarHBondContact O-N 3.34Å
383	Y	88.6	Confident	93.4	Very high	34 Å²	34	51.6 Å²	51.6	13%	0.133	26%	0.262	C	S	.	.	S	Bend	trans	-135.2	78.6	-170	-56.2	-75.3	0	0	0	111.6	P204 A206 V207 F312 V317 E336 V337	P204-Y383 HydrophobicContact CB-CD1 3.78Å; P204-Y383 HydrophobicContact CB-CE1 3.72Å; P204-Y383 HydrophobicContact CG-CD1 3.74Å; P204-Y383 HydrophobicContact CG-CE1 3.81Å; A206-Y383 WeakPolarHBondContact CA-O 3.46Å; A206-Y383 VanDerWaalsContact CB-O 3.29Å; A206-Y383 WeakPolarHBondContact CB-O 3.44Å; V207-Y383 PolarHBondContact N-O 3.08Å; V207-Y383 VanDerWaalsContact N-O 3.1Å; V207-Y383 VanDerWaalsContact O-O 3.09Å; F312-Y383 HydrophobicContact CE2-CD1 4.12Å; F312-Y383 AromaticContact CE2-CE1 3.68Å; F312-Y383 HydrophobicContact CE2-CE1 3.68Å; F312-Y383 AromaticContact CZ-CD1 3.62Å; F312-Y383 HydrophobicContact CZ-CD1 3.62Å; F312-Y383 HydrophobicContact CZ-CD2 4.22Å; F312-Y383 AromaticContact CZ-CE1 3.58Å; F312-Y383 HydrophobicContact CZ-CE1 3.58Å; F312-Y383 HydrophobicContact CZ-CE2 4.22Å; F312-Y383 AromaticContact CZ-CG 3.95Å; F312-Y383 HydrophobicContact CZ-CG 3.95Å; F312-Y383 AromaticContact CZ-CZ 3.91Å; V317-Y383 HydrophobicContact CG1-CD2 3.9Å; V317-Y383 HydrophobicContact CG2-CD2 4.18Å; V317-Y383 HydrophobicContact CG2-CE2 4.48Å; E336-Y383 PolarHBondContact O-OH 3.35Å; V337-Y383 WeakPolarHBondContact O-CE2 3.34Å; V337-Y383 PolarHBondContact O-OH 3.43Å
384	T	91.8	Very high	93.5	Very high	37 Å²	37	55.7 Å²	55.7	23%	0.227	27%	0.268	C	S	.	.			trans	-101.9	143.4	179.8	66.6	0	0	0	0	111.9	A206 K380 K386 N387 V388	A206-T384 VanDerWaalsContact CB-C 3.44Å; K380-T384 WeakPolarHBondContact O-CG2 3.38Å; T384-K386 PolarHBondContact O-N 3.18Å; T384-N387 PolarHBondContact O-N 3.02Å; T384-N387 VanDerWaalsContact O-N 3.12Å; T384-N387 WeakPolarHBondContact OG1-CB 3.36Å; T384-N387 PolarHBondContact OG1-N 3.17Å; T384-V388 PolarHBondContact O-N 2.82Å
385	W	93.6	Very high	93.6	Very high	18 Å²	18	53.5 Å²	53.5	7%	0.068	25%	0.253	C	S	.	.	H	α-helix	trans	-60.4	-31.3	177.2	-71.5	114.6	0	0	0	113	H49 Q52 L53 C56 A206 V388 A389	H49-W385 HydrophobicContact CB-CH2 3.95Å; H49-W385 AromaticContact CG-CH2 3.93Å; H49-W385 AromaticContact ND1-CH2 3.6Å; H49-W385 AromaticContact ND1-CZ3 3.61Å; Q52-W385 HydrophobicContact CB-CD2 3.45Å; Q52-W385 VanDerWaalsContact CB-CD2 3.45Å; Q52-W385 HydrophobicContact CB-CE3 3.87Å; Q52-W385 HydrophobicContact CB-CG 3.9Å; Q52-W385 HydrophobicContact CB-CH2 4.18Å; Q52-W385 HydrophobicContact CB-CZ2 3.73Å; Q52-W385 HydrophobicContact CB-CZ3 4.22Å; Q52-W385 HydrophobicContact CG-CD2 4.31Å; Q52-W385 HydrophobicContact CG-CZ2 4.02Å; L53-W385 HydrophobicContact CB-CZ3 4.44Å; C56-W385 VanDerWaalsContact SG-CB 3.56Å; A206-W385 HydrophobicContact CB-CD2 3.55Å; A206-W385 HydrophobicContact CB-CE3 3.79Å; A206-W385 HydrophobicContact CB-CG 3.92Å; A206-W385 HydrophobicContact CB-CH2 4.29Å; A206-W385 HydrophobicContact CB-CZ2 4.15Å; A206-W385 HydrophobicContact CB-CZ3 4.15Å; A206-W385 WeakPolarHBondContact O-CZ2 3.43Å; W385-V388 HydrophobicContact CE3-CB 4.46Å; W385-V388 HydrophobicContact CE3-CG1 4.46Å; W385-V388 HydrophobicContact CZ3-CG1 4.47Å; W385-V388 PolarHBondContact O-N 2.87Å; W385-A389 VanDerWaalsContact O-CB 3.3Å; W385-A389 WeakPolarHBondContact O-CB 3.39Å; W385-A389 PolarHBondContact O-N 3.21Å
386	K	92.6	Very high	93.7	Very high	145 Å²	145	53.3 Å²	53.3	63%	0.63	25%	0.252	S	S	*	.	H	α-helix	trans	-61.3	-47.4	173.9	-66.1	-176.5	179.9	178	0	111.7	T384 A389 E390	T384-K386 PolarHBondContact O-N 3.18Å; K386-A389 PolarHBondContact O-N 2.82Å; K386-E390 WeakPolarHBondContact O-CG 3.25Å; K386-E390 PolarHBondContact O-N 3.18Å
387	N	93.1	Very high	93.8	Very high	63 Å²	63	54.3 Å²	54.3	34%	0.337	26%	0.258	S	S	.	.	H	α-helix	trans	-65.3	-41.7	177.3	-176.1	-99.7	0	0	0	112.1	T384 E390 R391	T384-N387 PolarHBondContact O-N 3.02Å; T384-N387 VanDerWaalsContact O-N 3.12Å; T384-N387 WeakPolarHBondContact OG1-CB 3.36Å; T384-N387 PolarHBondContact OG1-N 3.17Å; N387-E390 PolarHBondContact O-N 2.96Å; N387-R391 WeakPolarHBondContact O-CG 3.15Å; N387-R391 PolarHBondContact O-N 3.05Å; N387-R391 VanDerWaalsContact OD1-CD 3.32Å; N387-R391 WeakPolarHBondContact OD1-CD 3.05Å
388	V	95.4	Very high	93.8	Very high	2 Å²	2	57 Å²	57	1%	0.012	26%	0.259	C	S	.	.	H	α-helix	trans	-60.2	-48	175.8	174.3	0	0	0	0	110.4	L53 I203 P204 A206 T384 W385 E390 R391 T392	L53-V388 HydrophobicContact CD1-CG1 4.23Å; I203-V388 HydrophobicContact CG2-CB 4.41Å; I203-V388 HydrophobicContact CG2-CG1 3.91Å; I203-V388 HydrophobicContact CG2-CG2 4.4Å; P204-V388 VanDerWaalsContact O-CG2 3.27Å; P204-V388 WeakPolarHBondContact O-CG2 3.4Å; A206-V388 HydrophobicContact CB-CG2 3.7Å; T384-V388 PolarHBondContact O-N 2.82Å; W385-V388 HydrophobicContact CE3-CB 4.46Å; W385-V388 HydrophobicContact CE3-CG1 4.46Å; W385-V388 HydrophobicContact CZ3-CG1 4.47Å; W385-V388 PolarHBondContact O-N 2.87Å; V388-E390 PolarHBondContact O-N 2.86Å; V388-R391 PolarHBondContact O-N 3.49Å; V388-T392 WeakPolarHBondContact O-CB 3.33Å; V388-T392 PolarHBondContact O-N 3.31Å; V388-T392 PolarHBondContact O-OG1 3.22Å
389	A	95.9	Very high	93.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.8	-40.2	178.3	0	0	0	0	0	112.9	L53 C56 L57 K60 W385 K386 T392 E393	L53-A389 HydrophobicContact CD1-CB 4.02Å; C56-A389 HydrophobicContact CB-CB 3.55Å; L57-A389 HydrophobicContact CD2-CB 4.41Å; K60-A389 HydrophobicContact CD-CB 4.29Å; W385-A389 VanDerWaalsContact O-CB 3.3Å; W385-A389 WeakPolarHBondContact O-CB 3.39Å; W385-A389 PolarHBondContact O-N 3.21Å; K386-A389 PolarHBondContact O-N 2.82Å; A389-T392 PolarHBondContact O-N 2.88Å; A389-E393 VanDerWaalsContact O-CB 3.31Å; A389-E393 WeakPolarHBondContact O-CB 3.46Å; A389-E393 PolarHBondContact O-N 2.96Å
390	E	95.6	Very high	93.9	Very high	93 Å²	93	52.8 Å²	52.8	44%	0.435	25%	0.246	S	C	.	.	H	α-helix	trans	-63	-40.6	174.2	-76.2	171.7	-175.9	0	0	112.8	K386 N387 V388 K394	K386-E390 WeakPolarHBondContact O-CG 3.25Å; K386-E390 PolarHBondContact O-N 3.18Å; N387-E390 PolarHBondContact O-N 2.96Å; V388-E390 PolarHBondContact O-N 2.86Å; E390-K394 WeakPolarHBondContact O-CG 3.27Å; E390-K394 PolarHBondContact O-N 2.53Å
391	R	96.6	Very high	93.9	Very high	85 Å²	85	52.5 Å²	52.5	32%	0.321	26%	0.264	S	S	.	.	H	α-helix	trans	-69.9	-38.8	177.2	-68.9	173.2	68.7	168	6	111.4	V202 I203 N387 V388 K394 V395	V202-R391 PolarHBondContact O-NH2 3.03Å; I203-R391 HydrophobicContact CD1-CB 3.89Å; I203-R391 HydrophobicContact CG1-CB 4.23Å; I203-R391 HydrophobicContact CG2-CB 4.1Å; N387-R391 WeakPolarHBondContact O-CG 3.15Å; N387-R391 PolarHBondContact O-N 3.05Å; N387-R391 VanDerWaalsContact OD1-CD 3.32Å; N387-R391 WeakPolarHBondContact OD1-CD 3.05Å; V388-R391 PolarHBondContact O-N 3.49Å; R391-K394 PolarHBondContact O-N 3.46Å; R391-V395 PolarHBondContact O-N 3.43Å
392	T	96.9	Very high	94	Very high	3 Å²	3	49.5 Å²	49.5	2%	0.018	25%	0.246	C	C	.	.	H	α-helix	trans	-69.3	-36.6	176.4	-56.5	0	0	0	0	111.6	L53 V388 A389 K394 V395 Y396	L53-T392 HydrophobicContact CD2-CG2 4.38Å; V388-T392 WeakPolarHBondContact O-CB 3.33Å; V388-T392 PolarHBondContact O-N 3.31Å; V388-T392 PolarHBondContact O-OG1 3.22Å; A389-T392 PolarHBondContact O-N 2.88Å; T392-K394 VanDerWaalsContact C-N 3.31Å; T392-K394 PolarHBondContact O-N 3.1Å; T392-V395 WeakPolarHBondContact O-CA 3.39Å; T392-V395 WeakPolarHBondContact O-CB 3.44Å; T392-V395 PolarHBondContact O-N 3.11Å; T392-Y396 HydrophobicContact CG2-CD2 4.39Å; T392-Y396 HydrophobicContact CG2-CE1 3.91Å; T392-Y396 HydrophobicContact CG2-CE2 3.66Å; T392-Y396 WeakPolarHBondContact CG2-OH 3.12Å; T392-Y396 PolarHBondContact O-N 3.36Å
393	E	96.4	Very high	93.9	Very high	20 Å²	20	52 Å²	52	9%	0.093	26%	0.256	C	S	.	.	H	α-helix	trans	-57.4	-43.2	172.7	-179.9	-178	-114.6	0	0	111.5	S27 K60 H62 A389 V395 Y396 D397	S27-E393 PolarHBondContact OG-OE1 3.08Å; K60-E393 WeakPolarHBondContact CE-OE1 3.46Å; K60-E393 WeakPolarHBondContact CE-OE2 3.45Å; K60-E393 IonicContact NZ-OE1 2.86Å; K60-E393 PolarHBondContact NZ-OE1 3.31Å; K60-E393 IonicContact NZ-OE2 2.79Å; K60-E393 PolarHBondContact NZ-OE2 2.91Å; H62-E393 IonicContact CE1-OE1 2.76Å; H62-E393 IonicContact NE2-OE1 3.39Å; H62-E393 PolarHBondContact NE2-OE1 3.29Å; A389-E393 VanDerWaalsContact O-CB 3.31Å; A389-E393 WeakPolarHBondContact O-CB 3.46Å; A389-E393 PolarHBondContact O-N 2.96Å; E393-V395 VanDerWaalsContact C-N 3.26Å; E393-V395 PolarHBondContact O-N 2.86Å; E393-Y396 WeakPolarHBondContact O-CA 3.49Å; E393-Y396 WeakPolarHBondContact O-CB 3.47Å; E393-Y396 PolarHBondContact O-N 2.86Å; E393-D397 PolarHBondContact O-N 3.1Å
394	K	96.4	Very high	93.8	Very high	148 Å²	148	51.8 Å²	51.8	64%	0.643	26%	0.258	S	S	*	.	H	α-helix	trans	-60.8	-34.7	174.3	-68.2	174.2	-177.9	179.5	0	112.9	E390 R391 T392 R398	E390-K394 WeakPolarHBondContact O-CG 3.27Å; E390-K394 PolarHBondContact O-N 2.53Å; R391-K394 PolarHBondContact O-N 3.46Å; T392-K394 VanDerWaalsContact C-N 3.31Å; T392-K394 PolarHBondContact O-N 3.1Å; K394-R398 WeakPolarHBondContact O-CB 3.3Å; K394-R398 PolarHBondContact O-N 3.31Å
395	V	96.9	Very high	93.6	Very high	10 Å²	10	51.3 Å²	51.3	6%	0.061	25%	0.254	C	S	.	.	H	α-helix	trans	-65.9	-44.2	173.1	172.4	0	0	0	0	110	V147 H177 V179 I203 R391 T392 E393 R398 V399	V147-V395 HydrophobicContact CG1-CG1 4.06Å; V147-V395 HydrophobicContact CG2-CG1 4.02Å; H177-V395 HydrophobicContact CB-CG1 3.89Å; H177-V395 WeakPolarHBondContact CD2-CG1 3.39Å; V179-V395 HydrophobicContact CG2-CG2 4.48Å; I203-V395 HydrophobicContact CD1-CG2 4.11Å; R391-V395 PolarHBondContact O-N 3.43Å; T392-V395 WeakPolarHBondContact O-CA 3.39Å; T392-V395 WeakPolarHBondContact O-CB 3.44Å; T392-V395 PolarHBondContact O-N 3.11Å; E393-V395 VanDerWaalsContact C-N 3.26Å; E393-V395 PolarHBondContact O-N 2.86Å; V395-R398 PolarHBondContact O-N 3.36Å; V395-V399 HydrophobicContact CG1-CG1 4.41Å; V395-V399 WeakPolarHBondContact O-CG1 3.35Å; V395-V399 WeakPolarHBondContact O-CG2 3.21Å; V395-V399 PolarHBondContact O-N 3.48Å
396	Y	97.2	Very high	93.5	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.6	-43.7	176.3	-59.2	-31.3	0	0	0	112.8	I32 L57 V121 H123 V147 T392 E393 R398 V399 A400	I32-Y396 HydrophobicContact CD1-CD2 3.69Å; I32-Y396 HydrophobicContact CD1-CE2 3.39Å; I32-Y396 HydrophobicContact CG1-CD2 4.4Å; I32-Y396 HydrophobicContact CG1-CE2 4.18Å; L57-Y396 HydrophobicContact CD1-CE2 3.89Å; L57-Y396 HydrophobicContact CD2-CE2 4.01Å; V121-Y396 HydrophobicContact CG1-CD1 3.82Å; V121-Y396 HydrophobicContact CG1-CE1 3.94Å; H123-Y396 HydrophobicContact CB-CE1 4.4Å; H123-Y396 AromaticContact ND1-CZ 3.88Å; H123-Y396 PolarHBondContact ND1-OH 3.04Å; V147-Y396 HydrophobicContact CB-CE1 4.33Å; V147-Y396 HydrophobicContact CG2-CD1 3.99Å; V147-Y396 HydrophobicContact CG2-CE1 4.02Å; T392-Y396 HydrophobicContact CG2-CD2 4.39Å; T392-Y396 HydrophobicContact CG2-CE1 3.91Å; T392-Y396 HydrophobicContact CG2-CE2 3.66Å; T392-Y396 WeakPolarHBondContact CG2-OH 3.12Å; T392-Y396 PolarHBondContact O-N 3.36Å; E393-Y396 WeakPolarHBondContact O-CA 3.49Å; E393-Y396 WeakPolarHBondContact O-CB 3.47Å; E393-Y396 PolarHBondContact O-N 2.86Å; Y396-R398 VanDerWaalsContact C-N 3.33Å; Y396-R398 PolarHBondContact O-N 2.92Å; Y396-V399 WeakPolarHBondContact O-CG2 3.38Å; Y396-V399 PolarHBondContact O-N 3.19Å; Y396-A400 WeakPolarHBondContact O-CB 3.18Å; Y396-A400 PolarHBondContact O-N 2.96Å
397	D	95.9	Very high	93.4	Very high	55 Å²	55	48.2 Å²	48.2	29%	0.294	25%	0.248	S	C	.	.	H	α-helix	trans	-61.3	-42.3	176.7	-71.5	-22.5	0	0	0	111.8	H30 E393	H30-D397 IonicContact CD2-OD1 2.57Å; H30-D397 IonicContact CE1-OD1 3.02Å; H30-D397 IonicContact NE2-OD1 3.33Å; H30-D397 PolarHBondContact NE2-OD1 3.24Å; E393-D397 PolarHBondContact O-N 3.1Å
398	R	95	Very high	93.4	Very high	116 Å²	116	48.8 Å²	48.8	44%	0.438	25%	0.251	S	S	.	.	H	α-helix	trans	-60.6	-57.1	174.7	178	-179.6	174.7	176.5	0.7	111.4	E198 K394 V395 Y396 A400 G401 E402	E198-R398 PolarHBondContact O-NH1 3.03Å; E198-R398 VanDerWaalsContact O-NH1 3.14Å; E198-R398 PolarHBondContact O-NH2 3.38Å; E198-R398 VanDerWaalsContact O-NH2 3.16Å; K394-R398 WeakPolarHBondContact O-CB 3.3Å; K394-R398 PolarHBondContact O-N 3.31Å; V395-R398 PolarHBondContact O-N 3.36Å; Y396-R398 VanDerWaalsContact C-N 3.33Å; Y396-R398 PolarHBondContact O-N 2.92Å; R398-A400 PolarHBondContact O-N 3.3Å; R398-G401 PolarHBondContact O-N 2.88Å; R398-G401 VanDerWaalsContact O-N 3.08Å; R398-E402 IonicContact NE-OE1 3.63Å
399	V	95.3	Very high	93.2	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.7	-30	-174.8	-58.8	0	0	0	0	112	V121 N145 V147 N176 H177 V395 Y396 G401 E402	V121-V399 HydrophobicContact CG2-CG2 4.47Å; N145-V399 HydrophobicContact CB-CB 4.39Å; N145-V399 HydrophobicContact CB-CG2 4.11Å; N145-V399 PolarHBondContact ND2-O 3.15Å; V147-V399 HydrophobicContact CG2-CG1 4.23Å; V147-V399 HydrophobicContact CG2-CG2 4.02Å; N176-V399 HydrophobicContact CB-CB 3.91Å; N176-V399 HydrophobicContact CB-CG1 3.62Å; H177-V399 HydrophobicContact CB-CG1 3.47Å; H177-V399 VanDerWaalsContact CB-CG1 3.47Å; V395-V399 HydrophobicContact CG1-CG1 4.41Å; V395-V399 WeakPolarHBondContact O-CG1 3.35Å; V395-V399 WeakPolarHBondContact O-CG2 3.21Å; V395-V399 PolarHBondContact O-N 3.48Å; Y396-V399 WeakPolarHBondContact O-CG2 3.38Å; Y396-V399 PolarHBondContact O-N 3.19Å; V399-G401 PolarHBondContact O-N 2.77Å; V399-E402 WeakPolarHBondContact O-CB 3.36Å; V399-E402 PolarHBondContact O-N 2.94Å
400	A	93.3	Very high	93	Very high	13 Å²	13	54.2 Å²	54.2	11%	0.107	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-12	178.5	0	0	0	0	0	113.5	R28 Y396 R398	R28-A400 VanDerWaalsContact NH1-CB 3.26Å; R28-A400 PolarHBondContact NH1-O 3.02Å; Y396-A400 WeakPolarHBondContact O-CB 3.18Å; Y396-A400 PolarHBondContact O-N 2.96Å; R398-A400 PolarHBondContact O-N 3.3Å
401	G	89.8	Confident	92.9	Very high	69 Å²	69	51.3 Å²	51.3	71%	0.711	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-6.8	168.5	0	0	0	0	0	114	R398 V399	R398-G401 PolarHBondContact O-N 2.88Å; R398-G401 VanDerWaalsContact O-N 3.08Å; V399-G401 PolarHBondContact O-N 2.77Å
402	E	90.7	Very high	92.7	Very high	58 Å²	58	53.9 Å²	53.9	27%	0.271	27%	0.268	S	S	.	.	S	Bend	trans	-89.8	142	-178.5	-64.5	176.3	-176.6	0	0	111.9	N145 N176 R398 V399 V404	N145-E402 PolarHBondContact ND2-O 2.9Å; N176-E402 WeakPolarHBondContact CB-OE2 3.47Å; N176-E402 PolarHBondContact ND2-OE2 3.16Å; R398-E402 IonicContact NE-OE1 3.63Å; V399-E402 WeakPolarHBondContact O-CB 3.36Å; V399-E402 PolarHBondContact O-N 2.94Å; E402-V404 PolarHBondContact O-N 2.72Å
403	E	84.7	Confident	92.4	Very high	124 Å²	124	58.5 Å²	58.5	58%	0.579	29%	0.285	S	S	*	.	P	Polyproline II helix	trans	-67.8	126.6	172.8	-169.2	-171.9	179.1	0	0	110	L405 R409	E403-L405 PolarHBondContact O-N 2.94Å; E403-R409 IonicContact OE1-NH1 3.25Å; E403-R409 IonicContact OE2-CZ 2.87Å; E403-R409 IonicContact OE2-NH1 3.21Å; E403-R409 PolarHBondContact OE2-NH1 3.41Å
404	V	87.4	Confident	92.1	Very high	28 Å²	28	57.7 Å²	57.7	17%	0.17	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-74.5	122.9	166.7	-177.8	0	0	0	0	108	K140 E402	K140-V404 HydrophobicContact CD-CG1 3.99Å; E402-V404 PolarHBondContact O-N 2.72Å
405	L	87.6	Confident	91.8	Very high	28 Å²	28	57.3 Å²	57.3	15%	0.147	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-58	131.1	-172.4	-70.8	-171.5	0	0	0	112.1	E403 R409 R410 R413	E403-L405 PolarHBondContact O-N 2.94Å; L405-R409 HydrophobicContact CB-CB 4.29Å; L405-R409 HydrophobicContact CD1-CB 4.33Å; L405-R409 HydrophobicContact CD2-CB 4.13Å; L405-R410 HydrophobicContact CB-CB 4.41Å; L405-R413 VanDerWaalsContact CD1-NH1 3.34Å
406	P	90.1	Very high	91.5	Very high	48 Å²	48	61.5 Å²	61.5	31%	0.312	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-62.3	157.8	168.5	27.7	-35	0	0	0	110.6	D408 R409 R410	P406-D408 VanDerWaalsContact C-N 3.27Å; P406-D408 WeakPolarHBondContact CB-OD1 3.38Å; P406-D408 WeakPolarHBondContact CG-OD1 3.47Å; P406-D408 PolarHBondContact O-N 3.3Å; P406-D408 VanDerWaalsContact O-N 3.17Å; P406-R409 HydrophobicContact CG-CB 4.15Å; P406-R409 HydrophobicContact CG-CG 3.93Å; P406-R409 PolarHBondContact O-N 2.9Å; P406-R409 VanDerWaalsContact O-N 3.08Å; P406-R410 PolarHBondContact O-N 2.91Å
407	L	91.4	Very high	91	Very high	50 Å²	50	64.5 Å²	64.5	26%	0.262	32%	0.32	S	S	.	.	H	α-helix	trans	-52.9	-43	-173	-178.8	62.1	0	0	0	112.3	R409 R410 L411 F434	L407-R409 PolarHBondContact O-N 3.31Å; L407-R410 WeakPolarHBondContact O-CB 3.24Å; L407-R410 PolarHBondContact O-N 3.46Å; L407-L411 HydrophobicContact CD1-CD1 4.34Å; L407-L411 HydrophobicContact CD1-CD2 4.2Å; L407-L411 HydrophobicContact CD1-CG 4.07Å; L407-L411 HydrophobicContact CG-CD1 4.09Å; L407-L411 HydrophobicContact CG-CG 4.25Å; L407-L411 WeakPolarHBondContact O-CG 3.12Å; L407-L411 PolarHBondContact O-N 2.91Å; L407-F434 HydrophobicContact CD2-CB 4.12Å; L407-F434 HydrophobicContact CD2-CD1 3.76Å; L407-F434 HydrophobicContact CD2-CD2 4.38Å; L407-F434 HydrophobicContact CD2-CE1 4.25Å; L407-F434 HydrophobicContact CD2-CG 3.83Å
408	D	92.7	Very high	90.5	Very high	75 Å²	75	63 Å²	63	40%	0.401	31%	0.313	S	S	.	.	H	α-helix	trans	-61.9	-43.3	-179.3	73.7	-57.7	0	0	0	112.6	P406 R412	P406-D408 VanDerWaalsContact C-N 3.27Å; P406-D408 WeakPolarHBondContact CB-OD1 3.38Å; P406-D408 WeakPolarHBondContact CG-OD1 3.47Å; P406-D408 PolarHBondContact O-N 3.3Å; P406-D408 VanDerWaalsContact O-N 3.17Å; D408-R412 WeakPolarHBondContact O-CG 3.32Å; D408-R412 PolarHBondContact O-N 3.41Å; D408-R412 VanDerWaalsContact O-N 3.15Å; D408-R412 PolarHBondContact O-NH1 2.79Å; D408-R412 IonicContact OD2-CZ 3.26Å; D408-R412 VanDerWaalsContact OD2-CZ 3.26Å; D408-R412 IonicContact OD2-NH1 2.91Å; D408-R412 PolarHBondContact OD2-NH1 3.35Å; D408-R412 IonicContact OD2-NH2 2.71Å; D408-R412 PolarHBondContact OD2-NH2 3.21Å
409	R	92.2	Very high	90.1	Very high	109 Å²	109	58.6 Å²	58.6	41%	0.411	30%	0.304	S	S	.	.	H	α-helix	trans	-68.6	-39.2	175.6	-70	-172.9	-161.9	166	7.8	111.1	E403 L405 P406 L407 R412 R413	E403-R409 IonicContact OE1-NH1 3.25Å; E403-R409 IonicContact OE2-CZ 2.87Å; E403-R409 IonicContact OE2-NH1 3.21Å; E403-R409 PolarHBondContact OE2-NH1 3.41Å; L405-R409 HydrophobicContact CB-CB 4.29Å; L405-R409 HydrophobicContact CD1-CB 4.33Å; L405-R409 HydrophobicContact CD2-CB 4.13Å; P406-R409 HydrophobicContact CG-CB 4.15Å; P406-R409 HydrophobicContact CG-CG 3.93Å; P406-R409 PolarHBondContact O-N 2.9Å; P406-R409 VanDerWaalsContact O-N 3.08Å; L407-R409 PolarHBondContact O-N 3.31Å; R409-R412 VanDerWaalsContact CG-NH2 3.27Å; R409-R412 PolarHBondContact O-N 3.46Å; R409-R413 WeakPolarHBondContact O-CB 3.45Å; R409-R413 PolarHBondContact O-N 2.54Å
410	R	91.9	Very high	89.6	Confident	7 Å²	7	63.8 Å²	63.8	3%	0.026	34%	0.338	C	S	.	.	H	α-helix	trans	-60.3	-46.3	175.4	178.9	172.6	-176.5	-151.5	-1.2	111.8	F137 T141 D174 L405 P406 L407 R412 R413 L414	F137-R410 VanDerWaalsContact CD2-NH2 3.3Å; F137-R410 PolarHBondContact O-NH2 2.7Å; T141-R410 PolarHBondContact OG1-NH1 2.98Å; D174-R410 WeakPolarHBondContact OD2-CD 3.45Å; D174-R410 WeakPolarHBondContact OD2-CG 3.41Å; D174-R410 IonicContact OD2-NE 3.87Å; D174-R410 PolarHBondContact OD2-NE 2.97Å; L405-R410 HydrophobicContact CB-CB 4.41Å; P406-R410 PolarHBondContact O-N 2.91Å; L407-R410 WeakPolarHBondContact O-CB 3.24Å; L407-R410 PolarHBondContact O-N 3.46Å; R410-R412 PolarHBondContact O-N 2.89Å; R410-R413 PolarHBondContact O-N 3.34Å; R410-L414 HydrophobicContact CG-CD1 4.21Å; R410-L414 WeakPolarHBondContact O-CG 3.22Å; R410-L414 PolarHBondContact O-N 2.73Å
411	L	93.1	Very high	89.2	Confident	31 Å²	31	68.3 Å²	68.3	16%	0.162	36%	0.364	C	S	.	.	H	α-helix	trans	-62.8	-41.1	177.1	-64.7	175.2	0	0	0	112	L407 L414 R415 A427 A430 V431	L407-L411 HydrophobicContact CD1-CD1 4.34Å; L407-L411 HydrophobicContact CD1-CD2 4.2Å; L407-L411 HydrophobicContact CD1-CG 4.07Å; L407-L411 HydrophobicContact CG-CD1 4.09Å; L407-L411 HydrophobicContact CG-CG 4.25Å; L407-L411 WeakPolarHBondContact O-CG 3.12Å; L407-L411 PolarHBondContact O-N 2.91Å; L411-L414 PolarHBondContact O-N 3.3Å; L411-R415 WeakPolarHBondContact O-CG 3.31Å; L411-R415 PolarHBondContact O-N 2.77Å; L411-R415 VanDerWaalsContact O-N 3.14Å; L411-A427 HydrophobicContact CD2-CB 3.72Å; L411-A427 WeakPolarHBondContact CD2-O 3.46Å; L411-A430 HydrophobicContact CD2-CB 3.94Å; L411-V431 HydrophobicContact CD1-CG2 3.83Å; L411-V431 HydrophobicContact CD2-CG2 3.86Å
412	R	92	Very high	89	Confident	140 Å²	140	66.4 Å²	66.4	53%	0.528	34%	0.342	S	S	.	.	H	α-helix	trans	-61.7	-45.5	174.3	-74.2	-168.9	-66.3	-84.2	5.1	111.4	D408 R409 R410 R415 S416	D408-R412 WeakPolarHBondContact O-CG 3.32Å; D408-R412 PolarHBondContact O-N 3.41Å; D408-R412 VanDerWaalsContact O-N 3.15Å; D408-R412 PolarHBondContact O-NH1 2.79Å; D408-R412 IonicContact OD2-CZ 3.26Å; D408-R412 VanDerWaalsContact OD2-CZ 3.26Å; D408-R412 IonicContact OD2-NH1 2.91Å; D408-R412 PolarHBondContact OD2-NH1 3.35Å; D408-R412 IonicContact OD2-NH2 2.71Å; D408-R412 PolarHBondContact OD2-NH2 3.21Å; R409-R412 VanDerWaalsContact CG-NH2 3.27Å; R409-R412 PolarHBondContact O-N 3.46Å; R410-R412 PolarHBondContact O-N 2.89Å; R412-R415 PolarHBondContact O-N 3.38Å; R412-S416 WeakPolarHBondContact O-CB 3.46Å; R412-S416 PolarHBondContact O-N 3.42Å; R412-S416 PolarHBondContact O-OG 3.19Å
413	R	90.8	Very high	88.8	Confident	100 Å²	100	63.7 Å²	63.7	38%	0.377	33%	0.329	S	S	.	.	H	α-helix	trans	-61.1	-45	178.1	-177.1	174.6	-76.9	-176.5	-7	112.1	C173 D174 L405 R409 R410 R415 S416 H417	C173-R413 WeakPolarHBondContact O-CD 3.36Å; D174-R413 IonicContact OD1-NH1 3.93Å; L405-R413 VanDerWaalsContact CD1-NH1 3.34Å; R409-R413 WeakPolarHBondContact O-CB 3.45Å; R409-R413 PolarHBondContact O-N 2.54Å; R410-R413 PolarHBondContact O-N 3.34Å; R413-R415 VanDerWaalsContact C-N 3.34Å; R413-R415 PolarHBondContact O-N 3.4Å; R413-S416 PolarHBondContact O-N 3.09Å; R413-S416 PolarHBondContact O-OG 3.31Å; R413-H417 WeakPolarHBondContact O-CB 3.49Å; R413-H417 PolarHBondContact O-N 3.04Å
414	L	90.4	Very high	89.1	Confident	3 Å²	3	60.3 Å²	60.3	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-58.7	-45	176.3	-75.4	165.2	0	0	0	111.7	V170 R410 L411 C418 G423 F426 A430	V170-L414 HydrophobicContact CG1-CD2 4.2Å; R410-L414 HydrophobicContact CG-CD1 4.21Å; R410-L414 WeakPolarHBondContact O-CG 3.22Å; R410-L414 PolarHBondContact O-N 2.73Å; L411-L414 PolarHBondContact O-N 3.3Å; L414-C418 WeakPolarHBondContact O-CB 3.49Å; L414-C418 PolarHBondContact O-N 3.48Å; L414-G423 VanDerWaalsContact O-CA 3.24Å; L414-G423 WeakPolarHBondContact O-CA 3.41Å; L414-F426 HydrophobicContact CD2-CB 4.25Å; L414-A430 HydrophobicContact CD1-CB 4.01Å
415	R	90.6	Very high	89.2	Confident	140 Å²	140	63.7 Å²	63.7	53%	0.528	34%	0.335	S	S	.	.	H	α-helix	trans	-68.2	-42	178.7	-70.2	177.3	-177.8	178.2	1.1	113.1	L411 R412 R413 G419 A427	L411-R415 WeakPolarHBondContact O-CG 3.31Å; L411-R415 PolarHBondContact O-N 2.77Å; L411-R415 VanDerWaalsContact O-N 3.14Å; R412-R415 PolarHBondContact O-N 3.38Å; R413-R415 VanDerWaalsContact C-N 3.34Å; R413-R415 PolarHBondContact O-N 3.4Å; R415-G419 CarbonylContact O-C 3.44Å; R415-G419 PolarHBondContact O-N 3.31Å; R415-A427 HydrophobicContact CG-CB 4.25Å
416	S	89.3	Confident	89.2	Confident	98 Å²	98	64.5 Å²	64.5	69%	0.685	34%	0.337	S	S	*	.	H	α-helix	trans	-73.2	-38	-178.5	64.5	0	0	0	0	112.4	R412 R413	R412-S416 WeakPolarHBondContact O-CB 3.46Å; R412-S416 PolarHBondContact O-N 3.42Å; R412-S416 PolarHBondContact O-OG 3.19Å; R413-S416 PolarHBondContact O-N 3.09Å; R413-S416 PolarHBondContact O-OG 3.31Å
417	H	87.7	Confident	89.3	Confident	63 Å²	63	62.2 Å²	62.2	29%	0.292	32%	0.323	S	S	.	.	H	α-helix	trans	-90	-34.6	-172	-160.7	-55.6	0	0	0	113.3	C173 A193 A194 R413	C173-H417 HydrophobicContact CB-CB 4.31Å; A193-H417 PolarHBondContact O-CE1 2.93Å; A193-H417 VanDerWaalsContact O-CE1 3.31Å; A194-H417 PolarHBondContact O-CE1 3.28Å; A194-H417 PolarHBondContact O-NE2 2.68Å; A194-H417 VanDerWaalsContact O-NE2 3.09Å; R413-H417 WeakPolarHBondContact O-CB 3.49Å; R413-H417 PolarHBondContact O-N 3.04Å
418	C	85.1	Confident	89.3	Confident	22 Å²	22	64.8 Å²	64.8	15%	0.149	34%	0.336	C	S	.	.	S	Bend	trans	-96.5	0.8	-179.1	-51.9	0	0	0	0	113	V170 L414	V170-C418 HydrophobicContact CG2-CB 4.1Å; L414-C418 WeakPolarHBondContact O-CB 3.49Å; L414-C418 PolarHBondContact O-N 3.48Å
419	G	85.8	Confident	89.2	Confident	25 Å²	25	62.2 Å²	62.2	26%	0.258	32%	0.324	S	S	.	.			trans	80.6	172.2	-177.9	0	0	0	0	0	114.1	R415 V421 G423	R415-G419 CarbonylContact O-C 3.44Å; R415-G419 PolarHBondContact O-N 3.31Å; G419-V421 PolarHBondContact O-N 2.87Å; G419-G423 VanDerWaalsContact O-CA 3.22Å; G419-G423 WeakPolarHBondContact O-CA 3.47Å; G419-G423 PolarHBondContact O-N 3.47Å
420	P	84.4	Confident	89.2	Confident	108 Å²	108	57 Å²	57	70%	0.701	31%	0.305	S	S	*	.	H	α-helix	trans	-67	-36	-166.5	24	-33.8	0	0	0	113.8	S424	P420-S424 WeakPolarHBondContact O-CB 3.49Å; P420-S424 PolarHBondContact O-N 2.95Å; P420-S424 PolarHBondContact O-OG 3.29Å
421	V	86.5	Confident	89.3	Confident	109 Å²	109	59 Å²	59	66%	0.661	32%	0.317	S	S	*	.	H	α-helix	trans	-82.4	-64.1	-177.6	-178.4	0	0	0	0	110.8	G419 G423 S424 I425	G419-V421 PolarHBondContact O-N 2.87Å; V421-G423 PolarHBondContact O-N 3.34Å; V421-S424 PolarHBondContact O-N 3.46Å; V421-I425 HydrophobicContact CG1-CD1 4.26Å; V421-I425 WeakPolarHBondContact O-CG1 3.44Å; V421-I425 PolarHBondContact O-N 3.19Å; V421-I425 VanDerWaalsContact O-N 3.12Å
422	A	83.9	Confident	89.3	Confident	29 Å²	29	61.3 Å²	61.3	24%	0.24	33%	0.329	C	S	.	.	H	α-helix	trans	-63.4	-42.4	-177.4	0	0	0	0	0	111.6	S424 I425 F426	A422-S424 VanDerWaalsContact C-N 3.29Å; A422-S424 PolarHBondContact O-N 2.9Å; A422-I425 PolarHBondContact O-N 2.61Å; A422-F426 VanDerWaalsContact O-CD2 3.26Å; A422-F426 WeakPolarHBondContact O-CD2 3.1Å; A422-F426 PolarHBondContact O-N 3.26Å
423	G	88.1	Confident	89.4	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.7	-33.5	176.1	0	0	0	0	0	113.6	L414 G419 V421 A427	L414-G423 VanDerWaalsContact O-CA 3.24Å; L414-G423 WeakPolarHBondContact O-CA 3.41Å; G419-G423 VanDerWaalsContact O-CA 3.22Å; G419-G423 WeakPolarHBondContact O-CA 3.47Å; G419-G423 PolarHBondContact O-N 3.47Å; V421-G423 PolarHBondContact O-N 3.34Å; G423-A427 WeakPolarHBondContact O-CB 3.42Å; G423-A427 PolarHBondContact O-N 2.66Å
424	S	90	Very high	89.5	Confident	54 Å²	54	53.1 Å²	53.1	38%	0.378	30%	0.3	S	S	.	.	H	α-helix	trans	-71	-39.3	174.5	-65.7	0	0	0	0	112.6	P420 V421 A422 A427 L428	P420-S424 WeakPolarHBondContact O-CB 3.49Å; P420-S424 PolarHBondContact O-N 2.95Å; P420-S424 PolarHBondContact O-OG 3.29Å; V421-S424 PolarHBondContact O-N 3.46Å; A422-S424 VanDerWaalsContact C-N 3.29Å; A422-S424 PolarHBondContact O-N 2.9Å; S424-A427 PolarHBondContact O-N 3.33Å; S424-L428 PolarHBondContact O-N 3.09Å
425	I	89.4	Confident	89.7	Confident	98 Å²	98	57.6 Å²	57.6	50%	0.503	32%	0.324	S	S	.	.	H	α-helix	trans	-61.4	-50.6	175.4	-66.6	165.3	0	0	0	110	V421 A422 A427 L428 C429	V421-I425 HydrophobicContact CG1-CD1 4.26Å; V421-I425 WeakPolarHBondContact O-CG1 3.44Å; V421-I425 PolarHBondContact O-N 3.19Å; V421-I425 VanDerWaalsContact O-N 3.12Å; A422-I425 PolarHBondContact O-N 2.61Å; I425-A427 PolarHBondContact O-N 3.15Å; I425-L428 WeakPolarHBondContact O-CB 3.43Å; I425-L428 PolarHBondContact O-N 3.1Å; I425-L428 VanDerWaalsContact O-N 3.17Å; I425-C429 PolarHBondContact O-N 2.57Å; I425-C429 PolarHBondContact O-SG 3.03Å; I425-C429 VanDerWaalsContact O-SG 3.35Å
426	F	88.4	Confident	89.9	Confident	45 Å²	45	54 Å²	54	20%	0.197	31%	0.312	C	S	.	.	H	α-helix	trans	-73.2	-27.7	-179	-75	-74.1	0	0	0	113.6	V170 L414 A422 L428 C429 A430	V170-F426 HydrophobicContact CB-CD2 4.06Å; V170-F426 HydrophobicContact CB-CE2 4.03Å; V170-F426 HydrophobicContact CB-CG 4.36Å; V170-F426 HydrophobicContact CB-CZ 4.27Å; V170-F426 HydrophobicContact CG1-CB 3.81Å; V170-F426 HydrophobicContact CG1-CD1 3.5Å; V170-F426 VanDerWaalsContact CG1-CD1 3.5Å; V170-F426 HydrophobicContact CG1-CD2 3.49Å; V170-F426 VanDerWaalsContact CG1-CD2 3.49Å; V170-F426 HydrophobicContact CG1-CE1 3.79Å; V170-F426 HydrophobicContact CG1-CE2 3.82Å; V170-F426 HydrophobicContact CG1-CG 3.32Å; V170-F426 HydrophobicContact CG1-CZ 3.94Å; V170-F426 HydrophobicContact CG2-CD2 3.47Å; V170-F426 VanDerWaalsContact CG2-CD2 3.47Å; V170-F426 HydrophobicContact CG2-CE2 3.43Å; V170-F426 VanDerWaalsContact CG2-CE2 3.43Å; V170-F426 HydrophobicContact CG2-CG 4.22Å; V170-F426 HydrophobicContact CG2-CZ 4.13Å; L414-F426 HydrophobicContact CD2-CB 4.25Å; A422-F426 VanDerWaalsContact O-CD2 3.26Å; A422-F426 WeakPolarHBondContact O-CD2 3.1Å; A422-F426 PolarHBondContact O-N 3.26Å; F426-L428 VanDerWaalsContact C-N 3.35Å; F426-C429 PolarHBondContact O-N 3.11Å; F426-A430 WeakPolarHBondContact O-CB 3.42Å; F426-A430 PolarHBondContact O-N 2.94Å
427	A	91.4	Very high	90.2	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.008	28%	0.279	C	S	.	.	H	α-helix	trans	-62.4	-43	167.7	0	0	0	0	0	111	L411 R415 G423 S424 I425 A430 V431	L411-A427 HydrophobicContact CD2-CB 3.72Å; L411-A427 WeakPolarHBondContact CD2-O 3.46Å; R415-A427 HydrophobicContact CG-CB 4.25Å; G423-A427 WeakPolarHBondContact O-CB 3.42Å; G423-A427 PolarHBondContact O-N 2.66Å; S424-A427 PolarHBondContact O-N 3.33Å; I425-A427 PolarHBondContact O-N 3.15Å; A427-A430 PolarHBondContact O-N 2.83Å; A427-V431 WeakPolarHBondContact O-CG2 3.3Å; A427-V431 PolarHBondContact O-N 3.02Å
428	L	92.1	Very high	90.5	Very high	103 Å²	103	50 Å²	50	54%	0.539	29%	0.285	S	S	.	.	H	α-helix	trans	-61.6	-44.9	172.8	178.5	64	0	0	0	111.1	S424 I425 F426 A430 V431 L432	S424-L428 PolarHBondContact O-N 3.09Å; I425-L428 WeakPolarHBondContact O-CB 3.43Å; I425-L428 PolarHBondContact O-N 3.1Å; I425-L428 VanDerWaalsContact O-N 3.17Å; F426-L428 VanDerWaalsContact C-N 3.35Å; L428-A430 VanDerWaalsContact C-N 3.27Å; L428-A430 PolarHBondContact O-N 3.25Å; L428-V431 PolarHBondContact O-N 3.04Å; L428-L432 HydrophobicContact CD1-CD1 4.48Å; L428-L432 HydrophobicContact CD1-CG 4.33Å; L428-L432 HydrophobicContact CG-CD1 4.16Å; L428-L432 HydrophobicContact CG-CG 4.43Å; L428-L432 WeakPolarHBondContact O-CG 3.37Å; L428-L432 PolarHBondContact O-N 3.24Å
429	C	90.8	Very high	91	Very high	22 Å²	22	52.9 Å²	52.9	15%	0.149	30%	0.298	C	S	.	.	H	α-helix	trans	-56.8	-41	174	-63.9	0	0	0	0	112.1	F104 F137 I425 F426 L432 D433	F104-C429 HydrophobicContact CZ-CB 4.34Å; F137-C429 HydrophobicContact CZ-CB 4.14Å; I425-C429 PolarHBondContact O-N 2.57Å; I425-C429 PolarHBondContact O-SG 3.03Å; I425-C429 VanDerWaalsContact O-SG 3.35Å; F426-C429 PolarHBondContact O-N 3.11Å; C429-L432 PolarHBondContact O-N 2.93Å; C429-D433 VanDerWaalsContact O-CB 3.3Å; C429-D433 WeakPolarHBondContact O-CB 3.44Å; C429-D433 PolarHBondContact O-N 3.17Å
430	A	91.8	Very high	91.4	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-67.3	-36.5	179	0	0	0	0	0	112.2	F137 L411 L414 F426 A427 L428 F434	F137-A430 HydrophobicContact CE2-CB 4.41Å; F137-A430 HydrophobicContact CZ-CB 3.79Å; L411-A430 HydrophobicContact CD2-CB 3.94Å; L414-A430 HydrophobicContact CD1-CB 4.01Å; F426-A430 WeakPolarHBondContact O-CB 3.42Å; F426-A430 PolarHBondContact O-N 2.94Å; A427-A430 PolarHBondContact O-N 2.83Å; L428-A430 VanDerWaalsContact C-N 3.27Å; L428-A430 PolarHBondContact O-N 3.25Å; A430-F434 WeakPolarHBondContact O-CB 3.47Å; A430-F434 PolarHBondContact O-N 2.93Å
431	V	94.3	Very high	91.9	Very high	48 Å²	48	51.9 Å²	51.9	29%	0.291	27%	0.274	S	S	.	.	H	α-helix	trans	-65.3	-47.8	172.5	173.5	0	0	0	0	110.6	L411 A427 L428 D433 F434 L435	L411-V431 HydrophobicContact CD1-CG2 3.83Å; L411-V431 HydrophobicContact CD2-CG2 3.86Å; A427-V431 WeakPolarHBondContact O-CG2 3.3Å; A427-V431 PolarHBondContact O-N 3.02Å; L428-V431 PolarHBondContact O-N 3.04Å; V431-D433 VanDerWaalsContact C-N 3.3Å; V431-D433 PolarHBondContact O-N 3.44Å; V431-F434 PolarHBondContact O-N 3.06Å; V431-L435 HydrophobicContact CG1-CD1 4.06Å; V431-L435 HydrophobicContact CG1-CG 4.38Å; V431-L435 WeakPolarHBondContact O-CG 3.2Å; V431-L435 PolarHBondContact O-N 3.04Å
432	L	93.5	Very high	92.3	Very high	79 Å²	79	56 Å²	56	41%	0.414	28%	0.278	S	S	.	.	H	α-helix	trans	-61.3	-39.9	178.3	-68.2	175.4	0	0	0	111.7	F104 L428 C429 L435 F436	F104-L432 HydrophobicContact CE1-CB 3.73Å; F104-L432 HydrophobicContact CZ-CB 3.79Å; F104-L432 HydrophobicContact CZ-CD1 4.23Å; L428-L432 HydrophobicContact CD1-CD1 4.48Å; L428-L432 HydrophobicContact CD1-CG 4.33Å; L428-L432 HydrophobicContact CG-CD1 4.16Å; L428-L432 HydrophobicContact CG-CG 4.43Å; L428-L432 WeakPolarHBondContact O-CG 3.37Å; L428-L432 PolarHBondContact O-N 3.24Å; C429-L432 PolarHBondContact O-N 2.93Å; L432-L435 PolarHBondContact O-N 3.3Å; L432-F436 WeakPolarHBondContact O-CB 3.45Å; L432-F436 PolarHBondContact O-N 3.09Å
433	D	92.6	Very high	92.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-66.2	-40.6	178.5	-167.3	54.8	0	0	0	110.9	F104 L107 F137 H138 T141 C429 V431 F436 L437	F104-D433 HydrophobicContact CD1-CB 4.28Å; F104-D433 HydrophobicContact CE1-CB 3.93Å; L107-D433 WeakPolarHBondContact CD2-OD1 3.39Å; F137-D433 HydrophobicContact CD1-CB 4.5Å; F137-D433 HydrophobicContact CE1-CB 3.82Å; H138-D433 IonicContact CE1-OD1 2.94Å; H138-D433 PolarHBondContact CE1-OD1 3.08Å; H138-D433 IonicContact CE1-OD2 3.11Å; H138-D433 IonicContact ND1-OD1 3.04Å; H138-D433 PolarHBondContact ND1-OD1 2.86Å; H138-D433 IonicContact ND1-OD2 3.03Å; H138-D433 PolarHBondContact ND1-OD2 3.25Å; H138-D433 VanDerWaalsContact ND1-OD2 3.11Å; T141-D433 WeakPolarHBondContact CB-OD2 3.21Å; T141-D433 HydrophobicContact CG2-CB 4.47Å; T141-D433 WeakPolarHBondContact CG2-OD2 3.39Å; T141-D433 PolarHBondContact OG1-OD2 3.47Å; C429-D433 VanDerWaalsContact O-CB 3.3Å; C429-D433 WeakPolarHBondContact O-CB 3.44Å; C429-D433 PolarHBondContact O-N 3.17Å; V431-D433 VanDerWaalsContact C-N 3.3Å; V431-D433 PolarHBondContact O-N 3.44Å; D433-F436 PolarHBondContact O-N 3.18Å; D433-L437 WeakPolarHBondContact O-CB 3.18Å; D433-L437 PolarHBondContact O-N 3.44Å
434	F	94.3	Very high	92.9	Very high	69 Å²	69	62.2 Å²	62.2	30%	0.303	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-44.6	174.4	-175.7	-100.8	0	0	0	112.5	T141 L407 A430 V431 F436 L437 L438	T141-F434 HydrophobicContact CG2-CB 4.06Å; T141-F434 HydrophobicContact CG2-CD2 4.15Å; L407-F434 HydrophobicContact CD2-CB 4.12Å; L407-F434 HydrophobicContact CD2-CD1 3.76Å; L407-F434 HydrophobicContact CD2-CD2 4.38Å; L407-F434 HydrophobicContact CD2-CE1 4.25Å; L407-F434 HydrophobicContact CD2-CG 3.83Å; A430-F434 WeakPolarHBondContact O-CB 3.47Å; A430-F434 PolarHBondContact O-N 2.93Å; V431-F434 PolarHBondContact O-N 3.06Å; F434-F436 VanDerWaalsContact C-N 3.3Å; F434-F436 PolarHBondContact O-N 3.19Å; F434-L437 WeakPolarHBondContact O-CB 3.48Å; F434-L437 PolarHBondContact O-N 3.37Å; F434-L438 HydrophobicContact CD1-CD1 4.14Å; F434-L438 HydrophobicContact CD1-CG 4.41Å; F434-L438 HydrophobicContact CE1-CD1 3.72Å; F434-L438 HydrophobicContact CE1-CD2 4.42Å; F434-L438 HydrophobicContact CE1-CG 4.1Å; F434-L438 HydrophobicContact CZ-CD1 4.4Å; F434-L438 HydrophobicContact CZ-CD2 4.3Å; F434-L438 HydrophobicContact CZ-CG 4.42Å; F434-L438 WeakPolarHBondContact O-CG 3.48Å; F434-L438 PolarHBondContact O-N 3.23Å
435	L	94.9	Very high	93	Very high	97 Å²	97	61.3 Å²	61.3	51%	0.508	31%	0.306	S	S	.	.	H	α-helix	trans	-62	-39.9	175	-69.6	175.2	0	0	0	111.4	V431 L432 L438 L439	V431-L435 HydrophobicContact CG1-CD1 4.06Å; V431-L435 HydrophobicContact CG1-CG 4.38Å; V431-L435 WeakPolarHBondContact O-CG 3.2Å; V431-L435 PolarHBondContact O-N 3.04Å; L432-L435 PolarHBondContact O-N 3.3Å; L435-L438 HydrophobicContact CD2-CD1 4.48Å; L435-L438 WeakPolarHBondContact O-CB 3.48Å; L435-L438 PolarHBondContact O-N 2.91Å; L435-L439 PolarHBondContact O-N 3.4Å
436	F	94.7	Very high	93	Very high	63 Å²	63	58.9 Å²	58.9	28%	0.276	29%	0.294	S	S	.	.	H	α-helix	trans	-66.3	-39.1	175.9	-172.7	-140.1	0	0	0	111.6	F104 L107 P108 L432 D433 F434 L438 L439 L440	F104-F436 HydrophobicContact CB-CD1 4.44Å; F104-F436 WeakPolarHBondContact O-CE1 3.47Å; L107-F436 HydrophobicContact CB-CD1 4.33Å; L107-F436 HydrophobicContact CB-CE1 4.29Å; L107-F436 HydrophobicContact CD2-CB 4.39Å; L107-F436 HydrophobicContact CD2-CD1 3.57Å; L107-F436 HydrophobicContact CD2-CE1 4.21Å; L107-F436 HydrophobicContact CD2-CG 4.25Å; L107-F436 HydrophobicContact CG-CD1 4.47Å; P108-F436 HydrophobicContact CG-CE1 3.91Å; P108-F436 HydrophobicContact CG-CZ 3.85Å; L432-F436 WeakPolarHBondContact O-CB 3.45Å; L432-F436 PolarHBondContact O-N 3.09Å; D433-F436 PolarHBondContact O-N 3.18Å; F434-F436 VanDerWaalsContact C-N 3.3Å; F434-F436 PolarHBondContact O-N 3.19Å; F436-L438 VanDerWaalsContact C-N 3.33Å; F436-L438 PolarHBondContact O-N 2.71Å; F436-L439 HydrophobicContact CD2-CD2 4.16Å; F436-L439 HydrophobicContact CE2-CD2 4.37Å; F436-L439 WeakPolarHBondContact O-CB 3.48Å; F436-L439 PolarHBondContact O-N 3.15Å; F436-L440 HydrophobicContact CD1-CD1 4.27Å; F436-L440 HydrophobicContact CD2-CG 4.31Å; F436-L440 HydrophobicContact CE1-CD1 4.05Å; F436-L440 HydrophobicContact CE2-CD1 4.42Å; F436-L440 HydrophobicContact CE2-CD2 4.06Å; F436-L440 HydrophobicContact CE2-CG 4.07Å; F436-L440 HydrophobicContact CZ-CD1 4.13Å; F436-L440 HydrophobicContact CZ-CD2 4.08Å; F436-L440 HydrophobicContact CZ-CG 4.2Å; F436-L440 VanDerWaalsContact O-CG 3.31Å; F436-L440 WeakPolarHBondContact O-CG 3.11Å; F436-L440 PolarHBondContact O-N 2.94Å
437	L	94.6	Very high	93	Very high	0 Å²	0	66.8 Å²	66.8	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-59.2	-42.6	171.4	175.5	61.5	0	0	0	112	L107 T141 L142 D433 F434 L439 L440 R441	L107-L437 HydrophobicContact CD2-CB 4.28Å; T141-L437 HydrophobicContact CG2-CB 4.2Å; T141-L437 HydrophobicContact CG2-CD2 3.86Å; T141-L437 WeakPolarHBondContact O-CD2 3.24Å; L142-L437 HydrophobicContact CD2-CD1 3.53Å; L142-L437 HydrophobicContact CD2-CD2 3.87Å; L142-L437 HydrophobicContact CD2-CG 4.38Å; L142-L437 HydrophobicContact CG-CD1 4.37Å; L142-L437 HydrophobicContact CG-CD2 4.23Å; D433-L437 WeakPolarHBondContact O-CB 3.18Å; D433-L437 PolarHBondContact O-N 3.44Å; F434-L437 WeakPolarHBondContact O-CB 3.48Å; F434-L437 PolarHBondContact O-N 3.37Å; L437-L439 VanDerWaalsContact C-N 3.34Å; L437-L440 PolarHBondContact O-N 2.8Å; L437-R441 HydrophobicContact CD1-CG 4.23Å; L437-R441 WeakPolarHBondContact O-CB 3.24Å; L437-R441 WeakPolarHBondContact O-CG 3.22Å; L437-R441 PolarHBondContact O-N 2.91Å
438	L	95.1	Very high	92.8	Very high	78 Å²	78	73.1 Å²	73.1	41%	0.408	35%	0.352	S	S	.	.	H	α-helix	trans	-61.5	-43.5	176.1	-67.9	180	0	0	0	111.5	F434 L435 F436 R441 W442	F434-L438 HydrophobicContact CD1-CD1 4.14Å; F434-L438 HydrophobicContact CD1-CG 4.41Å; F434-L438 HydrophobicContact CE1-CD1 3.72Å; F434-L438 HydrophobicContact CE1-CD2 4.42Å; F434-L438 HydrophobicContact CE1-CG 4.1Å; F434-L438 HydrophobicContact CZ-CD1 4.4Å; F434-L438 HydrophobicContact CZ-CD2 4.3Å; F434-L438 HydrophobicContact CZ-CG 4.42Å; F434-L438 WeakPolarHBondContact O-CG 3.48Å; F434-L438 PolarHBondContact O-N 3.23Å; L435-L438 HydrophobicContact CD2-CD1 4.48Å; L435-L438 WeakPolarHBondContact O-CB 3.48Å; L435-L438 PolarHBondContact O-N 2.91Å; F436-L438 VanDerWaalsContact C-N 3.33Å; F436-L438 PolarHBondContact O-N 2.71Å; L438-R441 PolarHBondContact O-N 3.17Å; L438-W442 WeakPolarHBondContact O-CB 3.45Å; L438-W442 PolarHBondContact O-N 3.03Å
439	L	95.3	Very high	92.7	Very high	83 Å²	83	69.5 Å²	69.5	44%	0.435	33%	0.333	S	S	.	.	H	α-helix	trans	-59.7	-46.1	174.4	179.8	66.7	0	0	0	111.5	L435 F436 L437 R441 W442 L443	L435-L439 PolarHBondContact O-N 3.4Å; F436-L439 HydrophobicContact CD2-CD2 4.16Å; F436-L439 HydrophobicContact CE2-CD2 4.37Å; F436-L439 WeakPolarHBondContact O-CB 3.48Å; F436-L439 PolarHBondContact O-N 3.15Å; L437-L439 VanDerWaalsContact C-N 3.34Å; L439-R441 PolarHBondContact O-N 3.34Å; L439-W442 HydrophobicContact CD1-CE3 4.05Å; L439-W442 HydrophobicContact CD1-CZ3 4.47Å; L439-W442 WeakPolarHBondContact O-CB 3.48Å; L439-W442 PolarHBondContact O-N 3.49Å; L439-L443 HydrophobicContact CD1-CD1 4.36Å; L439-L443 HydrophobicContact CD1-CG 4.45Å; L439-L443 HydrophobicContact CG-CD1 4.11Å; L439-L443 WeakPolarHBondContact O-CG 3.39Å; L439-L443 PolarHBondContact O-N 3.43Å
440	L	93.5	Very high	92.6	Very high	22 Å²	22	73.1 Å²	73.1	12%	0.115	35%	0.35	C	S	.	.	H	α-helix	trans	-63.9	-38.6	178.6	-69.5	173.9	0	0	0	112.6	L107 P108 F436 L437 W442 L443 A444	L107-L440 HydrophobicContact CD2-CD1 3.78Å; L107-L440 HydrophobicContact CG-CD1 3.91Å; P108-L440 HydrophobicContact CB-CD1 4.24Å; P108-L440 HydrophobicContact CB-CD2 4.22Å; P108-L440 HydrophobicContact CG-CD1 4Å; P108-L440 HydrophobicContact CG-CD2 4.14Å; F436-L440 HydrophobicContact CD1-CD1 4.27Å; F436-L440 HydrophobicContact CD2-CG 4.31Å; F436-L440 HydrophobicContact CE1-CD1 4.05Å; F436-L440 HydrophobicContact CE2-CD1 4.42Å; F436-L440 HydrophobicContact CE2-CD2 4.06Å; F436-L440 HydrophobicContact CE2-CG 4.07Å; F436-L440 HydrophobicContact CZ-CD1 4.13Å; F436-L440 HydrophobicContact CZ-CD2 4.08Å; F436-L440 HydrophobicContact CZ-CG 4.2Å; F436-L440 VanDerWaalsContact O-CG 3.31Å; F436-L440 WeakPolarHBondContact O-CG 3.11Å; F436-L440 PolarHBondContact O-N 2.94Å; L437-L440 PolarHBondContact O-N 2.8Å; L440-W442 VanDerWaalsContact C-N 3.32Å; L440-L443 PolarHBondContact O-N 3.29Å; L440-A444 PolarHBondContact O-N 3.39Å
441	R	94.9	Very high	92.5	Very high	90 Å²	90	76.7 Å²	76.7	34%	0.34	37%	0.368	S	S	.	.	H	α-helix	trans	-68.2	-32.3	174.8	-80.2	179.8	161.7	158.9	1.4	112.5	L437 L438 L439 P445 D446	L437-R441 HydrophobicContact CD1-CG 4.23Å; L437-R441 WeakPolarHBondContact O-CB 3.24Å; L437-R441 WeakPolarHBondContact O-CG 3.22Å; L437-R441 PolarHBondContact O-N 2.91Å; L438-R441 PolarHBondContact O-N 3.17Å; L439-R441 PolarHBondContact O-N 3.34Å; R441-P445 VanDerWaalsContact O-CA 3.22Å; R441-P445 WeakPolarHBondContact O-CA 3.48Å; R441-D446 IonicContact CZ-OD2 3.18Å; R441-D446 IonicContact NE-OD2 3.62Å; R441-D446 PolarHBondContact NE-OD2 2.94Å; R441-D446 IonicContact NH2-OD2 3.63Å; R441-D446 PolarHBondContact NH2-OD2 3.21Å
442	W	94.8	Very high	92.1	Very high	195 Å²	195	74.9 Å²	74.9	74%	0.739	36%	0.359	S	S	*	.	H	α-helix	trans	-70	-45.7	173.4	178.1	74.8	0	0	0	111.6	L438 L439 L440	L438-W442 WeakPolarHBondContact O-CB 3.45Å; L438-W442 PolarHBondContact O-N 3.03Å; L439-W442 HydrophobicContact CD1-CE3 4.05Å; L439-W442 HydrophobicContact CD1-CZ3 4.47Å; L439-W442 WeakPolarHBondContact O-CB 3.48Å; L439-W442 PolarHBondContact O-N 3.49Å; L440-W442 VanDerWaalsContact C-N 3.32Å
443	L	93	Very high	91.2	Very high	111 Å²	111	75.4 Å²	75.4	58%	0.581	37%	0.365	S	S	*	.	H	α-helix	trans	-67.7	-42.8	178.8	-70.9	173.1	0	0	0	113.2	L439 L440	L439-L443 HydrophobicContact CD1-CD1 4.36Å; L439-L443 HydrophobicContact CD1-CG 4.45Å; L439-L443 HydrophobicContact CG-CD1 4.11Å; L439-L443 WeakPolarHBondContact O-CG 3.39Å; L439-L443 PolarHBondContact O-N 3.43Å; L440-L443 PolarHBondContact O-N 3.29Å
444	A	91.4	Very high	90.3	Very high	49 Å²	49	79 Å²	79	41%	0.405	38%	0.384	S	S	.	.	S	Bend	trans	-138.7	85.4	-177.2	0	0	0	0	0	109.8	R111 L440	R111-A444 PolarHBondContact NH1-O 2.89Å; R111-A444 PolarHBondContact NH2-O 3.18Å; L440-A444 PolarHBondContact O-N 3.39Å
445	P	92.3	Very high	88.9	Confident	34 Å²	34	76.2 Å²	76.2	22%	0.221	37%	0.373	C	S	.	.			trans	-57.1	139.8	-175.9	-26.7	34.6	0	0	0	114	R441 R447 H448	R441-P445 VanDerWaalsContact O-CA 3.22Å; R441-P445 WeakPolarHBondContact O-CA 3.48Å; P445-R447 HydrophobicContact CB-CG 3.97Å; P445-R447 PolarHBondContact O-N 2.9Å; P445-R447 VanDerWaalsContact O-N 3.11Å; P445-H448 PolarHBondContact O-N 3.23Å
446	D	89.9	Confident	87.2	Confident	47 Å²	47	73.4 Å²	73.4	25%	0.251	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-52.9	-37.2	-179.4	-68.3	-23.4	0	0	0	111.8	R111 V115 R441 H448 M449	R111-D446 IonicContact CZ-OD1 2.68Å; R111-D446 VanDerWaalsContact CZ-OD1 3.25Å; R111-D446 IonicContact NE-OD1 2.61Å; R111-D446 PolarHBondContact NE-OD1 2.91Å; R111-D446 IonicContact NH2-OD1 3.57Å; R111-D446 PolarHBondContact NH2-OD1 3.12Å; V115-D446 HydrophobicContact CG1-CB 4.18Å; R441-D446 IonicContact CZ-OD2 3.18Å; R441-D446 IonicContact NE-OD2 3.62Å; R441-D446 PolarHBondContact NE-OD2 2.94Å; R441-D446 IonicContact NH2-OD2 3.63Å; R441-D446 PolarHBondContact NH2-OD2 3.21Å; D446-H448 VanDerWaalsContact C-N 3.27Å; D446-H448 PolarHBondContact O-N 3.02Å; D446-M449 WeakPolarHBondContact O-CB 3.45Å; D446-M449 PolarHBondContact O-N 3.44Å
447	R	87.8	Confident	85.4	Confident	211 Å²	211	71.1 Å²	71.1	80%	0.796	35%	0.354	S	S	*	.	G	3₁₀ helix	trans	-66.1	-20.4	179.7	62	171.4	-175	-155.9	-4	115.3	P445	P445-R447 HydrophobicContact CB-CG 3.97Å; P445-R447 PolarHBondContact O-N 2.9Å; P445-R447 VanDerWaalsContact O-N 3.11Å
448	H	88.1	Confident	83.6	Confident	134 Å²	134	73.6 Å²	73.6	62%	0.62	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-96	-5.3	178.9	-60.9	163.7	0	0	0	112.1	P445 D446	P445-H448 PolarHBondContact O-N 3.23Å; D446-H448 VanDerWaalsContact C-N 3.27Å; D446-H448 PolarHBondContact O-N 3.02Å
449	M	88.4	Confident	81.8	Confident	27 Å²	27	77.4 Å²	77.4	13%	0.133	39%	0.386	C	S	.	.	S	Bend	trans	-77.2	126.6	177.1	-60.8	-175.5	66.6	0	0	109.3	C112 V115 R116 D446 M451	C112-M449 HydrophobicContact CB-CE 4.04Å; V115-M449 HydrophobicContact CB-CE 4.24Å; V115-M449 HydrophobicContact CB-SD 4.01Å; V115-M449 HydrophobicContact CG1-CB 4.27Å; V115-M449 HydrophobicContact CG1-CE 4.41Å; V115-M449 HydrophobicContact CG1-SD 3.76Å; V115-M449 HydrophobicContact CG2-SD 4.44Å; R116-M449 HydrophobicContact CG-CE 3.91Å; D446-M449 WeakPolarHBondContact O-CB 3.45Å; D446-M449 PolarHBondContact O-N 3.44Å; M449-M451 PolarHBondContact O-N 2.85Å
450	D	89.2	Confident	80.2	Confident	98 Å²	98	73.5 Å²	73.5	52%	0.524	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-67.5	133.5	176.7	56	-57	0	0	0	110.8	R116 A452	R116-D450 WeakPolarHBondContact CG-O 3.33Å; R116-D450 IonicContact CZ-OD1 3.98Å; R116-D450 IonicContact CZ-OD2 2.6Å; R116-D450 IonicContact NH1-OD1 3.45Å; R116-D450 PolarHBondContact NH1-OD1 3.25Å; R116-D450 IonicContact NH1-OD2 2.91Å; R116-D450 PolarHBondContact NH1-OD2 2.98Å; R116-D450 IonicContact NH2-OD1 2.91Å; R116-D450 IonicContact NH2-OD2 3.73Å; R116-D450 PolarHBondContact NH2-OD2 3.23Å; D450-A452 PolarHBondContact O-N 3.38Å
451	M	89.5	Confident	78.6	Confident	75 Å²	75	76.5 Å²	76.5	37%	0.369	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-73.1	130.9	-179.3	-54.2	-67.8	-12.4	0	0	109.5	V115 R116 R118 M449 V453	V115-M451 WeakPolarHBondContact O-CE 3.44Å; R116-M451 WeakPolarHBondContact O-CE 3.38Å; R118-M451 HydrophobicContact CG-CE 3.2Å; R118-M451 HydrophobicContact CG-SD 4.44Å; M449-M451 PolarHBondContact O-N 2.85Å; M451-V453 PolarHBondContact O-N 2.85Å
452	A	85.9	Confident	77	Confident	11 Å²	11	78.8 Å²	78.8	9%	0.091	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-66.3	129.4	174	0	0	0	0	0	109.6	R116 E117 D450	R116-A452 HydrophobicContact CB-CB 4.2Å; R116-A452 WeakPolarHBondContact O-CB 3.34Å; R116-A452 PolarHBondContact O-N 3.45Å; E117-A452 HydrophobicContact CG-CB 4.17Å; E117-A452 VanDerWaalsContact OE1-CB 3.28Å; E117-A452 WeakPolarHBondContact OE1-CB 3.45Å; E117-A452 VanDerWaalsContact OE2-CB 3.26Å; E117-A452 WeakPolarHBondContact OE2-CB 3.48Å; D450-A452 PolarHBondContact O-N 3.38Å
453	V	75.6	Confident	75.2	Confident	89 Å²	89	75.3 Å²	75.3	54%	0.539	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-73.1	133.7	179.9	-179	0	0	0	0	110.3	M451 A455 L461	M451-V453 PolarHBondContact O-N 2.85Å; V453-A455 VanDerWaalsContact C-N 3.3Å; V453-A455 PolarHBondContact O-N 3.26Å; V453-L461 HydrophobicContact CG1-CD1 3.13Å; V453-L461 HydrophobicContact CG1-CG 4.02Å
454	D	73.8	Confident	73.4	Confident	77 Å²	77	75.5 Å²	75.5	41%	0.412	38%	0.378	S	S	.	.			trans	-74.3	85.3	173.9	-69.9	-17.4	0	0	0	109.6	K63 T456 G460 L461	K63-D454 VanDerWaalsContact CD-OD1 3.22Å; K63-D454 WeakPolarHBondContact CD-OD1 3.14Å; K63-D454 WeakPolarHBondContact CE-OD1 3.38Å; K63-D454 IonicContact NZ-OD1 3.55Å; K63-D454 PolarHBondContact NZ-OD1 2.89Å; D454-T456 PolarHBondContact O-N 3.37Å; D454-G460 WeakPolarHBondContact O-CA 3.22Å; D454-L461 PolarHBondContact O-N 3.33Å
455	A	64.4	Low	71.5	Confident	9 Å²	9	76 Å²	76	7%	0.074	38%	0.378	C	S	.	.			trans	-68.5	-25.2	-179.7	0	0	0	0	0	112.2	Y79 V453 G460 L461 W462	Y79-A455 HydrophobicContact CE1-CB 4.07Å; V453-A455 VanDerWaalsContact C-N 3.3Å; V453-A455 PolarHBondContact O-N 3.26Å; A455-G460 CarbonylContact O-C 3.59Å; A455-L461 PolarHBondContact O-N 2.91Å; A455-W462 HydrophobicContact CB-CD2 4.32Å; A455-W462 HydrophobicContact CB-CZ2 4.26Å; A455-W462 VanDerWaalsContact O-CB 3.27Å; A455-W462 WeakPolarHBondContact O-CB 3.36Å; A455-W462 PolarHBondContact O-N 3.33Å
456	T	58.5	Low	69.5	Low	38 Å²	38	84.1 Å²	84.1	23%	0.233	41%	0.405	C	S	.	.	S	Bend	trans	-141.9	163	-157.9	58.3	0	0	0	0	112.6	Y79 G83 D454 W462	Y79-T456 HydrophobicContact CD1-CG2 4.41Å; G83-T456 VanDerWaalsContact O-CB 3.31Å; G83-T456 WeakPolarHBondContact O-CB 3.08Å; G83-T456 WeakPolarHBondContact O-CG2 3.26Å; G83-T456 PolarHBondContact O-OG1 3.03Å; D454-T456 PolarHBondContact O-N 3.37Å; T456-W462 HydrophobicContact CG2-CD2 3.99Å; T456-W462 HydrophobicContact CG2-CE3 3.49Å; T456-W462 VanDerWaalsContact CG2-CE3 3.49Å; T456-W462 HydrophobicContact CG2-CH2 4.43Å; T456-W462 HydrophobicContact CG2-CZ3 3.74Å
457	G	58.4	Low	67.6	Low	15 Å²	15	89.5 Å²	89.5	16%	0.155	43%	0.426	C	S	.	.	S	Bend	trans	100.5	178.1	-170.2	0	0	0	0	0	113.6	H459 G460	G457-H459 PolarHBondContact O-N 3.41Å; G457-H459 VanDerWaalsContact O-N 3.12Å; G457-G460 PolarHBondContact O-N 2.84Å; G457-G460 VanDerWaalsContact O-N 3.09Å
458	P	55.3	Low	65.7	Low	53 Å²	53	82.4 Å²	82.4	34%	0.344	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-28.1	-177.9	-24.3	33.5	0	0	0	114.2	I58	I58-P458 WeakPolarHBondContact O-CD 3.42Å
459	H	57.5	Low	63.9	Low	158 Å²	158	83.5 Å²	83.5	73%	0.731	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	14.3	-179.2	-55	-68.4	0	0	0	112.8	G457	G457-H459 PolarHBondContact O-N 3.41Å; G457-H459 VanDerWaalsContact O-N 3.12Å
460	G	61.6	Low	61.9	Low	0 Å²	0	86.4 Å²	86.4	0%	0	43%	0.434	C	S	.	.			trans	-78.6	149.2	-177.9	0	0	0	0	0	113	D454 A455 G457 W462 K463 E464	D454-G460 WeakPolarHBondContact O-CA 3.22Å; A455-G460 CarbonylContact O-C 3.59Å; G457-G460 PolarHBondContact O-N 2.84Å; G457-G460 VanDerWaalsContact O-N 3.09Å; G460-W462 PolarHBondContact O-N 3.23Å; G460-K463 PolarHBondContact O-N 2.88Å; G460-E464 PolarHBondContact O-N 3.35Å
461	L	60.2	Low	59.9	Low	86 Å²	86	85.6 Å²	85.6	45%	0.45	44%	0.436	S	S	.	.	H	α-helix	trans	-52.7	-32.8	-177.9	-73.3	-177.5	0	0	0	114.2	V453 D454 A455 K463 E464 S465	V453-L461 HydrophobicContact CG1-CD1 3.13Å; V453-L461 HydrophobicContact CG1-CG 4.02Å; D454-L461 PolarHBondContact O-N 3.33Å; A455-L461 PolarHBondContact O-N 2.91Å; L461-K463 VanDerWaalsContact C-N 3.28Å; L461-K463 PolarHBondContact O-N 3.18Å; L461-E464 PolarHBondContact O-N 3.03Å; L461-S465 WeakPolarHBondContact O-CB 3.47Å; L461-S465 PolarHBondContact O-N 3.17Å
462	W	60.9	Low	57.9	Low	138 Å²	138	89 Å²	89	52%	0.523	46%	0.456	S	S	.	.	H	α-helix	trans	-69.2	-23.6	-179.8	-67.1	-2	0	0	0	113.4	Y79 A455 T456 G460	Y79-W462 AromaticContact CD1-CH2 3.75Å; Y79-W462 HydrophobicContact CD1-CH2 3.75Å; Y79-W462 HydrophobicContact CD1-CZ2 4.42Å; Y79-W462 HydrophobicContact CD1-CZ3 4.27Å; Y79-W462 HydrophobicContact CD2-CH2 4.25Å; Y79-W462 HydrophobicContact CE1-CH2 4.28Å; Y79-W462 AromaticContact CG-CH2 3.73Å; Y79-W462 HydrophobicContact CG-CH2 3.73Å; Y79-W462 HydrophobicContact CG-CZ3 4.47Å; A455-W462 HydrophobicContact CB-CD2 4.32Å; A455-W462 HydrophobicContact CB-CZ2 4.26Å; A455-W462 VanDerWaalsContact O-CB 3.27Å; A455-W462 WeakPolarHBondContact O-CB 3.36Å; A455-W462 PolarHBondContact O-N 3.33Å; T456-W462 HydrophobicContact CG2-CD2 3.99Å; T456-W462 HydrophobicContact CG2-CE3 3.49Å; T456-W462 VanDerWaalsContact CG2-CE3 3.49Å; T456-W462 HydrophobicContact CG2-CH2 4.43Å; T456-W462 HydrophobicContact CG2-CZ3 3.74Å; G460-W462 PolarHBondContact O-N 3.23Å
463	K	58.4	Low	56	Low	121 Å²	121	92.8 Å²	92.8	53%	0.526	49%	0.487	S	S	.	.	H	α-helix	trans	-82	-37.4	171.4	-83.8	-170.4	179.2	177.2	0	112	G460 L461 R466 K467	G460-K463 PolarHBondContact O-N 2.88Å; L461-K463 VanDerWaalsContact C-N 3.28Å; L461-K463 PolarHBondContact O-N 3.18Å; K463-R466 PolarHBondContact O-N 3.48Å; K463-K467 PolarHBondContact O-N 2.98Å
464	E	54.7	Low	54.6	Low	115 Å²	115	91.5 Å²	91.5	54%	0.537	49%	0.492	S	S	.	.	H	α-helix	trans	-64.3	-42.7	176.6	-68.5	-175.7	160	0	0	111.6	G460 L461 R466 K467 S468	G460-E464 PolarHBondContact O-N 3.35Å; L461-E464 PolarHBondContact O-N 3.03Å; E464-R466 VanDerWaalsContact C-N 3.26Å; E464-R466 PolarHBondContact O-N 3.33Å; E464-K467 PolarHBondContact O-N 2.94Å; E464-K467 VanDerWaalsContact O-N 3.12Å; E464-S468 PolarHBondContact O-N 2.89Å; E464-S468 PolarHBondContact O-OG 3.47Å
465	S	50.9	Low	52.8	Low	59 Å²	59	97.9 Å²	97.9	41%	0.413	54%	0.54	S	S	.	.	H	α-helix	trans	-60	-31.1	174.1	176.5	0	0	0	0	113.8	L461 S468 K469	L461-S465 WeakPolarHBondContact O-CB 3.47Å; L461-S465 PolarHBondContact O-N 3.17Å; S465-S468 PolarHBondContact O-OG 2.98Å; S465-K469 WeakPolarHBondContact O-CG 3.17Å; S465-K469 PolarHBondContact O-N 3.2Å
466	R	51.4	Low	52.2	Low	205 Å²	205	102.3 Å²	102.3	77%	0.774	56%	0.564	S	S	*	*	H	α-helix	trans	-76.1	-34.9	174.6	-81.2	-175.3	175.4	-171.9	-0.8	112.6	K463 E464 S470	K463-R466 PolarHBondContact O-N 3.48Å; E464-R466 VanDerWaalsContact C-N 3.26Å; E464-R466 PolarHBondContact O-N 3.33Å; R466-S470 PolarHBondContact O-N 3.14Å; R466-S470 PolarHBondContact O-OG 3.36Å
467	K	50	Low	51.9	Low	161 Å²	161	105.7 Å²	105.7	70%	0.7	58%	0.581	S	S	*	*	H	α-helix	trans	-70.2	-39.8	176.5	-78	-174.8	175.1	-177.3	0	112.2	K463 E464 K469 S470 S471	K463-K467 PolarHBondContact O-N 2.98Å; E464-K467 PolarHBondContact O-N 2.94Å; E464-K467 VanDerWaalsContact O-N 3.12Å; K467-K469 VanDerWaalsContact C-N 3.33Å; K467-K469 PolarHBondContact O-N 3.34Å; K467-S470 PolarHBondContact O-N 3.48Å; K467-S470 PolarHBondContact O-OG 3.42Å; K467-S471 PolarHBondContact O-N 3.12Å; K467-S471 PolarHBondContact O-OG 3.18Å
468	S	47.3	Very low	51.5	Low	62 Å²	62	110.7 Å²	110.7	43%	0.434	61%	0.605	S	S	.	*	H	α-helix	trans	-67.1	-32.9	176.9	62.5	0	0	0	0	112.9	E464 S465 S470 S471	E464-S468 PolarHBondContact O-N 2.89Å; E464-S468 PolarHBondContact O-OG 3.47Å; S465-S468 PolarHBondContact O-OG 2.98Å; S468-S470 VanDerWaalsContact C-N 3.33Å; S468-S470 PolarHBondContact O-N 2.91Å; S468-S471 PolarHBondContact O-N 3.44Å; S468-S471 PolarHBondContact O-OG 2.62Å
469	K	49.9	Very low	51.3	Low	157 Å²	157	114.1 Å²	114.1	68%	0.683	62%	0.62	S	S	*	*	H	α-helix	trans	-73.4	-20.9	174.5	-74.4	-174	177.5	-171.2	0	114.3	S465 K467	S465-K469 WeakPolarHBondContact O-CG 3.17Å; S465-K469 PolarHBondContact O-N 3.2Å; K467-K469 VanDerWaalsContact C-N 3.33Å; K467-K469 PolarHBondContact O-N 3.34Å
470	S	47.6	Very low	50.9	Low	87 Å²	87	111.4 Å²	111.4	61%	0.608	61%	0.613	S	S	*	*	H	α-helix	trans	-83.9	-17.7	174.7	54.3	0	0	0	0	114	R466 K467 S468	R466-S470 PolarHBondContact O-N 3.14Å; R466-S470 PolarHBondContact O-OG 3.36Å; K467-S470 PolarHBondContact O-N 3.48Å; K467-S470 PolarHBondContact O-OG 3.42Å; S468-S470 VanDerWaalsContact C-N 3.33Å; S468-S470 PolarHBondContact O-N 2.91Å
471	S	46.4	Very low	50.2	Low	81 Å²	81	118.8 Å²	118.8	57%	0.566	65%	0.654	S	S	*	*	H	α-helix	trans	-84.4	-16.9	176.1	44.6	0	0	0	0	113.9	K467 S468	K467-S471 PolarHBondContact O-N 3.12Å; K467-S471 PolarHBondContact O-OG 3.18Å; S468-S471 PolarHBondContact O-N 3.44Å; S468-S471 PolarHBondContact O-OG 2.62Å
472	D	48	Very low	49.5	Very low	146 Å²	146	121.1 Å²	121.1	78%	0.781	67%	0.669	S	S	*	*	S	Bend	trans	-97.2	6	-178.8	-69.1	-15.2	0	0	0	113.8
473	A	45.7	Very low	48.6	Very low	91 Å²	91	119.8 Å²	119.8	75%	0.752	68%	0.68	S	S	*	*	S	Bend	trans	-103.5	20.2	176.7	0	0	0	0	0	113.2
474	G	44.9	Very low	47.8	Very low	62 Å²	62	119.8 Å²	119.8	64%	0.639	69%	0.693	S	S	*	*			trans	-133.1	72.6	179.5	0	0	0	0	0	111.8
475	C	36.8	Very low	47.2	Very low	211 Å²	211	120.2 Å²	120.2	100%	1.426	71%	0.707	S	S	*	*			trans	-149.6	0	151.2	-94.4	0	0	0	0	108.2

Retrieved 475 of 475 residues in 166 ms (Link to these results)

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