A0A087X863_POEFO Loading...

L-lactate dehydrogenase

AlphaFold DB (A0A3B3VWQ0), UniProt , Accession A0A087X863, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 355 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	54	Low	60.3	Low	199 Å²	199	135.9 Å²	135.9	98%	0.98	64%	0.644	S	S	*	*				0	-28	0	-96	174.1	69.2	0	0	114.6	T4 W5	M1-T4 PolarHBondContact O-OG1 2.92Å; M1-T4 VanDerWaalsContact O-OG1 3.11Å; M1-W5 VanDerWaalsContact O-CD1 3.3Å
2	L	54.1	Low	60.3	Low	158 Å²	158	129.7 Å²	129.7	83%	0.827	63%	0.633	S	S	*	*	H	α-helix	trans	-75.7	-29.7	-178.4	-81.2	151.1	0	0	0	115.1
3	I	57.3	Low	60.3	Low	131 Å²	131	130.5 Å²	130.5	67%	0.672	63%	0.625	S	S	*	*	H	α-helix	trans	-70.6	-35	-176	-63.4	169.7	0	0	0	112	W5 W6 Y7	I3-W5 PolarHBondContact O-N 3.48Å; I3-W6 PolarHBondContact O-N 2.95Å; I3-Y7 HydrophobicContact CG2-CD2 4.15Å; I3-Y7 HydrophobicContact CG2-CE2 4.1Å; I3-Y7 WeakPolarHBondContact O-CD2 3.48Å; I3-Y7 PolarHBondContact O-N 2.76Å
4	T	57.3	Low	59.9	Low	89 Å²	89	125.5 Å²	125.5	55%	0.546	61%	0.61	S	S	.	*	H	α-helix	trans	-69.9	-32.3	-178.9	37.8	0	0	0	0	113.2	M1 L8	M1-T4 PolarHBondContact O-OG1 2.92Å; M1-T4 VanDerWaalsContact O-OG1 3.11Å; T4-L8 PolarHBondContact O-N 2.91Å
5	W	55	Low	59.7	Low	186 Å²	186	127 Å²	127	71%	0.705	61%	0.613	S	S	*	*	H	α-helix	trans	-70.4	-32.5	175.8	-77.9	78.1	0	0	0	112.6	M1 I3 L8 Y9	M1-W5 VanDerWaalsContact O-CD1 3.3Å; I3-W5 PolarHBondContact O-N 3.48Å; W5-L8 PolarHBondContact O-N 3.03Å; W5-Y9 WeakPolarHBondContact O-CB 3.49Å; W5-Y9 PolarHBondContact O-N 3.24Å
6	W	63.5	Low	59.4	Low	174 Å²	174	121.9 Å²	121.9	66%	0.659	60%	0.598	S	S	*	*	H	α-helix	trans	-68.1	-40.5	177.1	-166.2	-85.2	0	0	0	112.2	I3 Y9 L10	I3-W6 PolarHBondContact O-N 2.95Å; W6-Y9 PolarHBondContact O-N 2.83Å; W6-L10 VanDerWaalsContact CD1-CD1 3.45Å; W6-L10 WeakPolarHBondContact O-CB 3.38Å; W6-L10 WeakPolarHBondContact O-CG 3.32Å; W6-L10 PolarHBondContact O-N 3.18Å
7	Y	64.3	Low	59.1	Low	168 Å²	168	121.6 Å²	121.6	66%	0.659	60%	0.595	S	S	*	*	H	α-helix	trans	-68	-39.1	175.2	-86.4	-83.5	0	0	0	112.6	I3 L10 A11	I3-Y7 HydrophobicContact CG2-CD2 4.15Å; I3-Y7 HydrophobicContact CG2-CE2 4.1Å; I3-Y7 WeakPolarHBondContact O-CD2 3.48Å; I3-Y7 PolarHBondContact O-N 2.76Å; Y7-L10 PolarHBondContact O-N 3.28Å; Y7-A11 VanDerWaalsContact O-CB 3.28Å; Y7-A11 WeakPolarHBondContact O-CB 3.34Å; Y7-A11 PolarHBondContact O-N 3.42Å
8	L	63	Low	58.7	Low	121 Å²	121	121.1 Å²	121.1	63%	0.634	59%	0.591	S	S	*	*	H	α-helix	trans	-63.4	-40.6	172.4	-89.1	153.8	0	0	0	112	T4 W5 A11 A12	T4-L8 PolarHBondContact O-N 2.91Å; W5-L8 PolarHBondContact O-N 3.03Å; L8-A11 PolarHBondContact O-N 2.87Å; L8-A12 WeakPolarHBondContact O-CB 3.35Å; L8-A12 PolarHBondContact O-N 2.73Å
9	Y	66.3	Low	58.3	Low	133 Å²	133	119.1 Å²	119.1	52%	0.522	59%	0.587	S	S	.	*	H	α-helix	trans	-64.9	-45.3	175.6	179.6	-102.4	0	0	0	112.2	W5 W6 A12 R13	W5-Y9 WeakPolarHBondContact O-CB 3.49Å; W5-Y9 PolarHBondContact O-N 3.24Å; W6-Y9 PolarHBondContact O-N 2.83Å; Y9-A12 PolarHBondContact O-N 3.46Å; Y9-R13 WeakPolarHBondContact O-CB 3.34Å; Y9-R13 PolarHBondContact O-N 2.93Å
10	L	65.7	Low	58	Low	79 Å²	79	119.3 Å²	119.3	41%	0.414	59%	0.59	S	S	.	*	H	α-helix	trans	-64.5	-39.5	175.7	-75.1	173	0	0	0	112.4	W6 Y7 R13 S14	W6-L10 VanDerWaalsContact CD1-CD1 3.45Å; W6-L10 WeakPolarHBondContact O-CB 3.38Å; W6-L10 WeakPolarHBondContact O-CG 3.32Å; W6-L10 PolarHBondContact O-N 3.18Å; Y7-L10 PolarHBondContact O-N 3.28Å; L10-R13 PolarHBondContact O-N 2.9Å; L10-S14 WeakPolarHBondContact O-CB 3.47Å; L10-S14 PolarHBondContact O-N 2.88Å
11	A	63.2	Low	57.7	Low	57 Å²	57	123.7 Å²	123.7	47%	0.471	60%	0.6	S	S	.	*	H	α-helix	trans	-65.3	-44	175.6	0	0	0	0	0	111.6	Y7 L8 R13 S14 F15	Y7-A11 VanDerWaalsContact O-CB 3.28Å; Y7-A11 WeakPolarHBondContact O-CB 3.34Å; Y7-A11 PolarHBondContact O-N 3.42Å; L8-A11 PolarHBondContact O-N 2.87Å; A11-R13 VanDerWaalsContact C-N 3.34Å; A11-R13 PolarHBondContact O-N 2.68Å; A11-S14 PolarHBondContact O-N 3.14Å; A11-F15 WeakPolarHBondContact O-CB 3.45Å; A11-F15 PolarHBondContact O-N 2.89Å
12	A	59.7	Low	57.8	Low	61 Å²	61	122 Å²	122	50%	0.504	59%	0.592	S	S	.	*	H	α-helix	trans	-63.5	-38.3	175.3	0	0	0	0	0	112.3	L8 Y9 F15 A16	L8-A12 WeakPolarHBondContact O-CB 3.35Å; L8-A12 PolarHBondContact O-N 2.73Å; Y9-A12 PolarHBondContact O-N 3.46Å; A12-F15 PolarHBondContact O-N 3.15Å; A12-A16 VanDerWaalsContact O-CB 3.29Å; A12-A16 WeakPolarHBondContact O-CB 3.42Å; A12-A16 PolarHBondContact O-N 3.23Å
13	R	60.2	Low	58.3	Low	140 Å²	140	115.7 Å²	115.7	53%	0.528	56%	0.562	S	S	.	*	H	α-helix	trans	-66.6	-43.6	174.4	-128.9	-177.2	179.2	-164.8	-2.1	112.2	Y9 L10 A11 F15 A16 E17	Y9-R13 WeakPolarHBondContact O-CB 3.34Å; Y9-R13 PolarHBondContact O-N 2.93Å; L10-R13 PolarHBondContact O-N 2.9Å; A11-R13 VanDerWaalsContact C-N 3.34Å; A11-R13 PolarHBondContact O-N 2.68Å; R13-F15 VanDerWaalsContact C-N 3.32Å; R13-F15 PolarHBondContact O-N 3.23Å; R13-A16 PolarHBondContact O-N 2.89Å; R13-E17 WeakPolarHBondContact O-CB 3.46Å; R13-E17 WeakPolarHBondContact O-CG 3.28Å; R13-E17 PolarHBondContact O-N 3.42Å
14	S	55.8	Low	59.5	Low	61 Å²	61	112 Å²	112	43%	0.427	55%	0.548	S	S	.	.	H	α-helix	trans	-63.3	-38.3	175.4	-179.9	0	0	0	0	111.9	L10 A11 Q18	L10-S14 WeakPolarHBondContact O-CB 3.47Å; L10-S14 PolarHBondContact O-N 2.88Å; A11-S14 PolarHBondContact O-N 3.14Å; S14-Q18 WeakPolarHBondContact O-CB 3.45Å; S14-Q18 PolarHBondContact O-N 3.02Å
15	F	56	Low	61.1	Low	148 Å²	148	113.6 Å²	113.6	65%	0.649	56%	0.558	S	S	*	*	H	α-helix	trans	-69.3	-44.6	176.8	-136.4	-93.3	0	0	0	110.8	A11 A12 R13 E17 Q18 T19	A11-F15 WeakPolarHBondContact O-CB 3.45Å; A11-F15 PolarHBondContact O-N 2.89Å; A12-F15 PolarHBondContact O-N 3.15Å; R13-F15 VanDerWaalsContact C-N 3.32Å; R13-F15 PolarHBondContact O-N 3.23Å; F15-E17 PolarHBondContact O-N 3.41Å; F15-Q18 PolarHBondContact O-N 2.94Å; F15-T19 PolarHBondContact O-N 3.24Å; F15-T19 PolarHBondContact O-OG1 3.42Å
16	A	55.3	Low	62.5	Low	46 Å²	46	110.1 Å²	110.1	38%	0.38	55%	0.552	S	S	.	*	H	α-helix	trans	-60	-43.8	174.3	0	0	0	0	0	112.1	A12 R13 T19 L20	A12-A16 VanDerWaalsContact O-CB 3.29Å; A12-A16 WeakPolarHBondContact O-CB 3.42Å; A12-A16 PolarHBondContact O-N 3.23Å; R13-A16 PolarHBondContact O-N 2.89Å; A16-T19 VanDerWaalsContact CA-OG1 3.27Å; A16-T19 WeakPolarHBondContact CA-OG1 3.34Å; A16-T19 PolarHBondContact O-N 3.01Å; A16-T19 PolarHBondContact O-OG1 2.91Å; A16-L20 WeakPolarHBondContact O-CB 3.48Å; A16-L20 PolarHBondContact O-N 3.17Å
17	E	54.6	Low	63.6	Low	116 Å²	116	107.8 Å²	107.8	54%	0.542	55%	0.549	S	S	.	.	H	α-helix	trans	-65.9	-35	174.2	-78.6	177.3	-177.9	0	0	112.8	R13 F15 R21	R13-E17 WeakPolarHBondContact O-CB 3.46Å; R13-E17 WeakPolarHBondContact O-CG 3.28Å; R13-E17 PolarHBondContact O-N 3.42Å; F15-E17 PolarHBondContact O-N 3.41Å; E17-R21 WeakPolarHBondContact O-CB 3.11Å; E17-R21 WeakPolarHBondContact O-CG 3.36Å; E17-R21 PolarHBondContact O-N 3.4Å
18	Q	51.3	Low	65	Low	112 Å²	112	106 Å²	106	52%	0.523	54%	0.544	S	S	.	.	H	α-helix	trans	-68.2	-42.5	172.3	-99.8	174.9	-29.7	0	0	112.2	S14 F15 L20 R21 M22	S14-Q18 WeakPolarHBondContact O-CB 3.45Å; S14-Q18 PolarHBondContact O-N 3.02Å; F15-Q18 PolarHBondContact O-N 2.94Å; Q18-L20 VanDerWaalsContact C-N 3.35Å; Q18-R21 WeakPolarHBondContact O-CB 3.48Å; Q18-R21 PolarHBondContact O-N 2.88Å; Q18-R21 VanDerWaalsContact O-N 3.16Å; Q18-M22 WeakPolarHBondContact O-CG 3.39Å; Q18-M22 PolarHBondContact O-N 3.18Å
19	T	50.7	Low	66.4	Low	84 Å²	84	106.6 Å²	106.6	52%	0.515	55%	0.547	S	S	.	.	H	α-helix	trans	-65.4	-35.4	173.2	34.5	0	0	0	0	112.6	F15 A16 R21 M22 A23	F15-T19 PolarHBondContact O-N 3.24Å; F15-T19 PolarHBondContact O-OG1 3.42Å; A16-T19 VanDerWaalsContact CA-OG1 3.27Å; A16-T19 WeakPolarHBondContact CA-OG1 3.34Å; A16-T19 PolarHBondContact O-N 3.01Å; A16-T19 PolarHBondContact O-OG1 2.91Å; T19-R21 VanDerWaalsContact C-N 3.35Å; T19-M22 PolarHBondContact O-N 3.47Å; T19-A23 PolarHBondContact O-N 3.02Å
20	L	52.1	Low	67.7	Low	123 Å²	123	104.9 Å²	104.9	64%	0.644	55%	0.546	S	S	*	.	H	α-helix	trans	-67.8	-31.8	170.8	-100.6	141.8	0	0	0	112.6	A16 Q18 M22 K28	A16-L20 WeakPolarHBondContact O-CB 3.48Å; A16-L20 PolarHBondContact O-N 3.17Å; Q18-L20 VanDerWaalsContact C-N 3.35Å; L20-M22 VanDerWaalsContact C-N 3.34Å; L20-K28 VanDerWaalsContact O-CE 3.27Å; L20-K28 WeakPolarHBondContact O-CE 3.47Å
21	R	53.3	Low	69	Low	211 Å²	211	106.7 Å²	106.7	80%	0.796	56%	0.56	S	S	*	*	H	α-helix	trans	-69.9	-28.8	172.2	-85.6	-178.9	175.2	-170.4	-0.2	113	E17 Q18 T19	E17-R21 WeakPolarHBondContact O-CB 3.11Å; E17-R21 WeakPolarHBondContact O-CG 3.36Å; E17-R21 PolarHBondContact O-N 3.4Å; Q18-R21 WeakPolarHBondContact O-CB 3.48Å; Q18-R21 PolarHBondContact O-N 2.88Å; Q18-R21 VanDerWaalsContact O-N 3.16Å; T19-R21 VanDerWaalsContact C-N 3.35Å
22	M	55.9	Low	70.2	Confident	165 Å²	165	108.4 Å²	108.4	81%	0.813	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-5.1	176.9	-68.5	-166.4	77	0	0	114.9	Q18 T19 L20 S24	Q18-M22 WeakPolarHBondContact O-CG 3.39Å; Q18-M22 PolarHBondContact O-N 3.18Å; T19-M22 PolarHBondContact O-N 3.47Å; L20-M22 VanDerWaalsContact C-N 3.34Å; M22-S24 PolarHBondContact O-N 3.3Å
23	A	63.8	Low	71.7	Confident	25 Å²	25	113.8 Å²	113.8	21%	0.207	59%	0.586	C	S	.	*	S	Bend	trans	-64.2	129.5	173.3	0	0	0	0	0	110.4	T19 Q27 K28	T19-A23 PolarHBondContact O-N 3.02Å; A23-Q27 VanDerWaalsContact CA-OE1 3.24Å; A23-Q27 HydrophobicContact CB-CB 4.17Å; A23-K28 HydrophobicContact CB-CG 4.2Å; A23-K28 VanDerWaalsContact O-CE 3.25Å; A23-K28 WeakPolarHBondContact O-CE 3.35Å; A23-K28 PolarHBondContact O-NZ 3.06Å
24	S	83.6	Confident	73.1	Confident	54 Å²	54	114.2 Å²	114.2	38%	0.378	59%	0.592	S	S	.	*			trans	-60.9	157.1	-179.3	71	0	0	0	0	110.8	M22 L26 Q27 K28	M22-S24 PolarHBondContact O-N 3.3Å; S24-L26 PolarHBondContact O-N 2.85Å; S24-L26 VanDerWaalsContact O-N 3.14Å; S24-Q27 PolarHBondContact O-N 3.02Å; S24-Q27 WeakPolarHBondContact OG-CG 3.4Å; S24-Q27 PolarHBondContact OG-N 3.18Å; S24-K28 PolarHBondContact O-N 3.31Å; S24-K28 VanDerWaalsContact O-N 3.12Å
25	V	89	Confident	74.4	Confident	122 Å²	122	117.9 Å²	117.9	74%	0.739	61%	0.612	S	S	*	*	H	α-helix	trans	-50.4	-40.1	173.7	173.6	0	0	0	0	110.5	K28 L29	V25-K28 PolarHBondContact O-N 3.31Å; V25-L29 WeakPolarHBondContact O-CB 3.3Å; V25-L29 PolarHBondContact O-N 3.02Å
26	L	85.4	Confident	75.9	Confident	112 Å²	112	112.7 Å²	112.7	59%	0.586	60%	0.6	S	S	*	*	H	α-helix	trans	-58.4	-49.4	176.3	179.9	64.3	0	0	0	112.4	S24 K28 L29 I30	S24-L26 PolarHBondContact O-N 2.85Å; S24-L26 VanDerWaalsContact O-N 3.14Å; L26-K28 VanDerWaalsContact C-N 3.25Å; L26-K28 PolarHBondContact O-N 3.41Å; L26-L29 PolarHBondContact O-N 3.35Å; L26-I30 HydrophobicContact CD1-CB 4.2Å; L26-I30 HydrophobicContact CD1-CD1 3.87Å; L26-I30 HydrophobicContact CD1-CG1 4.21Å; L26-I30 PolarHBondContact O-N 2.94Å
27	Q	86.8	Confident	77.3	Confident	126 Å²	126	116.5 Å²	116.5	59%	0.589	62%	0.619	S	S	*	*	H	α-helix	trans	-64.7	-30	-179.1	-73.8	170.1	-24.4	0	0	112.8	A23 S24	A23-Q27 VanDerWaalsContact CA-OE1 3.24Å; A23-Q27 HydrophobicContact CB-CB 4.17Å; S24-Q27 PolarHBondContact O-N 3.02Å; S24-Q27 WeakPolarHBondContact OG-CG 3.4Å; S24-Q27 PolarHBondContact OG-N 3.18Å
28	K	93.1	Very high	78.6	Confident	131 Å²	131	116.5 Å²	116.5	57%	0.57	63%	0.629	S	S	*	*	H	α-helix	trans	-79.6	-31.7	175.6	-67.2	176.7	-176.3	163.9	0	112.6	L20 A23 S24 V25 L26	L20-K28 VanDerWaalsContact O-CE 3.27Å; L20-K28 WeakPolarHBondContact O-CE 3.47Å; A23-K28 HydrophobicContact CB-CG 4.2Å; A23-K28 VanDerWaalsContact O-CE 3.25Å; A23-K28 WeakPolarHBondContact O-CE 3.35Å; A23-K28 PolarHBondContact O-NZ 3.06Å; S24-K28 PolarHBondContact O-N 3.31Å; S24-K28 VanDerWaalsContact O-N 3.12Å; V25-K28 PolarHBondContact O-N 3.31Å; L26-K28 VanDerWaalsContact C-N 3.25Å; L26-K28 PolarHBondContact O-N 3.41Å
29	L	93.1	Very high	80.3	Confident	133 Å²	133	117.6 Å²	117.6	70%	0.696	63%	0.634	S	S	*	*	H	α-helix	trans	-86.5	-39.1	-175.8	-177.8	63.2	0	0	0	112.7	V25 L26	V25-L29 WeakPolarHBondContact O-CB 3.3Å; V25-L29 PolarHBondContact O-N 3.02Å; L26-L29 PolarHBondContact O-N 3.35Å
30	I	92.6	Very high	82.1	Confident	97 Å²	97	117.8 Å²	117.8	50%	0.497	64%	0.636	S	S	.	*			trans	-129.6	121.8	-170.5	-54.3	-175.4	0	0	0	109.6	L26	L26-I30 HydrophobicContact CD1-CB 4.2Å; L26-I30 HydrophobicContact CD1-CD1 3.87Å; L26-I30 HydrophobicContact CD1-CG1 4.21Å; L26-I30 PolarHBondContact O-N 2.94Å
31	T	92.8	Very high	84	Confident	116 Å²	116	113.4 Å²	113.4	71%	0.712	62%	0.616	S	S	*	*			trans	-95.1	113.1	173	-58.7	0	0	0	0	109.5
32	P	88.3	Confident	85.9	Confident	93 Å²	93	111.6 Å²	111.6	60%	0.604	61%	0.609	S	S	*	*			trans	-72.7	132.4	178.6	29.6	-33.3	0	0	0	110.6
33	L	91.3	Very high	87.9	Confident	174 Å²	174	106.4 Å²	106.4	91%	0.911	58%	0.584	S	S	*	*	S	Bend	trans	-99.9	-19.4	170.7	-61.9	-178.8	0	0	0	112.7
34	F	89.6	Confident	89.5	Confident	150 Å²	150	105.6 Å²	105.6	66%	0.658	58%	0.576	S	S	*	*			trans	-124.4	138.1	178.8	177.2	-107.4	0	0	0	109.5	G36	F34-G36 VanDerWaalsContact CE1-CA 3.43Å; F34-G36 VanDerWaalsContact CE1-O 3.28Å; F34-G36 WeakPolarHBondContact CE1-O 3.33Å
35	T	84.7	Confident	90.3	Very high	138 Å²	138	103 Å²	103	85%	0.847	56%	0.558	S	S	*	*			trans	-121.2	6.9	-176	57.8	0	0	0	0	113.5
36	G	86.9	Confident	90.7	Very high	38 Å²	38	97.2 Å²	97.2	39%	0.392	52%	0.523	S	S	.	.	S	Bend	trans	-82.1	175.4	175.3	0	0	0	0	0	112.6	F34	F34-G36 VanDerWaalsContact CE1-CA 3.43Å; F34-G36 VanDerWaalsContact CE1-O 3.28Å; F34-G36 WeakPolarHBondContact CE1-O 3.33Å
37	T	83.9	Confident	91.4	Very high	126 Å²	126	91.9 Å²	91.9	77%	0.773	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-71	139.4	172.9	49.7	0	0	0	0	110.3
38	P	82.5	Confident	91.9	Very high	116 Å²	116	86 Å²	86	75%	0.753	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-54.2	151.6	168.6	-23.5	33.5	0	0	0	111.4
39	E	87.4	Confident	92.2	Very high	136 Å²	136	79.9 Å²	79.9	64%	0.636	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-59.4	146.7	171.1	-69.9	-171.5	177.5	0	0	110.9	R42	E39-R42 IonicContact OE1-NH2 2.74Å; E39-R42 IonicContact OE2-CZ 3.76Å; E39-R42 IonicContact OE2-NE 3.74Å; E39-R42 PolarHBondContact OE2-NE 3.45Å; E39-R42 IonicContact OE2-NH2 2.83Å; E39-R42 PolarHBondContact OE2-NH2 3.4Å
40	P	87.5	Confident	92.4	Very high	87 Å²	87	73.6 Å²	73.6	57%	0.565	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-63.4	156.6	170.7	29.3	-34.7	0	0	0	110.5
41	P	92.6	Very high	92.6	Very high	32 Å²	32	70.2 Å²	70.2	21%	0.208	40%	0.398	C	S	.	.	P	Polyproline II helix	trans	-62.1	142.6	176.5	29.8	-36.7	0	0	0	110.3	K44 E69	P41-K44 HydrophobicContact CB-CB 4Å; P41-K44 HydrophobicContact CG-CB 3.95Å; P41-K44 HydrophobicContact CG-CD 3.87Å; P41-K44 HydrophobicContact CG-CG 4.44Å; P41-E69 HydrophobicContact CB-CB 3.72Å; P41-E69 HydrophobicContact CG-CB 4.17Å
42	R	92.8	Very high	92.9	Very high	172 Å²	172	68.4 Å²	68.4	65%	0.649	38%	0.381	S	S	*	.	S	Bend	trans	-98	-31.3	-176.3	-62.4	-177.3	-179.3	-167.7	-0.3	112.3	E39 D68	E39-R42 IonicContact OE1-NH2 2.74Å; E39-R42 IonicContact OE2-CZ 3.76Å; E39-R42 IonicContact OE2-NE 3.74Å; E39-R42 PolarHBondContact OE2-NE 3.45Å; E39-R42 IonicContact OE2-NH2 2.83Å; E39-R42 PolarHBondContact OE2-NH2 3.4Å; R42-D68 PolarHBondContact N-OD2 3.13Å
43	N	97.4	Very high	93.3	Very high	57 Å²	57	65.6 Å²	65.6	31%	0.305	36%	0.363	S	S	.	.	S	Bend	trans	-122.5	36	-174.8	-69.3	-29.4	0	0	0	111.2	V45 A67 D68 R112 M286	N43-V45 PolarHBondContact O-N 3.26Å; N43-A67 VanDerWaalsContact O-CA 3.32Å; N43-A67 WeakPolarHBondContact O-CA 3.48Å; N43-A67 WeakPolarHBondContact O-CB 3.44Å; N43-D68 VanDerWaalsContact CA-OD1 3.28Å; N43-D68 WeakPolarHBondContact CA-OD1 3.42Å; N43-D68 PolarHBondContact N-OD1 2.92Å; N43-D68 PolarHBondContact N-OD2 2.81Å; N43-R112 PolarHBondContact OD1-NH1 2.95Å; N43-M286 HydrophobicContact CB-CE 3.92Å; N43-M286 HydrophobicContact CB-CG 4.44Å; N43-M286 HydrophobicContact CB-SD 3.53Å; N43-M286 VanDerWaalsContact CB-SD 3.53Å; N43-M286 VanDerWaalsContact O-CE 3.32Å; N43-M286 WeakPolarHBondContact O-CE 3.37Å; N43-M286 PolarHBondContact OD1-SD 2.96Å
44	K	98.8	Very high	93.7	Very high	8 Å²	8	57.4 Å²	57.4	4%	0.035	32%	0.32	C	S	.	.			trans	-62.5	134.6	-178.9	-179.2	173.2	179.4	164.3	0	111.5	P41 D68 E69 V107 A109 R112 I113	P41-K44 HydrophobicContact CB-CB 4Å; P41-K44 HydrophobicContact CG-CB 3.95Å; P41-K44 HydrophobicContact CG-CD 3.87Å; P41-K44 HydrophobicContact CG-CG 4.44Å; K44-D68 PolarHBondContact N-OD1 2.92Å; K44-E69 VanDerWaalsContact CA-O 3.3Å; K44-E69 WeakPolarHBondContact CA-O 3.47Å; K44-E69 HydrophobicContact CB-CB 4.21Å; K44-E69 HydrophobicContact CD-CB 4.37Å; K44-E69 HydrophobicContact CD-CG 4.18Å; K44-E69 WeakPolarHBondContact CE-OE1 3.31Å; K44-E69 HydrophobicContact CG-CB 4.02Å; K44-E69 HydrophobicContact CG-CG 4.2Å; K44-E69 IonicContact NZ-OE1 3.5Å; K44-E69 PolarHBondContact NZ-OE1 2.94Å; K44-V107 WeakPolarHBondContact CE-O 3.41Å; K44-V107 PolarHBondContact NZ-O 2.94Å; K44-A109 WeakPolarHBondContact CD-O 3.23Å; K44-A109 WeakPolarHBondContact CE-O 3.2Å; K44-A109 PolarHBondContact NZ-O 2.82Å; K44-R112 PolarHBondContact O-N 3.33Å; K44-I113 PolarHBondContact O-N 2.83Å
45	V	98.9	Very high	94.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	135.1	173.2	180	0	0	0	0	109.5	N43 I61 A67 E69 L70 A71 I113 T282 M286	N43-V45 PolarHBondContact O-N 3.26Å; V45-I61 HydrophobicContact CB-CG2 4.44Å; V45-I61 HydrophobicContact CG1-CD1 4.1Å; V45-I61 HydrophobicContact CG1-CG2 4.38Å; V45-I61 HydrophobicContact CG2-CG2 4.42Å; V45-A67 HydrophobicContact CB-CB 4.1Å; V45-A67 HydrophobicContact CG2-CB 3.81Å; V45-E69 PolarHBondContact N-O 3.13Å; V45-L70 HydrophobicContact CB-CD1 4.39Å; V45-L70 HydrophobicContact CG1-CD1 4.43Å; V45-L70 WeakPolarHBondContact O-CA 3.37Å; V45-A71 PolarHBondContact O-N 2.96Å; V45-I113 WeakPolarHBondContact CA-O 3.46Å; V45-I113 HydrophobicContact CG2-CB 4.39Å; V45-T282 HydrophobicContact CG2-CG2 4.35Å; V45-M286 HydrophobicContact CG2-CE 3.57Å
46	T	98.9	Very high	94.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138.1	170.6	-70.2	0	0	0	0	110.3	V48 A71 V73 T108 S111 I113 V114 V115	T46-V48 HydrophobicContact CG2-CG2 3.95Å; T46-A71 CarbonylContact C-O 3.53Å; T46-A71 VanDerWaalsContact CA-O 3.27Å; T46-A71 WeakPolarHBondContact CA-O 3.26Å; T46-V73 HydrophobicContact CG2-CG2 4.41Å; T46-T108 HydrophobicContact CG2-CG2 3.54Å; T46-T108 WeakPolarHBondContact OG1-CB 3.34Å; T46-S111 PolarHBondContact OG1-OG 2.61Å; T46-I113 PolarHBondContact N-O 3.44Å; T46-V114 HydrophobicContact CG2-CG1 4.05Å; T46-V114 CarbonylContact O-C 3.46Å; T46-V114 WeakPolarHBondContact O-CA 3.18Å; T46-V115 PolarHBondContact O-N 2.85Å
47	V	98.9	Very high	95.4	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	120.4	167	-177.2	0	0	0	0	109.1	A58 I61 L70 A71 L72 V73 V115 T117	V47-A58 HydrophobicContact CG2-CB 4.33Å; V47-I61 HydrophobicContact CG2-CD1 4.44Å; V47-L70 HydrophobicContact CG2-CD1 4.16Å; V47-A71 PolarHBondContact N-O 2.96Å; V47-L72 HydrophobicContact CB-CD2 3.91Å; V47-L72 HydrophobicContact CG2-CD2 4.47Å; V47-V73 PolarHBondContact O-N 3.08Å; V47-V115 WeakPolarHBondContact CA-O 3.37Å; V47-V115 HydrophobicContact CG2-CB 4.34Å; V47-T117 HydrophobicContact CG1-CG2 4.32Å
48	V	98.8	Very high	96.1	Very high	2 Å²	2	37 Å²	37	1%	0.012	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	121.4	176.7	-174.7	0	0	0	0	109.3	T46 Y105 V114 V115 T117 A118 I142 I146	T46-V48 HydrophobicContact CG2-CG2 3.95Å; V48-Y105 HydrophobicContact CG1-CE1 4.49Å; V48-Y105 WeakPolarHBondContact CG1-OH 3.3Å; V48-Y105 HydrophobicContact CG2-CE1 4.27Å; V48-V114 HydrophobicContact CG2-CG1 3.98Å; V48-V115 PolarHBondContact N-O 3.12Å; V48-T117 CarbonylContact O-C 3.49Å; V48-T117 WeakPolarHBondContact O-CA 3.46Å; V48-T117 PolarHBondContact O-N 3.39Å; V48-T117 PolarHBondContact O-OG1 2.79Å; V48-A118 HydrophobicContact CG1-CB 4.07Å; V48-A118 PolarHBondContact O-N 3.35Å; V48-A118 VanDerWaalsContact O-N 3.07Å; V48-I142 HydrophobicContact CG1-CD1 4.17Å; V48-I142 HydrophobicContact CG1-CG2 3.9Å; V48-I146 HydrophobicContact CG2-CD1 4.09Å; V48-I146 HydrophobicContact CG2-CG1 4.47Å
49	G	98.1	Very high	96.8	Very high	3 Å²	3	33.7 Å²	33.7	3%	0.031	18%	0.176	C	C	.	.			trans	93.6	121.3	-169.9	0	0	0	0	0	111.3	G54 V73 D74 T117	G49-G54 WeakPolarHBondContact O-CA 3.48Å; G49-V73 PolarHBondContact N-O 3.32Å; G49-D74 WeakPolarHBondContact CA-OD2 3.41Å; G49-T117 PolarHBondContact O-OG1 3.09Å
50	V	98.3	Very high	97.4	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.15	C	C	.	.			trans	-104	34.4	173.2	-58.1	0	0	0	0	111.2	M55 L72 D74 K79 L80 E83	V50-M55 HydrophobicContact CB-CG 4.37Å; V50-M55 HydrophobicContact CB-SD 3.82Å; V50-M55 HydrophobicContact CG1-SD 4.07Å; V50-L72 HydrophobicContact CG1-CB 4.02Å; V50-L72 HydrophobicContact CG1-CD1 4.24Å; V50-D74 HydrophobicContact CB-CB 4.41Å; V50-D74 HydrophobicContact CG1-CB 4.26Å; V50-D74 HydrophobicContact CG2-CB 3.65Å; V50-D74 PolarHBondContact N-OD2 2.66Å; V50-K79 HydrophobicContact CG2-CD 4.13Å; V50-K79 HydrophobicContact CG2-CG 4.18Å; V50-K79 VanDerWaalsContact O-CE 3.26Å; V50-K79 WeakPolarHBondContact O-CE 3.4Å; V50-K79 PolarHBondContact O-NZ 3.46Å; V50-L80 HydrophobicContact CG1-CD1 3.58Å; V50-L80 HydrophobicContact CG2-CD1 4.34Å; V50-E83 HydrophobicContact CB-CG 4.3Å; V50-E83 HydrophobicContact CG2-CG 4.31Å
51	G	97.1	Very high	97.9	Very high	26 Å²	26	23.7 Å²	23.7	27%	0.268	12%	0.123	S	C	.	.	S	Bend	trans	-68.4	-177.1	167.1	0	0	0	0	0	112.1	V53 G54 M55	G51-V53 VanDerWaalsContact C-N 3.26Å; G51-V53 PolarHBondContact O-N 2.8Å; G51-G54 PolarHBondContact O-N 3.38Å; G51-M55 PolarHBondContact O-N 3.46Å
52	Q	97.4	Very high	98.2	Very high	78 Å²	78	22.3 Å²	22.3	36%	0.364	11%	0.114	S	C	.	.	H	α-helix	trans	-58.4	-39.1	-179.8	-61.3	85.7	-7.8	0	0	112.2	A56 Y269 N271	Q52-A56 WeakPolarHBondContact O-CB 3.36Å; Q52-A56 PolarHBondContact O-N 3.04Å; Q52-A56 VanDerWaalsContact O-N 3.16Å; Q52-Y269 HydrophobicContact CB-CD2 3.69Å; Q52-Y269 HydrophobicContact CB-CE2 4Å; Q52-Y269 HydrophobicContact CB-CG 4.28Å; Q52-Y269 HydrophobicContact CG-CD1 4.28Å; Q52-Y269 HydrophobicContact CG-CD2 3.69Å; Q52-Y269 HydrophobicContact CG-CE1 4.39Å; Q52-Y269 HydrophobicContact CG-CE2 3.78Å; Q52-Y269 HydrophobicContact CG-CG 3.96Å; Q52-N271 HydrophobicContact CB-CB 3.99Å; Q52-N271 VanDerWaalsContact O-CB 3.31Å; Q52-N271 WeakPolarHBondContact O-CB 3.34Å
53	V	98.1	Very high	98.5	Very high	35 Å²	35	19.8 Å²	19.8	21%	0.212	11%	0.113	C	C	.	.	H	α-helix	trans	-67.8	-48.8	176.7	176.6	0	0	0	0	111.1	G51 M55 A56 C57 T117 V158 T270 I274	G51-V53 VanDerWaalsContact C-N 3.26Å; G51-V53 PolarHBondContact O-N 2.8Å; V53-M55 PolarHBondContact O-N 3.27Å; V53-A56 PolarHBondContact O-N 3.1Å; V53-C57 PolarHBondContact O-N 2.77Å; V53-C57 PolarHBondContact O-SG 2.96Å; V53-T117 HydrophobicContact CG1-CG2 4.02Å; V53-V158 HydrophobicContact CG1-CG1 3.81Å; V53-T270 WeakPolarHBondContact CG2-O 3.46Å; V53-I274 HydrophobicContact CG1-CG1 4.3Å; V53-I274 HydrophobicContact CG1-CG2 3.95Å; V53-I274 HydrophobicContact CG2-CG2 4.12Å
54	G	98.6	Very high	98.5	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.01	11%	0.113	C	C	.	.	H	α-helix	trans	-56.5	-47.9	178.9	0	0	0	0	0	112.9	G49 G51 A56 C57 A58 T117	G49-G54 WeakPolarHBondContact O-CA 3.48Å; G51-G54 PolarHBondContact O-N 3.38Å; G54-A56 PolarHBondContact O-N 3.28Å; G54-C57 WeakPolarHBondContact O-CB 3.41Å; G54-C57 PolarHBondContact O-N 3.13Å; G54-A58 WeakPolarHBondContact O-CB 3.46Å; G54-A58 PolarHBondContact O-N 2.97Å; G54-T117 WeakPolarHBondContact CA-OG1 3.29Å
55	M	98.8	Very high	98.5	Very high	22 Å²	22	25.7 Å²	25.7	11%	0.108	14%	0.136	C	C	.	.	H	α-helix	trans	-67.1	-35.8	178.2	-65.4	-49.1	-58.8	0	0	112.9	V50 G51 V53 C57 A58 V59 L72 E83 L87	V50-M55 HydrophobicContact CB-CG 4.37Å; V50-M55 HydrophobicContact CB-SD 3.82Å; V50-M55 HydrophobicContact CG1-SD 4.07Å; G51-M55 PolarHBondContact O-N 3.46Å; V53-M55 PolarHBondContact O-N 3.27Å; M55-C57 VanDerWaalsContact C-N 3.35Å; M55-A58 PolarHBondContact O-N 3.12Å; M55-V59 WeakPolarHBondContact O-CB 3.44Å; M55-V59 WeakPolarHBondContact O-CG2 3.2Å; M55-V59 PolarHBondContact O-N 3.13Å; M55-L72 HydrophobicContact SD-CD1 4.41Å; M55-E83 HydrophobicContact CE-CB 3.83Å; M55-E83 HydrophobicContact CE-CG 4.29Å; M55-E83 VanDerWaalsContact CE-OE2 3.25Å; M55-E83 WeakPolarHBondContact CE-OE2 3.3Å; M55-E83 HydrophobicContact CG-CG 4.29Å; M55-E83 HydrophobicContact SD-CB 3.8Å; M55-E83 HydrophobicContact SD-CG 3.92Å; M55-L87 HydrophobicContact CE-CD1 3.77Å; M55-L87 HydrophobicContact CE-CD2 4.38Å; M55-L87 HydrophobicContact CE-CG 4.1Å
56	A	98.8	Very high	98.5	Very high	1 Å²	1	26 Å²	26	1%	0.008	14%	0.137	C	C	.	.	H	α-helix	trans	-65.8	-36.8	173	0	0	0	0	0	112.5	Q52 V53 G54 S60 N271 W272	Q52-A56 WeakPolarHBondContact O-CB 3.36Å; Q52-A56 PolarHBondContact O-N 3.04Å; Q52-A56 VanDerWaalsContact O-N 3.16Å; V53-A56 PolarHBondContact O-N 3.1Å; G54-A56 PolarHBondContact O-N 3.28Å; A56-S60 VanDerWaalsContact O-CB 3.27Å; A56-S60 WeakPolarHBondContact O-CB 3.39Å; A56-S60 PolarHBondContact O-N 3.36Å; A56-S60 VanDerWaalsContact O-N 3.15Å; A56-S60 PolarHBondContact O-OG 2.76Å; A56-N271 HydrophobicContact CB-CB 3.88Å; A56-N271 WeakPolarHBondContact CB-O 3.43Å; A56-W272 HydrophobicContact CB-CE3 3.97Å; A56-W272 HydrophobicContact CB-CZ3 4.21Å
57	C	98.9	Very high	98.5	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.7	-51.2	172.4	-62.1	0	0	0	0	110.6	V53 G54 M55 V59 S60 I61 V278	V53-C57 PolarHBondContact O-N 2.77Å; V53-C57 PolarHBondContact O-SG 2.96Å; G54-C57 WeakPolarHBondContact O-CB 3.41Å; G54-C57 PolarHBondContact O-N 3.13Å; M55-C57 VanDerWaalsContact C-N 3.35Å; C57-V59 PolarHBondContact O-N 3.13Å; C57-S60 PolarHBondContact O-N 2.96Å; C57-I61 WeakPolarHBondContact O-CB 3.5Å; C57-I61 WeakPolarHBondContact O-CD1 3.27Å; C57-I61 WeakPolarHBondContact O-CG1 3.27Å; C57-I61 PolarHBondContact O-N 3.07Å; C57-V278 HydrophobicContact CB-CG1 4.29Å
58	A	98.9	Very high	98.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-55.1	-52.7	-179.2	0	0	0	0	0	112.2	V47 G54 M55 S60 I61 L62 L70 L72	V47-A58 HydrophobicContact CG2-CB 4.33Å; G54-A58 WeakPolarHBondContact O-CB 3.46Å; G54-A58 PolarHBondContact O-N 2.97Å; M55-A58 PolarHBondContact O-N 3.12Å; A58-S60 PolarHBondContact O-N 3.09Å; A58-I61 PolarHBondContact O-N 3.03Å; A58-L62 VanDerWaalsContact O-CG 3.32Å; A58-L62 WeakPolarHBondContact O-CG 2.77Å; A58-L62 PolarHBondContact O-N 2.99Å; A58-L70 HydrophobicContact CB-CD2 4.06Å; A58-L72 HydrophobicContact CB-CD2 4.05Å
59	V	98.8	Very high	98.4	Very high	48 Å²	48	29.1 Å²	29.1	29%	0.291	15%	0.154	S	C	.	.	H	α-helix	trans	-62.7	-42.2	179	171.8	0	0	0	0	111.4	M55 C57 I61 L62 L63 L87	M55-V59 WeakPolarHBondContact O-CB 3.44Å; M55-V59 WeakPolarHBondContact O-CG2 3.2Å; M55-V59 PolarHBondContact O-N 3.13Å; C57-V59 PolarHBondContact O-N 3.13Å; V59-I61 VanDerWaalsContact C-N 3.31Å; V59-I61 PolarHBondContact O-N 3.29Å; V59-L62 PolarHBondContact O-N 3.36Å; V59-L63 HydrophobicContact CG1-CD1 3.68Å; V59-L63 HydrophobicContact CG1-CG 4.13Å; V59-L63 WeakPolarHBondContact O-CB 3.28Å; V59-L63 VanDerWaalsContact O-CG 3.29Å; V59-L63 WeakPolarHBondContact O-CG 3.44Å; V59-L63 PolarHBondContact O-N 2.98Å; V59-L87 HydrophobicContact CG2-CD2 3.75Å
60	S	98.9	Very high	98.4	Very high	12 Å²	12	29 Å²	29	8%	0.084	15%	0.153	C	C	.	.	H	α-helix	trans	-63.8	-37.1	179	-58.7	0	0	0	0	112.3	A56 C57 A58 R64	A56-S60 VanDerWaalsContact O-CB 3.27Å; A56-S60 WeakPolarHBondContact O-CB 3.39Å; A56-S60 PolarHBondContact O-N 3.36Å; A56-S60 VanDerWaalsContact O-N 3.15Å; A56-S60 PolarHBondContact O-OG 2.76Å; C57-S60 PolarHBondContact O-N 2.96Å; A58-S60 PolarHBondContact O-N 3.09Å; S60-R64 WeakPolarHBondContact O-CB 3.38Å; S60-R64 WeakPolarHBondContact O-CG 3.3Å; S60-R64 PolarHBondContact O-N 3.39Å; S60-R64 VanDerWaalsContact O-N 3.14Å
61	I	98.8	Very high	98.5	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-68.6	-42.3	176.9	-70.5	165	0	0	0	111	V45 V47 C57 A58 V59 R64 E65 L66 A67 V115 A279 T282	V45-I61 HydrophobicContact CB-CG2 4.44Å; V45-I61 HydrophobicContact CG1-CD1 4.1Å; V45-I61 HydrophobicContact CG1-CG2 4.38Å; V45-I61 HydrophobicContact CG2-CG2 4.42Å; V47-I61 HydrophobicContact CG2-CD1 4.44Å; C57-I61 WeakPolarHBondContact O-CB 3.5Å; C57-I61 WeakPolarHBondContact O-CD1 3.27Å; C57-I61 WeakPolarHBondContact O-CG1 3.27Å; C57-I61 PolarHBondContact O-N 3.07Å; A58-I61 PolarHBondContact O-N 3.03Å; V59-I61 VanDerWaalsContact C-N 3.31Å; V59-I61 PolarHBondContact O-N 3.29Å; I61-R64 PolarHBondContact O-N 2.9Å; I61-E65 PolarHBondContact O-N 3.05Å; I61-L66 HydrophobicContact CG2-CB 4.1Å; I61-L66 PolarHBondContact O-N 2.97Å; I61-A67 HydrophobicContact CG2-CB 4.42Å; I61-V115 HydrophobicContact CD1-CG2 4.33Å; I61-A279 HydrophobicContact CG1-CB 4.33Å; I61-T282 HydrophobicContact CD1-CG2 4.45Å; I61-T282 HydrophobicContact CG1-CG2 4.36Å
62	L	98.8	Very high	98.6	Very high	3 Å²	3	27.8 Å²	27.8	2%	0.016	14%	0.14	C	C	.	.	H	α-helix	trans	-63	-47.8	176	-71.2	169.3	0	0	0	111.7	A58 V59 R64 E65 L70 L87 L94 T96 I99	A58-L62 VanDerWaalsContact O-CG 3.32Å; A58-L62 WeakPolarHBondContact O-CG 2.77Å; A58-L62 PolarHBondContact O-N 2.99Å; V59-L62 PolarHBondContact O-N 3.36Å; L62-R64 VanDerWaalsContact C-N 3.26Å; L62-R64 PolarHBondContact O-N 2.82Å; L62-E65 PolarHBondContact O-N 3.33Å; L62-L70 HydrophobicContact CD1-CD2 3.73Å; L62-L70 HydrophobicContact CD2-CB 4.16Å; L62-L70 HydrophobicContact CD2-CD2 3.87Å; L62-L70 HydrophobicContact CG-CD2 3.79Å; L62-L87 HydrophobicContact CD1-CD1 4.07Å; L62-L87 HydrophobicContact CD1-CD2 3.89Å; L62-L87 HydrophobicContact CD1-CG 4.42Å; L62-L94 HydrophobicContact CB-CD1 4.27Å; L62-L94 HydrophobicContact CB-CD2 4.08Å; L62-L94 HydrophobicContact CD1-CD1 4Å; L62-L94 HydrophobicContact CD2-CD1 4.31Å; L62-L94 HydrophobicContact CG-CD1 4.43Å; L62-T96 HydrophobicContact CD2-CG2 3.87Å; L62-T96 WeakPolarHBondContact CD2-OG1 3.37Å; L62-I99 HydrophobicContact CD1-CD1 3.96Å; L62-I99 HydrophobicContact CD2-CD1 3.94Å; L62-I99 HydrophobicContact CD2-CG1 4.26Å
63	L	98.6	Very high	98.6	Very high	120 Å²	120	24.1 Å²	24.1	63%	0.628	12%	0.123	S	C	*	.	H	α-helix	trans	-68.9	-23	-178.6	-68.8	176.8	0	0	0	113.3	V59 E65 L94	V59-L63 HydrophobicContact CG1-CD1 3.68Å; V59-L63 HydrophobicContact CG1-CG 4.13Å; V59-L63 WeakPolarHBondContact O-CB 3.28Å; V59-L63 VanDerWaalsContact O-CG 3.29Å; V59-L63 WeakPolarHBondContact O-CG 3.44Å; V59-L63 PolarHBondContact O-N 2.98Å; L63-E65 VanDerWaalsContact C-N 3.34Å; L63-L94 HydrophobicContact CD2-CD2 4.06Å
64	R	98.3	Very high	98.6	Very high	78 Å²	78	23.8 Å²	23.8	29%	0.294	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	2.1	172.3	-72.7	-164	-174.8	-157.2	6.4	113.9	S60 I61 L62 L66 D280 E283 R287	S60-R64 WeakPolarHBondContact O-CB 3.38Å; S60-R64 WeakPolarHBondContact O-CG 3.3Å; S60-R64 PolarHBondContact O-N 3.39Å; S60-R64 VanDerWaalsContact O-N 3.14Å; I61-R64 PolarHBondContact O-N 2.9Å; L62-R64 VanDerWaalsContact C-N 3.26Å; L62-R64 PolarHBondContact O-N 2.82Å; R64-L66 VanDerWaalsContact C-N 3.3Å; R64-L66 HydrophobicContact CB-CD1 3.92Å; R64-L66 HydrophobicContact CB-CD2 4.04Å; R64-L66 HydrophobicContact CB-CG 3.64Å; R64-L66 WeakPolarHBondContact O-CD2 3.31Å; R64-L66 PolarHBondContact O-N 3.3Å; R64-D280 IonicContact NH1-OD1 2.75Å; R64-D280 PolarHBondContact NH1-OD1 2.94Å; R64-E283 IonicContact CZ-OE2 3.59Å; R64-E283 IonicContact NH1-OE2 3.38Å; R64-E283 PolarHBondContact NH1-OE2 3.24Å; R64-R287 PolarHBondContact O-NH2 3.46Å
65	E	98.2	Very high	98.5	Very high	111 Å²	111	29 Å²	29	52%	0.519	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	42.6	177.1	-50.6	179.9	171.4	0	0	112.3	I61 L62 L63 K95	I61-E65 PolarHBondContact O-N 3.05Å; L62-E65 PolarHBondContact O-N 3.33Å; L63-E65 VanDerWaalsContact C-N 3.34Å; E65-K95 HydrophobicContact CB-CB 4.43Å; E65-K95 HydrophobicContact CG-CB 3.99Å; E65-K95 HydrophobicContact CG-CG 3.89Å; E65-K95 WeakPolarHBondContact OE1-CG 3.42Å
66	L	98.4	Very high	98.5	Very high	5 Å²	5	31.7 Å²	31.7	3%	0.026	17%	0.169	C	C	.	.			trans	-89.9	-12.9	-173.1	-58.2	-179.8	0	0	0	113.9	I61 R64 A279 T282 E283 M286	I61-L66 HydrophobicContact CG2-CB 4.1Å; I61-L66 PolarHBondContact O-N 2.97Å; R64-L66 VanDerWaalsContact C-N 3.3Å; R64-L66 HydrophobicContact CB-CD1 3.92Å; R64-L66 HydrophobicContact CB-CD2 4.04Å; R64-L66 HydrophobicContact CB-CG 3.64Å; R64-L66 WeakPolarHBondContact O-CD2 3.31Å; R64-L66 PolarHBondContact O-N 3.3Å; L66-A279 WeakPolarHBondContact CD1-O 3.41Å; L66-T282 HydrophobicContact CB-CG2 4.44Å; L66-T282 HydrophobicContact CD1-CG2 3.91Å; L66-E283 HydrophobicContact CD1-CB 3.99Å; L66-E283 HydrophobicContact CD2-CB 3.81Å; L66-E283 HydrophobicContact CD2-CG 3.81Å; L66-M286 WeakPolarHBondContact O-CG 3.36Å
67	A	98.2	Very high	98.4	Very high	8 Å²	8	37.1 Å²	37.1	7%	0.066	19%	0.194	C	C	.	.			trans	-133.9	141.7	-174	0	0	0	0	0	112.1	N43 V45 I61 T96	N43-A67 VanDerWaalsContact O-CA 3.32Å; N43-A67 WeakPolarHBondContact O-CA 3.48Å; N43-A67 WeakPolarHBondContact O-CB 3.44Å; V45-A67 HydrophobicContact CB-CB 4.1Å; V45-A67 HydrophobicContact CG2-CB 3.81Å; I61-A67 HydrophobicContact CG2-CB 4.42Å; A67-T96 WeakPolarHBondContact O-CB 3.31Å; A67-T96 WeakPolarHBondContact O-CG2 3.38Å; A67-T96 PolarHBondContact O-OG1 3.11Å
68	D	98.1	Very high	98.3	Very high	48 Å²	48	44.1 Å²	44.1	26%	0.257	23%	0.232	S	C	.	.	S	Bend	trans	-88.4	-17.1	167.1	58.2	-8.7	0	0	0	112.3	R42 N43 K44 P97	R42-D68 PolarHBondContact N-OD2 3.13Å; N43-D68 VanDerWaalsContact CA-OD1 3.28Å; N43-D68 WeakPolarHBondContact CA-OD1 3.42Å; N43-D68 PolarHBondContact N-OD1 2.92Å; N43-D68 PolarHBondContact N-OD2 2.81Å; K44-D68 PolarHBondContact N-OD1 2.92Å; D68-P97 WeakPolarHBondContact O-CD 3.41Å; D68-P97 VanDerWaalsContact O-CG 3.24Å; D68-P97 WeakPolarHBondContact O-CG 3.49Å
69	E	98.7	Very high	98.3	Very high	13 Å²	13	48 Å²	48	6%	0.061	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	129	168.5	-175.7	169.9	134.1	0	0	109.8	P41 K44 V45 K98 V100	P41-E69 HydrophobicContact CB-CB 3.72Å; P41-E69 HydrophobicContact CG-CB 4.17Å; K44-E69 VanDerWaalsContact CA-O 3.3Å; K44-E69 WeakPolarHBondContact CA-O 3.47Å; K44-E69 HydrophobicContact CB-CB 4.21Å; K44-E69 HydrophobicContact CD-CB 4.37Å; K44-E69 HydrophobicContact CD-CG 4.18Å; K44-E69 WeakPolarHBondContact CE-OE1 3.31Å; K44-E69 HydrophobicContact CG-CB 4.02Å; K44-E69 HydrophobicContact CG-CG 4.2Å; K44-E69 IonicContact NZ-OE1 3.5Å; K44-E69 PolarHBondContact NZ-OE1 2.94Å; V45-E69 PolarHBondContact N-O 3.13Å; E69-K98 WeakPolarHBondContact CA-O 3.49Å; E69-K98 HydrophobicContact CG-CB 4.22Å; E69-K98 HydrophobicContact CG-CD 4.24Å; E69-K98 HydrophobicContact CG-CG 4.09Å; E69-K98 IonicContact OE1-NZ 3.72Å; E69-K98 VanDerWaalsContact OE2-CD 3.26Å; E69-K98 WeakPolarHBondContact OE2-CD 3.32Å; E69-K98 VanDerWaalsContact OE2-CE 3.32Å; E69-K98 WeakPolarHBondContact OE2-CE 3.32Å; E69-K98 IonicContact OE2-NZ 2.85Å; E69-K98 PolarHBondContact OE2-NZ 3.46Å; E69-V100 HydrophobicContact CG-CG2 4.47Å
70	L	98.9	Very high	98.3	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.2	169.7	-178.9	72.4	0	0	0	109.2	V45 V47 A58 L62 L72 L87 T96 K98 I99 V100	V45-L70 HydrophobicContact CB-CD1 4.39Å; V45-L70 HydrophobicContact CG1-CD1 4.43Å; V45-L70 WeakPolarHBondContact O-CA 3.37Å; V47-L70 HydrophobicContact CG2-CD1 4.16Å; A58-L70 HydrophobicContact CB-CD2 4.06Å; L62-L70 HydrophobicContact CD1-CD2 3.73Å; L62-L70 HydrophobicContact CD2-CB 4.16Å; L62-L70 HydrophobicContact CD2-CD2 3.87Å; L62-L70 HydrophobicContact CG-CD2 3.79Å; L70-L72 HydrophobicContact CD2-CD2 4.2Å; L70-L72 HydrophobicContact CG-CD2 4.3Å; L70-L87 HydrophobicContact CD2-CD1 4.33Å; L70-T96 HydrophobicContact CB-CG2 4.44Å; L70-K98 PolarHBondContact N-O 2.59Å; L70-I99 HydrophobicContact CB-CG1 4.45Å; L70-I99 HydrophobicContact CD2-CG2 4.39Å; L70-I99 WeakPolarHBondContact O-CA 3.37Å; L70-V100 PolarHBondContact O-N 2.75Å
71	A	98.9	Very high	98.3	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	136.7	171.1	0	0	0	0	0	111.1	V45 T46 V47 V100	V45-A71 PolarHBondContact O-N 2.96Å; T46-A71 CarbonylContact C-O 3.53Å; T46-A71 VanDerWaalsContact CA-O 3.27Å; T46-A71 WeakPolarHBondContact CA-O 3.26Å; V47-A71 PolarHBondContact N-O 2.96Å; A71-V100 CarbonylContact C-O 3.44Å; A71-V100 VanDerWaalsContact CA-O 3.3Å; A71-V100 WeakPolarHBondContact CA-O 3.47Å; A71-V100 HydrophobicContact CB-CG2 3.91Å
72	L	98.9	Very high	98.2	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	138.2	174.3	-56.7	179.3	0	0	0	110	V47 V50 M55 A58 L70 L80 L87 V100 A101 D102	V47-L72 HydrophobicContact CB-CD2 3.91Å; V47-L72 HydrophobicContact CG2-CD2 4.47Å; V50-L72 HydrophobicContact CG1-CB 4.02Å; V50-L72 HydrophobicContact CG1-CD1 4.24Å; M55-L72 HydrophobicContact SD-CD1 4.41Å; A58-L72 HydrophobicContact CB-CD2 4.05Å; L70-L72 HydrophobicContact CD2-CD2 4.2Å; L70-L72 HydrophobicContact CG-CD2 4.3Å; L72-L80 HydrophobicContact CB-CD1 3.77Å; L72-L87 HydrophobicContact CD1-CD1 3.94Å; L72-V100 PolarHBondContact N-O 3.29Å; L72-A101 HydrophobicContact CB-CB 3.87Å; L72-A101 VanDerWaalsContact O-CA 3.23Å; L72-A101 WeakPolarHBondContact O-CA 3.31Å; L72-D102 PolarHBondContact O-N 3.26Å; L72-D102 VanDerWaalsContact O-N 3.17Å
73	V	98.8	Very high	98.3	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.012	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	130	175.2	178.8	0	0	0	0	110	T46 V47 G49 D102 Y105 V107 T108	T46-V73 HydrophobicContact CG2-CG2 4.41Å; V47-V73 PolarHBondContact O-N 3.08Å; G49-V73 PolarHBondContact N-O 3.32Å; V73-D102 WeakPolarHBondContact CA-O 3.49Å; V73-Y105 HydrophobicContact CG1-CD1 4.47Å; V73-Y105 HydrophobicContact CG1-CD2 4.17Å; V73-Y105 HydrophobicContact CG1-CE1 4.08Å; V73-Y105 HydrophobicContact CG1-CE2 3.75Å; V73-V107 HydrophobicContact CG2-CG1 3.65Å; V73-T108 HydrophobicContact CG2-CG2 3.34Å
74	D	98.3	Very high	98.3	Very high	28 Å²	28	51.1 Å²	51.1	15%	0.15	26%	0.264	C	S	.	.			trans	-153.2	161.9	170.9	-157.9	-71.3	0	0	0	109.9	G49 V50 V76 L80	G49-D74 WeakPolarHBondContact CA-OD2 3.41Å; V50-D74 HydrophobicContact CB-CB 4.41Å; V50-D74 HydrophobicContact CG1-CB 4.26Å; V50-D74 HydrophobicContact CG2-CB 3.65Å; V50-D74 PolarHBondContact N-OD2 2.66Å; D74-V76 PolarHBondContact OD1-N 3.2Å; D74-L80 HydrophobicContact CB-CB 4.35Å; D74-L80 HydrophobicContact CB-CD1 4.05Å; D74-L80 HydrophobicContact CB-CD2 4.48Å
75	V	96.6	Very high	98.3	Very high	110 Å²	110	51.1 Å²	51.1	67%	0.667	27%	0.268	S	S	*	.	S	Bend	trans	-83.8	-19.2	177.5	-62.5	0	0	0	0	112.7	E77	V75-E77 PolarHBondContact O-N 3.38Å
76	V	97.1	Very high	98.3	Very high	78 Å²	78	51.2 Å²	51.2	47%	0.473	27%	0.273	S	S	.	.			trans	-90	89	-179.8	-171.6	0	0	0	0	110.1	D74 D78 K79 L80	D74-V76 PolarHBondContact OD1-N 3.2Å; V76-D78 PolarHBondContact O-N 3.27Å; V76-K79 HydrophobicContact CB-CB 4.14Å; V76-K79 HydrophobicContact CG1-CB 3.71Å; V76-K79 PolarHBondContact O-N 3.34Å; V76-L80 WeakPolarHBondContact O-CB 3.23Å; V76-L80 PolarHBondContact O-N 3.43Å
77	E	96.6	Very high	98.3	Very high	115 Å²	115	52 Å²	52	54%	0.537	28%	0.277	S	S	.	.	H	α-helix	trans	-55.7	-47.7	-169.8	-68.5	172.8	-149.5	0	0	114.3	V75 K79 L80 K81 K103	V75-E77 PolarHBondContact O-N 3.38Å; E77-K79 VanDerWaalsContact C-N 3.35Å; E77-K79 PolarHBondContact O-N 3.4Å; E77-L80 PolarHBondContact O-N 2.59Å; E77-K81 WeakPolarHBondContact O-CB 3.38Å; E77-K81 PolarHBondContact O-N 3.11Å; E77-K103 HydrophobicContact CG-CB 4.42Å; E77-K103 HydrophobicContact CG-CD 3.95Å; E77-K103 VanDerWaalsContact OE1-CD 3.23Å; E77-K103 WeakPolarHBondContact OE1-CD 3.17Å; E77-K103 IonicContact OE1-NZ 3.23Å; E77-K103 PolarHBondContact OE1-NZ 3.23Å
78	D	97.9	Very high	98.3	Very high	147 Å²	147	55.1 Å²	55.1	79%	0.786	29%	0.29	S	S	*	.	H	α-helix	trans	-63.3	-42.6	-179.5	-74.7	-21.4	0	0	0	112	V76 G82	V76-D78 PolarHBondContact O-N 3.27Å; D78-G82 PolarHBondContact O-N 3.23Å
79	K	98.3	Very high	98.4	Very high	82 Å²	82	59.4 Å²	59.4	36%	0.357	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-48.3	176.7	-171.5	-176.7	-175.8	-164	0	110.2	V50 V76 E77 K81 G82 E83	V50-K79 HydrophobicContact CG2-CD 4.13Å; V50-K79 HydrophobicContact CG2-CG 4.18Å; V50-K79 VanDerWaalsContact O-CE 3.26Å; V50-K79 WeakPolarHBondContact O-CE 3.4Å; V50-K79 PolarHBondContact O-NZ 3.46Å; V76-K79 HydrophobicContact CB-CB 4.14Å; V76-K79 HydrophobicContact CG1-CB 3.71Å; V76-K79 PolarHBondContact O-N 3.34Å; E77-K79 VanDerWaalsContact C-N 3.35Å; E77-K79 PolarHBondContact O-N 3.4Å; K79-K81 VanDerWaalsContact C-N 3.31Å; K79-K81 PolarHBondContact O-N 2.84Å; K79-G82 PolarHBondContact O-N 2.87Å; K79-G82 VanDerWaalsContact O-N 3.15Å; K79-E83 WeakPolarHBondContact CE-OE1 3.45Å; K79-E83 HydrophobicContact CG-CG 4.16Å; K79-E83 VanDerWaalsContact O-CG 3.25Å; K79-E83 WeakPolarHBondContact O-CG 3.49Å; K79-E83 PolarHBondContact O-N 3.46Å
80	L	98.6	Very high	98.4	Very high	5 Å²	5	59.8 Å²	59.8	3%	0.026	32%	0.316	C	S	.	.	H	α-helix	trans	-55.7	-46.3	179.1	-178.1	62.2	0	0	0	112	V50 L72 D74 V76 E77 M84 A101 D102	V50-L80 HydrophobicContact CG1-CD1 3.58Å; V50-L80 HydrophobicContact CG2-CD1 4.34Å; L72-L80 HydrophobicContact CB-CD1 3.77Å; D74-L80 HydrophobicContact CB-CB 4.35Å; D74-L80 HydrophobicContact CB-CD1 4.05Å; D74-L80 HydrophobicContact CB-CD2 4.48Å; V76-L80 WeakPolarHBondContact O-CB 3.23Å; V76-L80 PolarHBondContact O-N 3.43Å; E77-L80 PolarHBondContact O-N 2.59Å; L80-M84 WeakPolarHBondContact O-CB 3.46Å; L80-M84 PolarHBondContact O-N 3.33Å; L80-A101 HydrophobicContact CD1-CB 3.74Å; L80-A101 HydrophobicContact CD2-CB 4.35Å; L80-A101 HydrophobicContact CG-CB 3.78Å; L80-D102 WeakPolarHBondContact CD2-O 3.3Å
81	K	98.4	Very high	98.3	Very high	125 Å²	125	62.1 Å²	62.1	54%	0.543	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-43	176.8	-175.5	177.7	179.1	-179.3	0	111.9	E77 K79 M84 M85	E77-K81 WeakPolarHBondContact O-CB 3.38Å; E77-K81 PolarHBondContact O-N 3.11Å; K79-K81 VanDerWaalsContact C-N 3.31Å; K79-K81 PolarHBondContact O-N 2.84Å; K81-M84 PolarHBondContact O-N 3.18Å; K81-M85 HydrophobicContact CG-CG 4.49Å; K81-M85 HydrophobicContact CG-SD 4.05Å; K81-M85 WeakPolarHBondContact O-CB 3.27Å; K81-M85 VanDerWaalsContact O-CG 3.29Å; K81-M85 WeakPolarHBondContact O-CG 3.18Å; K81-M85 PolarHBondContact O-N 2.95Å
82	G	98.7	Very high	98.3	Very high	38 Å²	38	69.3 Å²	69.3	39%	0.392	37%	0.369	S	S	.	.	H	α-helix	trans	-59.9	-50.8	177.1	0	0	0	0	0	112.5	D78 K79 M84 M85 D86	D78-G82 PolarHBondContact O-N 3.23Å; K79-G82 PolarHBondContact O-N 2.87Å; K79-G82 VanDerWaalsContact O-N 3.15Å; G82-M84 VanDerWaalsContact C-N 3.34Å; G82-M84 PolarHBondContact O-N 3.19Å; G82-M85 PolarHBondContact O-N 3.42Å; G82-D86 PolarHBondContact O-N 2.82Å
83	E	98.8	Very high	98.2	Very high	51 Å²	51	77.3 Å²	77.3	24%	0.238	41%	0.405	C	S	.	.	H	α-helix	trans	-61.4	-41.6	178.4	-63.8	-72.4	-175.4	0	0	111.6	V50 M55 K79 L87	V50-E83 HydrophobicContact CB-CG 4.3Å; V50-E83 HydrophobicContact CG2-CG 4.31Å; M55-E83 HydrophobicContact CE-CB 3.83Å; M55-E83 HydrophobicContact CE-CG 4.29Å; M55-E83 VanDerWaalsContact CE-OE2 3.25Å; M55-E83 WeakPolarHBondContact CE-OE2 3.3Å; M55-E83 HydrophobicContact CG-CG 4.29Å; M55-E83 HydrophobicContact SD-CB 3.8Å; M55-E83 HydrophobicContact SD-CG 3.92Å; K79-E83 WeakPolarHBondContact CE-OE1 3.45Å; K79-E83 HydrophobicContact CG-CG 4.16Å; K79-E83 VanDerWaalsContact O-CG 3.25Å; K79-E83 WeakPolarHBondContact O-CG 3.49Å; K79-E83 PolarHBondContact O-N 3.46Å; E83-L87 WeakPolarHBondContact O-CG 3.43Å; E83-L87 PolarHBondContact O-N 2.88Å; E83-L87 VanDerWaalsContact O-N 3.15Å
84	M	98.8	Very high	98.2	Very high	30 Å²	30	78.6 Å²	78.6	15%	0.148	41%	0.411	C	S	.	.	H	α-helix	trans	-61.3	-48.9	174.9	-178.6	-164.7	65.3	0	0	111.9	L80 K81 G82 D86 L87 Q88 I99 A101	L80-M84 WeakPolarHBondContact O-CB 3.46Å; L80-M84 PolarHBondContact O-N 3.33Å; K81-M84 PolarHBondContact O-N 3.18Å; G82-M84 VanDerWaalsContact C-N 3.34Å; G82-M84 PolarHBondContact O-N 3.19Å; M84-D86 VanDerWaalsContact C-N 3.32Å; M84-D86 PolarHBondContact O-N 3.32Å; M84-L87 PolarHBondContact O-N 3.33Å; M84-Q88 HydrophobicContact CG-CG 4.38Å; M84-Q88 WeakPolarHBondContact O-CB 3.06Å; M84-Q88 VanDerWaalsContact O-CG 3.28Å; M84-Q88 WeakPolarHBondContact O-CG 3.43Å; M84-Q88 PolarHBondContact O-N 2.87Å; M84-I99 HydrophobicContact CG-CG2 4.47Å; M84-A101 HydrophobicContact CB-CB 3.64Å; M84-A101 HydrophobicContact CG-CB 3.77Å; M84-A101 HydrophobicContact SD-CB 3.64Å; M84-A101 PolarHBondContact SD-N 2.99Å; M84-A101 VanDerWaalsContact SD-N 3.36Å
85	M	98.8	Very high	98.2	Very high	77 Å²	77	84.5 Å²	84.5	38%	0.379	44%	0.435	S	S	.	.	H	α-helix	trans	-63	-40.3	-178.4	-75.1	178.1	61.2	0	0	111.6	K81 G82 Q88 H89	K81-M85 HydrophobicContact CG-CG 4.49Å; K81-M85 HydrophobicContact CG-SD 4.05Å; K81-M85 WeakPolarHBondContact O-CB 3.27Å; K81-M85 VanDerWaalsContact O-CG 3.29Å; K81-M85 WeakPolarHBondContact O-CG 3.18Å; K81-M85 PolarHBondContact O-N 2.95Å; G82-M85 PolarHBondContact O-N 3.42Å; M85-Q88 PolarHBondContact O-N 3.15Å; M85-H89 PolarHBondContact O-CD2 2.93Å; M85-H89 PolarHBondContact O-N 3.45Å; M85-H89 PolarHBondContact O-ND1 3.24Å
86	D	98.8	Very high	98.3	Very high	114 Å²	114	79.4 Å²	79.4	61%	0.61	40%	0.404	S	S	*	.	H	α-helix	trans	-63.2	-45.6	178.6	-162.3	21.9	0	0	0	111.4	G82 M84 Q88 H89 G90	G82-D86 PolarHBondContact O-N 2.82Å; M84-D86 VanDerWaalsContact C-N 3.32Å; M84-D86 PolarHBondContact O-N 3.32Å; D86-Q88 VanDerWaalsContact C-N 3.33Å; D86-Q88 PolarHBondContact O-N 2.99Å; D86-H89 PolarHBondContact O-N 2.92Å; D86-G90 PolarHBondContact O-N 2.78Å
87	L	98.7	Very high	98.2	Very high	21 Å²	21	80.9 Å²	80.9	11%	0.11	42%	0.416	C	S	.	.	H	α-helix	trans	-61.7	-40.1	172.6	-67.1	178.7	0	0	0	112.4	M55 V59 L62 L70 L72 E83 M84 G90 S91 I99	M55-L87 HydrophobicContact CE-CD1 3.77Å; M55-L87 HydrophobicContact CE-CD2 4.38Å; M55-L87 HydrophobicContact CE-CG 4.1Å; V59-L87 HydrophobicContact CG2-CD2 3.75Å; L62-L87 HydrophobicContact CD1-CD1 4.07Å; L62-L87 HydrophobicContact CD1-CD2 3.89Å; L62-L87 HydrophobicContact CD1-CG 4.42Å; L70-L87 HydrophobicContact CD2-CD1 4.33Å; L72-L87 HydrophobicContact CD1-CD1 3.94Å; E83-L87 WeakPolarHBondContact O-CG 3.43Å; E83-L87 PolarHBondContact O-N 2.88Å; E83-L87 VanDerWaalsContact O-N 3.15Å; M84-L87 PolarHBondContact O-N 3.33Å; L87-G90 WeakPolarHBondContact O-CA 3.41Å; L87-G90 PolarHBondContact O-N 3.11Å; L87-G90 VanDerWaalsContact O-N 3.13Å; L87-S91 PolarHBondContact O-N 3.03Å; L87-I99 HydrophobicContact CB-CD1 3.91Å; L87-I99 HydrophobicContact CB-CG2 4.3Å; L87-I99 HydrophobicContact CD1-CG2 4.37Å
88	Q	98.8	Very high	98.3	Very high	74 Å²	74	80.1 Å²	80.1	35%	0.346	41%	0.411	S	S	.	.	H	α-helix	trans	-65.8	-37.4	177.6	-77.2	175.8	-15.8	0	0	112.4	M84 M85 D86 G90 S91 I99	M84-Q88 HydrophobicContact CG-CG 4.38Å; M84-Q88 WeakPolarHBondContact O-CB 3.06Å; M84-Q88 VanDerWaalsContact O-CG 3.28Å; M84-Q88 WeakPolarHBondContact O-CG 3.43Å; M84-Q88 PolarHBondContact O-N 2.87Å; M85-Q88 PolarHBondContact O-N 3.15Å; D86-Q88 VanDerWaalsContact C-N 3.33Å; D86-Q88 PolarHBondContact O-N 2.99Å; Q88-G90 PolarHBondContact O-N 3.34Å; Q88-S91 WeakPolarHBondContact CA-OG 3.44Å; Q88-S91 WeakPolarHBondContact O-CB 3.34Å; Q88-S91 PolarHBondContact O-N 2.77Å; Q88-S91 PolarHBondContact O-OG 2.9Å; Q88-I99 HydrophobicContact CG-CB 4.17Å; Q88-I99 PolarHBondContact NE2-O 3.06Å
89	H	98.6	Very high	98.4	Very high	138 Å²	138	73.4 Å²	73.4	64%	0.639	38%	0.375	S	S	*	.	H	α-helix	trans	-61.3	-28.7	173.4	-64.5	161.7	0	0	0	111.8	M85 D86 S91	M85-H89 PolarHBondContact O-CD2 2.93Å; M85-H89 PolarHBondContact O-N 3.45Å; M85-H89 PolarHBondContact O-ND1 3.24Å; D86-H89 PolarHBondContact O-N 2.92Å; H89-S91 VanDerWaalsContact C-N 3.32Å; H89-S91 PolarHBondContact O-N 3.44Å
90	G	98.3	Very high	98.4	Very high	21 Å²	21	71 Å²	71	22%	0.216	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-3.4	172.6	0	0	0	0	0	115.6	D86 L87 Q88 L92 F93	D86-G90 PolarHBondContact O-N 2.78Å; L87-G90 WeakPolarHBondContact O-CA 3.41Å; L87-G90 PolarHBondContact O-N 3.11Å; L87-G90 VanDerWaalsContact O-N 3.13Å; Q88-G90 PolarHBondContact O-N 3.34Å; G90-L92 PolarHBondContact O-N 3.1Å; G90-F93 PolarHBondContact O-N 3.21Å
91	S	97.7	Very high	98.4	Very high	48 Å²	48	71.8 Å²	71.8	34%	0.336	37%	0.374	S	S	.	.	G	3₁₀ helix	trans	-55.8	-31.2	-170.1	-60.9	0	0	0	0	114.3	L87 Q88 H89 F93 L94	L87-S91 PolarHBondContact O-N 3.03Å; Q88-S91 WeakPolarHBondContact CA-OG 3.44Å; Q88-S91 WeakPolarHBondContact O-CB 3.34Å; Q88-S91 PolarHBondContact O-N 2.77Å; Q88-S91 PolarHBondContact O-OG 2.9Å; H89-S91 VanDerWaalsContact C-N 3.32Å; H89-S91 PolarHBondContact O-N 3.44Å; S91-F93 PolarHBondContact O-N 2.88Å; S91-L94 PolarHBondContact O-N 3.45Å; S91-L94 VanDerWaalsContact O-N 3.12Å
92	L	98.2	Very high	98.4	Very high	151 Å²	151	69.7 Å²	69.7	79%	0.791	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-58.9	-30.4	176.6	179.7	62.3	0	0	0	112.6	G90	G90-L92 PolarHBondContact O-N 3.1Å
93	F	98.4	Very high	98.3	Very high	169 Å²	169	72.5 Å²	72.5	74%	0.741	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-94.5	0.8	-177.6	-48.1	-62.8	0	0	0	112.9	G90 S91	G90-F93 PolarHBondContact O-N 3.21Å; S91-F93 PolarHBondContact O-N 2.88Å
94	L	98.1	Very high	98.3	Very high	28 Å²	28	73.9 Å²	73.9	15%	0.147	38%	0.379	C	S	.	.			trans	-114.5	161.2	-176.9	-60.7	177.3	0	0	0	110.9	L62 L63 S91 I99	L62-L94 HydrophobicContact CB-CD1 4.27Å; L62-L94 HydrophobicContact CB-CD2 4.08Å; L62-L94 HydrophobicContact CD1-CD1 4Å; L62-L94 HydrophobicContact CD2-CD1 4.31Å; L62-L94 HydrophobicContact CG-CD1 4.43Å; L63-L94 HydrophobicContact CD2-CD2 4.06Å; S91-L94 PolarHBondContact O-N 3.45Å; S91-L94 VanDerWaalsContact O-N 3.12Å; L94-I99 HydrophobicContact CD1-CD1 4.06Å
95	K	97.6	Very high	98.3	Very high	152 Å²	152	74 Å²	74	66%	0.661	38%	0.378	S	S	*	.	S	Bend	trans	-103	-9	173.2	-58	-54.2	-176.3	-174.2	0	113.9	E65 P97	E65-K95 HydrophobicContact CB-CB 4.43Å; E65-K95 HydrophobicContact CG-CB 3.99Å; E65-K95 HydrophobicContact CG-CG 3.89Å; E65-K95 WeakPolarHBondContact OE1-CG 3.42Å; K95-P97 VanDerWaalsContact O-CD 3.25Å; K95-P97 WeakPolarHBondContact O-CD 3.29Å
96	T	98.3	Very high	98.2	Very high	3 Å²	3	73 Å²	73	2%	0.018	38%	0.379	C	S	.	.			trans	-77.3	112	174	-59	0	0	0	0	109.3	L62 A67 L70 K98 I99	L62-T96 HydrophobicContact CD2-CG2 3.87Å; L62-T96 WeakPolarHBondContact CD2-OG1 3.37Å; A67-T96 WeakPolarHBondContact O-CB 3.31Å; A67-T96 WeakPolarHBondContact O-CG2 3.38Å; A67-T96 PolarHBondContact O-OG1 3.11Å; L70-T96 HydrophobicContact CB-CG2 4.44Å; T96-K98 VanDerWaalsContact C-N 3.28Å; T96-K98 WeakPolarHBondContact CG2-O 3.38Å; T96-K98 PolarHBondContact O-N 3.13Å; T96-I99 HydrophobicContact CG2-CG1 4.45Å
97	P	96.9	Very high	98.2	Very high	109 Å²	109	68.8 Å²	68.8	71%	0.708	36%	0.357	S	S	*	.			trans	-73.5	-17.5	-172.8	29.7	-37.9	0	0	0	113.9	D68 K95	D68-P97 WeakPolarHBondContact O-CD 3.41Å; D68-P97 VanDerWaalsContact O-CG 3.24Å; D68-P97 WeakPolarHBondContact O-CG 3.49Å; K95-P97 VanDerWaalsContact O-CD 3.25Å; K95-P97 WeakPolarHBondContact O-CD 3.29Å
98	K	98.1	Very high	98.2	Very high	99 Å²	99	67.8 Å²	67.8	43%	0.43	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	122.5	-174	-172.9	168.4	164.1	-149	0	112	E69 L70 T96 V100	E69-K98 WeakPolarHBondContact CA-O 3.49Å; E69-K98 HydrophobicContact CG-CB 4.22Å; E69-K98 HydrophobicContact CG-CD 4.24Å; E69-K98 HydrophobicContact CG-CG 4.09Å; E69-K98 IonicContact OE1-NZ 3.72Å; E69-K98 VanDerWaalsContact OE2-CD 3.26Å; E69-K98 WeakPolarHBondContact OE2-CD 3.32Å; E69-K98 VanDerWaalsContact OE2-CE 3.32Å; E69-K98 WeakPolarHBondContact OE2-CE 3.32Å; E69-K98 IonicContact OE2-NZ 2.85Å; E69-K98 PolarHBondContact OE2-NZ 3.46Å; L70-K98 PolarHBondContact N-O 2.59Å; T96-K98 VanDerWaalsContact C-N 3.28Å; T96-K98 WeakPolarHBondContact CG2-O 3.38Å; T96-K98 PolarHBondContact O-N 3.13Å; K98-V100 HydrophobicContact CD-CG1 4.41Å; K98-V100 HydrophobicContact CG-CG1 3.94Å
99	I	98.7	Very high	98.2	Very high	6 Å²	6	65.5 Å²	65.5	3%	0.031	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	121.9	172.7	-55.5	177.7	0	0	0	106.6	L62 L70 M84 L87 Q88 L94 T96	L62-I99 HydrophobicContact CD1-CD1 3.96Å; L62-I99 HydrophobicContact CD2-CD1 3.94Å; L62-I99 HydrophobicContact CD2-CG1 4.26Å; L70-I99 HydrophobicContact CB-CG1 4.45Å; L70-I99 HydrophobicContact CD2-CG2 4.39Å; L70-I99 WeakPolarHBondContact O-CA 3.37Å; M84-I99 HydrophobicContact CG-CG2 4.47Å; L87-I99 HydrophobicContact CB-CD1 3.91Å; L87-I99 HydrophobicContact CB-CG2 4.3Å; L87-I99 HydrophobicContact CD1-CG2 4.37Å; Q88-I99 HydrophobicContact CG-CB 4.17Å; Q88-I99 PolarHBondContact NE2-O 3.06Å; L94-I99 HydrophobicContact CD1-CD1 4.06Å; T96-I99 HydrophobicContact CG2-CG1 4.45Å
100	V	98.6	Very high	98.1	Very high	31 Å²	31	63.9 Å²	63.9	19%	0.188	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	154.4	-178.2	-68.9	0	0	0	0	110.1	E69 L70 A71 L72 K98 V107	E69-V100 HydrophobicContact CG-CG2 4.47Å; L70-V100 PolarHBondContact O-N 2.75Å; A71-V100 CarbonylContact C-O 3.44Å; A71-V100 VanDerWaalsContact CA-O 3.3Å; A71-V100 WeakPolarHBondContact CA-O 3.47Å; A71-V100 HydrophobicContact CB-CG2 3.91Å; L72-V100 PolarHBondContact N-O 3.29Å; K98-V100 HydrophobicContact CD-CG1 4.41Å; K98-V100 HydrophobicContact CG-CG1 3.94Å; V100-V107 HydrophobicContact CB-CG2 3.93Å; V100-V107 HydrophobicContact CG2-CG2 3.6Å
101	A	98.6	Very high	98.2	Very high	22 Å²	22	63.1 Å²	63.1	18%	0.182	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	138	176.1	0	0	0	0	0	110.6	L72 L80 M84	L72-A101 HydrophobicContact CB-CB 3.87Å; L72-A101 VanDerWaalsContact O-CA 3.23Å; L72-A101 WeakPolarHBondContact O-CA 3.31Å; L80-A101 HydrophobicContact CD1-CB 3.74Å; L80-A101 HydrophobicContact CD2-CB 4.35Å; L80-A101 HydrophobicContact CG-CB 3.78Å; M84-A101 HydrophobicContact CB-CB 3.64Å; M84-A101 HydrophobicContact CG-CB 3.77Å; M84-A101 HydrophobicContact SD-CB 3.64Å; M84-A101 PolarHBondContact SD-N 2.99Å; M84-A101 VanDerWaalsContact SD-N 3.36Å
102	D	98.3	Very high	98.2	Very high	82 Å²	82	64 Å²	64	44%	0.439	33%	0.329	S	S	.	.			trans	-155.5	154.6	173.7	-153.3	-55.8	0	0	0	109.6	L72 V73 L80 D104 V107	L72-D102 PolarHBondContact O-N 3.26Å; L72-D102 VanDerWaalsContact O-N 3.17Å; V73-D102 WeakPolarHBondContact CA-O 3.49Å; L80-D102 WeakPolarHBondContact CD2-O 3.3Å; D102-D104 VanDerWaalsContact C-N 3.31Å; D102-D104 PolarHBondContact OD1-N 2.96Å; D102-V107 HydrophobicContact CB-CB 3.72Å; D102-V107 HydrophobicContact CB-CG1 3.84Å; D102-V107 HydrophobicContact CB-CG2 4.09Å
103	K	97.7	Very high	98.2	Very high	96 Å²	96	56.8 Å²	56.8	42%	0.417	29%	0.291	S	S	.	.	S	Bend	trans	-73.1	-29.6	169.5	179.8	-178.7	-176.5	-176.5	0	111.1	E77	E77-K103 HydrophobicContact CG-CB 4.42Å; E77-K103 HydrophobicContact CG-CD 3.95Å; E77-K103 VanDerWaalsContact OE1-CD 3.23Å; E77-K103 WeakPolarHBondContact OE1-CD 3.17Å; E77-K103 IonicContact OE1-NZ 3.23Å; E77-K103 PolarHBondContact OE1-NZ 3.23Å
104	D	98	Very high	98.3	Very high	80 Å²	80	48.7 Å²	48.7	43%	0.428	26%	0.256	S	S	.	.	S	Bend	trans	-75.9	126.5	175.3	-167.9	-56.5	0	0	0	111	D102 S106 V107	D102-D104 VanDerWaalsContact C-N 3.31Å; D102-D104 PolarHBondContact OD1-N 2.96Å; D104-S106 PolarHBondContact O-N 2.94Å; D104-S106 VanDerWaalsContact O-N 3.11Å; D104-S106 VanDerWaalsContact OD1-CB 3.24Å; D104-S106 WeakPolarHBondContact OD1-CB 3.42Å; D104-S106 PolarHBondContact OD1-N 3.02Å; D104-S106 PolarHBondContact OD1-OG 3.27Å; D104-V107 VanDerWaalsContact O-CG1 3.26Å; D104-V107 WeakPolarHBondContact O-CG1 3.18Å; D104-V107 PolarHBondContact O-N 2.92Å
105	Y	98.5	Very high	98.3	Very high	32 Å²	32	47.4 Å²	47.4	13%	0.125	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-67.3	-10.8	-177	-81.2	-101.6	0	0	0	114.3	V48 V73 V107 T108 I142 Q145 I146 Y149	V48-Y105 HydrophobicContact CG1-CE1 4.49Å; V48-Y105 WeakPolarHBondContact CG1-OH 3.3Å; V48-Y105 HydrophobicContact CG2-CE1 4.27Å; V73-Y105 HydrophobicContact CG1-CD1 4.47Å; V73-Y105 HydrophobicContact CG1-CD2 4.17Å; V73-Y105 HydrophobicContact CG1-CE1 4.08Å; V73-Y105 HydrophobicContact CG1-CE2 3.75Å; Y105-V107 PolarHBondContact O-N 3.5Å; Y105-T108 HydrophobicContact CD1-CG2 4.13Å; Y105-T108 VanDerWaalsContact O-CB 3.3Å; Y105-T108 WeakPolarHBondContact O-CB 3.23Å; Y105-T108 WeakPolarHBondContact O-CG2 3.49Å; Y105-T108 PolarHBondContact O-N 3.26Å; Y105-T108 PolarHBondContact O-OG1 3.27Å; Y105-I142 HydrophobicContact CE1-CG2 4.2Å; Y105-I142 WeakPolarHBondContact OH-CG1 2.98Å; Y105-I142 WeakPolarHBondContact OH-CG2 3.19Å; Y105-Q145 HydrophobicContact CD1-CB 3.71Å; Y105-Q145 HydrophobicContact CD2-CB 3.81Å; Y105-Q145 HydrophobicContact CD2-CG 4.18Å; Y105-Q145 HydrophobicContact CE1-CB 4.29Å; Y105-Q145 HydrophobicContact CE2-CB 4.37Å; Y105-Q145 HydrophobicContact CG-CB 3.45Å; Y105-Q145 VanDerWaalsContact CG-CB 3.45Å; Y105-Q145 HydrophobicContact CG-CG 4.29Å; Y105-I146 HydrophobicContact CD1-CG1 4.01Å; Y105-I146 HydrophobicContact CE1-CD1 4.49Å; Y105-I146 HydrophobicContact CE1-CG1 3.76Å; Y105-Y149 VanDerWaalsContact C-CD2 3.44Å; Y105-Y149 WeakPolarHBondContact O-CD2 3.44Å
106	S	98.3	Very high	98.4	Very high	57 Å²	57	40.1 Å²	40.1	40%	0.399	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-57.9	-27	171.5	55.5	0	0	0	0	112.5	D104 T108 A109	D104-S106 PolarHBondContact O-N 2.94Å; D104-S106 VanDerWaalsContact O-N 3.11Å; D104-S106 VanDerWaalsContact OD1-CB 3.24Å; D104-S106 WeakPolarHBondContact OD1-CB 3.42Å; D104-S106 PolarHBondContact OD1-N 3.02Å; D104-S106 PolarHBondContact OD1-OG 3.27Å; S106-T108 PolarHBondContact O-N 2.88Å; S106-T108 VanDerWaalsContact O-N 3.14Å; S106-A109 WeakPolarHBondContact O-CB 3.23Å; S106-A109 PolarHBondContact O-N 2.92Å; S106-A109 VanDerWaalsContact O-N 3.14Å
107	V	98.3	Very high	98.4	Very high	25 Å²	25	41 Å²	41	15%	0.152	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-60.2	-23	172.1	78.4	0	0	0	0	112.5	K44 V73 V100 D102 D104 Y105 A109	K44-V107 WeakPolarHBondContact CE-O 3.41Å; K44-V107 PolarHBondContact NZ-O 2.94Å; V73-V107 HydrophobicContact CG2-CG1 3.65Å; V100-V107 HydrophobicContact CB-CG2 3.93Å; V100-V107 HydrophobicContact CG2-CG2 3.6Å; D102-V107 HydrophobicContact CB-CB 3.72Å; D102-V107 HydrophobicContact CB-CG1 3.84Å; D102-V107 HydrophobicContact CB-CG2 4.09Å; D104-V107 VanDerWaalsContact O-CG1 3.26Å; D104-V107 WeakPolarHBondContact O-CG1 3.18Å; D104-V107 PolarHBondContact O-N 2.92Å; Y105-V107 PolarHBondContact O-N 3.5Å; V107-A109 VanDerWaalsContact C-N 3.33Å
108	T	98.5	Very high	98.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-84.6	-6.2	-178.1	74.8	0	0	0	0	113.3	T46 V73 Y105 S106 N110 S111 S150	T46-T108 HydrophobicContact CG2-CG2 3.54Å; T46-T108 WeakPolarHBondContact OG1-CB 3.34Å; V73-T108 HydrophobicContact CG2-CG2 3.34Å; Y105-T108 HydrophobicContact CD1-CG2 4.13Å; Y105-T108 VanDerWaalsContact O-CB 3.3Å; Y105-T108 WeakPolarHBondContact O-CB 3.23Å; Y105-T108 WeakPolarHBondContact O-CG2 3.49Å; Y105-T108 PolarHBondContact O-N 3.26Å; Y105-T108 PolarHBondContact O-OG1 3.27Å; S106-T108 PolarHBondContact O-N 2.88Å; S106-T108 VanDerWaalsContact O-N 3.14Å; T108-N110 PolarHBondContact O-N 2.61Å; T108-S111 WeakPolarHBondContact O-CB 3.39Å; T108-S111 PolarHBondContact O-N 3.12Å; T108-S111 PolarHBondContact O-OG 3.38Å; T108-S150 PolarHBondContact O-OG 2.87Å
109	A	98.3	Very high	97.9	Very high	26 Å²	26	34.1 Å²	34.1	22%	0.215	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	138.9	-171.3	0	0	0	0	0	113.5	K44 S106 V107 S111 Y149	K44-A109 WeakPolarHBondContact CD-O 3.23Å; K44-A109 WeakPolarHBondContact CE-O 3.2Å; K44-A109 PolarHBondContact NZ-O 2.82Å; S106-A109 WeakPolarHBondContact O-CB 3.23Å; S106-A109 PolarHBondContact O-N 2.92Å; S106-A109 VanDerWaalsContact O-N 3.14Å; V107-A109 VanDerWaalsContact C-N 3.33Å; A109-S111 VanDerWaalsContact C-N 3.31Å; A109-S111 PolarHBondContact O-N 2.71Å; A109-Y149 VanDerWaalsContact CA-O 3.32Å; A109-Y149 WeakPolarHBondContact CA-O 3.37Å
110	N	97.5	Very high	97.4	Very high	104 Å²	104	35.9 Å²	35.9	56%	0.556	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	29.5	-177.5	-48.7	-58	0	0	0	114.5	T108 Y149 S150	T108-N110 PolarHBondContact O-N 2.61Å; N110-Y149 PolarHBondContact N-O 3.06Å; N110-Y149 VanDerWaalsContact N-O 3.16Å; N110-S150 PolarHBondContact N-OG 3.01Å
111	S	98.8	Very high	96.7	Very high	5 Å²	5	41.7 Å²	41.7	4%	0.035	23%	0.227	C	C	.	.			trans	-68.6	134	170.5	-66.6	0	0	0	0	110.9	T46 T108 A109 S150 C153	T46-S111 PolarHBondContact OG1-OG 2.61Å; T108-S111 WeakPolarHBondContact O-CB 3.39Å; T108-S111 PolarHBondContact O-N 3.12Å; T108-S111 PolarHBondContact O-OG 3.38Å; A109-S111 VanDerWaalsContact C-N 3.31Å; A109-S111 PolarHBondContact O-N 2.71Å; S111-S150 WeakPolarHBondContact CB-OG 3.34Å; S111-S150 PolarHBondContact N-OG 2.9Å; S111-C153 VanDerWaalsContact O-CB 3.24Å; S111-C153 WeakPolarHBondContact O-CB 3.46Å
112	R	98.5	Very high	95.9	Very high	66 Å²	66	46.2 Å²	46.2	25%	0.249	25%	0.245	C	C	.	.	S	Bend	trans	-81.8	-38	171.6	-175.6	169.2	167.8	-161.4	-10.1	111.3	N43 K44 C153 I154 L285 M286	N43-R112 PolarHBondContact OD1-NH1 2.95Å; K44-R112 PolarHBondContact O-N 3.33Å; R112-C153 WeakPolarHBondContact O-CA 3.24Å; R112-I154 PolarHBondContact O-N 3.4Å; R112-L285 PolarHBondContact NH2-O 2.82Å; R112-L285 VanDerWaalsContact NH2-O 3.13Å; R112-M286 HydrophobicContact CB-CE 4.43Å; R112-M286 HydrophobicContact CG-SD 4.48Å; R112-M286 PolarHBondContact NH1-O 3.44Å; R112-M286 PolarHBondContact NH1-SD 3.4Å; R112-M286 VanDerWaalsContact NH1-SD 3.35Å; R112-M286 PolarHBondContact NH2-O 2.6Å
113	I	98.9	Very high	95.2	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	135.8	177.3	-59.4	176	0	0	0	109.1	K44 V45 T46 V115 I154 I156 T282 L285 M286	K44-I113 PolarHBondContact O-N 2.83Å; V45-I113 WeakPolarHBondContact CA-O 3.46Å; V45-I113 HydrophobicContact CG2-CB 4.39Å; T46-I113 PolarHBondContact N-O 3.44Å; I113-V115 HydrophobicContact CG2-CG2 4.39Å; I113-I154 CarbonylContact C-O 3.57Å; I113-I154 WeakPolarHBondContact CA-O 3.47Å; I113-I156 HydrophobicContact CG2-CD1 3.74Å; I113-I156 HydrophobicContact CG2-CG1 4.05Å; I113-T282 HydrophobicContact CD1-CG2 3.88Å; I113-L285 HydrophobicContact CD1-CB 3.61Å; I113-L285 HydrophobicContact CD1-CD1 4.21Å; I113-M286 HydrophobicContact CD1-CB 4.3Å; I113-M286 HydrophobicContact CD1-CE 4.01Å; I113-M286 HydrophobicContact CG1-CE 4.35Å
114	V	98.9	Very high	94.3	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	119.2	174.5	-174.9	0	0	0	0	109.5	T46 V48 V116 I146 C153 I154 I155 I156	T46-V114 HydrophobicContact CG2-CG1 4.05Å; T46-V114 CarbonylContact O-C 3.46Å; T46-V114 WeakPolarHBondContact O-CA 3.18Å; V48-V114 HydrophobicContact CG2-CG1 3.98Å; V114-V116 HydrophobicContact CG1-CG2 4.4Å; V114-I146 HydrophobicContact CB-CG2 4.05Å; V114-I146 HydrophobicContact CG1-CD1 3.77Å; V114-I146 HydrophobicContact CG1-CG1 4.12Å; V114-I146 HydrophobicContact CG1-CG2 3.92Å; V114-I146 HydrophobicContact CG2-CG2 3.81Å; V114-C153 HydrophobicContact CG2-CB 3.98Å; V114-I154 PolarHBondContact N-O 3.36Å; V114-I155 CarbonylContact O-C 3.57Å; V114-I155 WeakPolarHBondContact O-CA 3.31Å; V114-I156 PolarHBondContact O-N 3.48Å
115	V	98.9	Very high	93.6	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	117.1	178.1	-175.6	0	0	0	0	108.7	T46 V47 V48 I61 I113 T117 I156 V158 V278	T46-V115 PolarHBondContact O-N 2.85Å; V47-V115 WeakPolarHBondContact CA-O 3.37Å; V47-V115 HydrophobicContact CG2-CB 4.34Å; V48-V115 PolarHBondContact N-O 3.12Å; I61-V115 HydrophobicContact CD1-CG2 4.33Å; I113-V115 HydrophobicContact CG2-CG2 4.39Å; V115-T117 HydrophobicContact CG1-CG2 3.78Å; V115-I156 CarbonylContact C-O 3.53Å; V115-I156 WeakPolarHBondContact CA-O 3.37Å; V115-I156 HydrophobicContact CG2-CB 4.49Å; V115-I156 HydrophobicContact CG2-CD1 4.44Å; V115-V158 HydrophobicContact CG1-CG2 3.67Å; V115-V278 HydrophobicContact CG1-CG1 3.76Å; V115-V278 HydrophobicContact CG2-CG1 3.96Å
116	V	98.9	Very high	93.1	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	108	179.8	-176.9	0	0	0	0	109.4	V114 F139 I143 I146 I155 I156 V158 S159	V114-V116 HydrophobicContact CG1-CG2 4.4Å; V116-F139 HydrophobicContact CG1-CE1 4.17Å; V116-F139 HydrophobicContact CG1-CE2 4.27Å; V116-F139 HydrophobicContact CG1-CZ 3.72Å; V116-I143 HydrophobicContact CG2-CD1 4.16Å; V116-I146 HydrophobicContact CG2-CD1 3.78Å; V116-I155 HydrophobicContact CG2-CG2 3.8Å; V116-I156 PolarHBondContact N-O 3.18Å; V116-V158 PolarHBondContact O-N 3.36Å; V116-S159 PolarHBondContact O-N 2.99Å; V116-S159 PolarHBondContact O-OG 3Å
117	T	98.4	Very high	92.5	Very high	21 Å²	21	53 Å²	53	13%	0.129	30%	0.297	C	S	.	.			trans	-114.6	-8.6	178.1	75.7	0	0	0	0	112.7	V47 V48 G49 V53 G54 V115 V158 S159	V47-T117 HydrophobicContact CG1-CG2 4.32Å; V48-T117 CarbonylContact O-C 3.49Å; V48-T117 WeakPolarHBondContact O-CA 3.46Å; V48-T117 PolarHBondContact O-N 3.39Å; V48-T117 PolarHBondContact O-OG1 2.79Å; G49-T117 PolarHBondContact O-OG1 3.09Å; V53-T117 HydrophobicContact CG1-CG2 4.02Å; G54-T117 WeakPolarHBondContact CA-OG1 3.29Å; V115-T117 HydrophobicContact CG1-CG2 3.78Å; T117-V158 HydrophobicContact CG2-CB 4.12Å; T117-V158 HydrophobicContact CG2-CG2 4.27Å; T117-S159 VanDerWaalsContact C-OG 3.25Å
118	A	94.9	Very high	91.8	Very high	21 Å²	21	55.9 Å²	55.9	17%	0.174	31%	0.305	C	S	.	.			trans	-66.2	132.5	176.7	0	0	0	0	0	110.7	V48 F139 I142 S159	V48-A118 HydrophobicContact CG1-CB 4.07Å; V48-A118 PolarHBondContact O-N 3.35Å; V48-A118 VanDerWaalsContact O-N 3.07Å; A118-F139 WeakPolarHBondContact O-CE1 3.48Å; A118-I142 HydrophobicContact CB-CD1 3.66Å; A118-S159 WeakPolarHBondContact O-CB 3.16Å; A118-S159 PolarHBondContact O-OG 3.28Å
119	G	90.8	Very high	91.2	Very high	43 Å²	43	58.7 Å²	58.7	44%	0.443	32%	0.32	S	S	.	.			trans	177.4	168.6	179.1	0	0	0	0	0	110.9	N135	G119-N135 WeakPolarHBondContact CA-OD1 3.44Å
120	V	88.4	Confident	90.7	Very high	43 Å²	43	61.9 Å²	61.9	26%	0.261	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-98.9	145.2	174.5	-72.8	0	0	0	0	110.6	L131 R134 N135 I138	V120-L131 HydrophobicContact CG2-CD1 4.17Å; V120-L131 WeakPolarHBondContact O-CD1 3.5Å; V120-R134 HydrophobicContact CG2-CB 3.87Å; V120-N135 WeakPolarHBondContact CG2-ND2 3.36Å; V120-N135 PolarHBondContact N-OD1 3.05Å; V120-N135 PolarHBondContact O-ND2 3.31Å; V120-I138 HydrophobicContact CB-CD1 4.35Å; V120-I138 HydrophobicContact CG1-CD1 3.53Å; V120-I138 HydrophobicContact CG2-CD1 4.14Å
121	R	83.8	Confident	90.4	Very high	152 Å²	152	57.7 Å²	57.7	57%	0.574	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-79.6	151.2	171.7	-60.4	-176.6	-174.8	-168.9	1.1	109.9	Q123 G268	R121-Q123 PolarHBondContact O-N 3.48Å; R121-G268 PolarHBondContact NH1-O 3.22Å
122	Q	81	Confident	90	Very high	118 Å²	118	57.5 Å²	57.5	55%	0.551	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-58.6	132.7	171.3	-161.8	171.7	2	0	0	110.3	E126 L131	Q122-E126 WeakPolarHBondContact CA-OE2 3.21Å; Q122-E126 HydrophobicContact CG-CB 4.13Å; Q122-E126 PolarHBondContact NE2-O 2.88Å; Q122-L131 HydrophobicContact CB-CD1 4.38Å; Q122-L131 HydrophobicContact CB-CD2 3.79Å; Q122-L131 HydrophobicContact CG-CD2 4.02Å
123	Q	83.6	Confident	89.7	Confident	119 Å²	119	56.2 Å²	56.2	56%	0.556	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-86.3	155.7	170.9	-66.3	177.3	-9.7	0	0	110.4	R121 G125 E126	R121-Q123 PolarHBondContact O-N 3.48Å; Q123-G125 PolarHBondContact O-N 3.22Å; Q123-E126 HydrophobicContact CB-CB 4.08Å; Q123-E126 PolarHBondContact N-OE2 3.22Å; Q123-E126 WeakPolarHBondContact O-CB 3.4Å; Q123-E126 PolarHBondContact O-N 2.97Å
124	E	79.7	Confident	89.5	Confident	207 Å²	207	59.7 Å²	59.7	97%	0.967	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	127.3	176.7	-169	175.2	179.4	0	0	110.4	E126	E124-E126 VanDerWaalsContact C-N 3.27Å; E124-E126 PolarHBondContact O-N 3.23Å
125	G	83.3	Confident	89.3	Confident	85 Å²	85	59.7 Å²	59.7	88%	0.876	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	1.6	-175.8	0	0	0	0	0	115.6	Q123	Q123-G125 PolarHBondContact O-N 3.22Å
126	E	87.6	Confident	89.1	Confident	24 Å²	24	59.7 Å²	59.7	11%	0.112	32%	0.319	C	S	.	.			trans	-75.4	131.3	178	-176.4	174.6	-143.3	0	0	111.7	Q122 Q123 E124 N130 L131 R134	Q122-E126 WeakPolarHBondContact CA-OE2 3.21Å; Q122-E126 HydrophobicContact CG-CB 4.13Å; Q122-E126 PolarHBondContact NE2-O 2.88Å; Q123-E126 HydrophobicContact CB-CB 4.08Å; Q123-E126 PolarHBondContact N-OE2 3.22Å; Q123-E126 WeakPolarHBondContact O-CB 3.4Å; Q123-E126 PolarHBondContact O-N 2.97Å; E124-E126 VanDerWaalsContact C-N 3.27Å; E124-E126 PolarHBondContact O-N 3.23Å; E126-N130 HydrophobicContact CG-CB 3.9Å; E126-L131 HydrophobicContact CG-CB 4.36Å; E126-R134 WeakPolarHBondContact OE1-CD 3.15Å; E126-R134 IonicContact OE1-CZ 3.32Å; E126-R134 IonicContact OE1-NE 3.86Å; E126-R134 IonicContact OE1-NH1 2.67Å; E126-R134 PolarHBondContact OE1-NH1 3.39Å; E126-R134 IonicContact OE2-NH1 3.59Å; E126-R134 PolarHBondContact OE2-NH1 2.8Å
127	S	85.2	Confident	88.9	Confident	55 Å²	55	63.1 Å²	63.1	39%	0.385	34%	0.337	S	S	.	.			trans	-69.1	151.2	173.7	75.4	0	0	0	0	111.5	L129 N130 L131	S127-L129 VanDerWaalsContact C-N 3.25Å; S127-L129 PolarHBondContact O-N 3.38Å; S127-N130 PolarHBondContact O-N 3.1Å; S127-N130 VanDerWaalsContact O-N 3.13Å; S127-N130 WeakPolarHBondContact OG-CB 3.42Å; S127-N130 PolarHBondContact OG-N 3.23Å; S127-N130 PolarHBondContact OG-ND2 3.1Å; S127-L131 PolarHBondContact O-N 3.07Å; S127-L131 VanDerWaalsContact O-N 3.08Å
128	R	84.2	Confident	88.7	Confident	85 Å²	85	64.6 Å²	64.6	32%	0.321	34%	0.344	S	S	.	.	H	α-helix	trans	-55.5	-41.2	176.4	-171.6	172.1	-178.6	177.2	2.3	112.3	L131 V132 E214 I348	R128-L131 PolarHBondContact O-N 3.2Å; R128-V132 VanDerWaalsContact O-CG2 3.29Å; R128-V132 WeakPolarHBondContact O-CG2 3.23Å; R128-V132 PolarHBondContact O-N 3.38Å; R128-E214 IonicContact CZ-OE1 3.44Å; R128-E214 IonicContact NH1-OE1 3.85Å; R128-E214 PolarHBondContact NH1-OE1 3.42Å; R128-E214 IonicContact NH2-OE1 3.84Å; R128-E214 PolarHBondContact NH2-OE1 2.85Å; R128-I348 HydrophobicContact CG-CD1 4.2Å
129	L	85.7	Confident	88.9	Confident	59 Å²	59	63.6 Å²	63.6	31%	0.309	34%	0.336	S	S	.	.	H	α-helix	trans	-62.1	-43.8	177.6	-176.5	64.8	0	0	0	112.2	S127 V132 Q133 I348 D351 L352	S127-L129 VanDerWaalsContact C-N 3.25Å; S127-L129 PolarHBondContact O-N 3.38Å; L129-V132 PolarHBondContact O-N 2.8Å; L129-Q133 PolarHBondContact O-N 3.16Å; L129-I348 HydrophobicContact CD1-CG2 4.38Å; L129-D351 HydrophobicContact CD1-CB 3.97Å; L129-D351 HydrophobicContact CD2-CB 4.21Å; L129-L352 HydrophobicContact CD1-CD2 4.09Å
130	N	88.1	Confident	89.1	Confident	93 Å²	93	64.1 Å²	64.1	50%	0.497	33%	0.326	S	S	.	.	H	α-helix	trans	-65.1	-41.9	178.9	-73.7	-10.8	0	0	0	111.8	E126 S127 V132 Q133 R134	E126-N130 HydrophobicContact CG-CB 3.9Å; S127-N130 PolarHBondContact O-N 3.1Å; S127-N130 VanDerWaalsContact O-N 3.13Å; S127-N130 WeakPolarHBondContact OG-CB 3.42Å; S127-N130 PolarHBondContact OG-N 3.23Å; S127-N130 PolarHBondContact OG-ND2 3.1Å; N130-V132 VanDerWaalsContact C-N 3.33Å; N130-V132 PolarHBondContact O-N 3.3Å; N130-Q133 PolarHBondContact O-N 3.27Å; N130-R134 WeakPolarHBondContact O-CG 3.47Å; N130-R134 PolarHBondContact O-N 3.4Å
131	L	90.1	Very high	89.5	Confident	16 Å²	16	69 Å²	69	8%	0.084	35%	0.345	C	S	.	.	H	α-helix	trans	-58.1	-46.5	173.9	172.9	62.6	0	0	0	111.3	V120 Q122 E126 S127 R128 R134 N135	V120-L131 HydrophobicContact CG2-CD1 4.17Å; V120-L131 WeakPolarHBondContact O-CD1 3.5Å; Q122-L131 HydrophobicContact CB-CD1 4.38Å; Q122-L131 HydrophobicContact CB-CD2 3.79Å; Q122-L131 HydrophobicContact CG-CD2 4.02Å; E126-L131 HydrophobicContact CG-CB 4.36Å; S127-L131 PolarHBondContact O-N 3.07Å; S127-L131 VanDerWaalsContact O-N 3.08Å; R128-L131 PolarHBondContact O-N 3.2Å; L131-R134 PolarHBondContact O-N 3.05Å; L131-N135 PolarHBondContact O-N 3.46Å; L131-N135 VanDerWaalsContact O-N 3.15Å; L131-N135 PolarHBondContact O-ND2 2.9Å
132	V	91.4	Very high	90.2	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-48.1	177.9	176.9	0	0	0	0	110.2	R128 L129 N130 R134 N135 V136 P161 V164 I348 L352	R128-V132 VanDerWaalsContact O-CG2 3.29Å; R128-V132 WeakPolarHBondContact O-CG2 3.23Å; R128-V132 PolarHBondContact O-N 3.38Å; L129-V132 PolarHBondContact O-N 2.8Å; N130-V132 VanDerWaalsContact C-N 3.33Å; N130-V132 PolarHBondContact O-N 3.3Å; V132-R134 VanDerWaalsContact C-N 3.29Å; V132-R134 PolarHBondContact O-N 3.31Å; V132-N135 CarbonylContact O-C 3.58Å; V132-N135 WeakPolarHBondContact O-CA 3.44Å; V132-N135 PolarHBondContact O-N 3.03Å; V132-V136 HydrophobicContact CG1-CG2 4.08Å; V132-V136 WeakPolarHBondContact O-CG2 3.34Å; V132-V136 PolarHBondContact O-N 3.47Å; V132-P161 HydrophobicContact CG2-CG 3.39Å; V132-V164 HydrophobicContact CG1-CG1 3.64Å; V132-V164 HydrophobicContact CG2-CG1 4.44Å; V132-I348 HydrophobicContact CG2-CG2 4.17Å; V132-L352 HydrophobicContact CB-CD2 4.19Å; V132-L352 HydrophobicContact CG1-CD1 4.11Å; V132-L352 HydrophobicContact CG1-CD2 3.43Å; V132-L352 VanDerWaalsContact CG1-CD2 3.43Å; V132-L352 HydrophobicContact CG1-CG 4.42Å
133	Q	92.7	Very high	91	Very high	40 Å²	40	56.8 Å²	56.8	19%	0.187	30%	0.295	C	S	.	.	H	α-helix	trans	-61.1	-36.4	-178.1	-170.3	63.3	62.9	0	0	112.6	L129 N130 V136 N137 R353	L129-Q133 PolarHBondContact O-N 3.16Å; N130-Q133 PolarHBondContact O-N 3.27Å; Q133-V136 WeakPolarHBondContact O-CB 3.45Å; Q133-V136 PolarHBondContact O-N 3.28Å; Q133-N137 VanDerWaalsContact O-CG 3.29Å; Q133-N137 PolarHBondContact O-N 3.02Å; Q133-N137 PolarHBondContact O-ND2 3.08Å; Q133-R353 PolarHBondContact NE2-O 3.47Å
134	R	93.9	Very high	91.7	Very high	72 Å²	72	53.8 Å²	53.8	27%	0.272	29%	0.286	S	S	.	.	H	α-helix	trans	-64.9	-42.9	173.2	-73.2	168.9	63	-149.7	-4.3	112	V120 E126 N130 L131 V132 N137 I138	V120-R134 HydrophobicContact CG2-CB 3.87Å; E126-R134 WeakPolarHBondContact OE1-CD 3.15Å; E126-R134 IonicContact OE1-CZ 3.32Å; E126-R134 IonicContact OE1-NE 3.86Å; E126-R134 IonicContact OE1-NH1 2.67Å; E126-R134 PolarHBondContact OE1-NH1 3.39Å; E126-R134 IonicContact OE2-NH1 3.59Å; E126-R134 PolarHBondContact OE2-NH1 2.8Å; N130-R134 WeakPolarHBondContact O-CG 3.47Å; N130-R134 PolarHBondContact O-N 3.4Å; L131-R134 PolarHBondContact O-N 3.05Å; V132-R134 VanDerWaalsContact C-N 3.29Å; V132-R134 PolarHBondContact O-N 3.31Å; R134-N137 PolarHBondContact O-N 3.41Å; R134-I138 WeakPolarHBondContact O-CG1 3.23Å; R134-I138 PolarHBondContact O-N 3.22Å; R134-I138 VanDerWaalsContact O-N 3.17Å
135	N	94.5	Very high	92.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-66.4	-36.7	175.1	-79.4	-64.7	0	0	0	112.1	G119 V120 L131 V132 N137 I138 F139 L165	G119-N135 WeakPolarHBondContact CA-OD1 3.44Å; V120-N135 WeakPolarHBondContact CG2-ND2 3.36Å; V120-N135 PolarHBondContact N-OD1 3.05Å; V120-N135 PolarHBondContact O-ND2 3.31Å; L131-N135 PolarHBondContact O-N 3.46Å; L131-N135 VanDerWaalsContact O-N 3.15Å; L131-N135 PolarHBondContact O-ND2 2.9Å; V132-N135 CarbonylContact O-C 3.58Å; V132-N135 WeakPolarHBondContact O-CA 3.44Å; V132-N135 PolarHBondContact O-N 3.03Å; N135-N137 VanDerWaalsContact C-N 3.32Å; N135-N137 PolarHBondContact O-N 3.02Å; N135-I138 WeakPolarHBondContact O-CB 3.21Å; N135-I138 PolarHBondContact O-N 3.29Å; N135-I138 VanDerWaalsContact O-N 3.17Å; N135-F139 WeakPolarHBondContact O-CB 3.28Å; N135-F139 WeakPolarHBondContact O-CD1 3.48Å; N135-F139 PolarHBondContact O-N 3.13Å; N135-L165 HydrophobicContact CB-CD1 3.86Å; N135-L165 HydrophobicContact CB-CD2 3.64Å; N135-L165 HydrophobicContact CB-CG 4.4Å
136	V	94.4	Very high	93.4	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-56.4	-46.7	171.6	168.6	0	0	0	0	110.6	V132 Q133 I138 F139 K140 V168 L352 I355	V132-V136 HydrophobicContact CG1-CG2 4.08Å; V132-V136 WeakPolarHBondContact O-CG2 3.34Å; V132-V136 PolarHBondContact O-N 3.47Å; Q133-V136 WeakPolarHBondContact O-CB 3.45Å; Q133-V136 PolarHBondContact O-N 3.28Å; V136-I138 VanDerWaalsContact C-N 3.29Å; V136-I138 PolarHBondContact O-N 3.01Å; V136-F139 PolarHBondContact O-N 2.62Å; V136-F139 VanDerWaalsContact O-N 3.12Å; V136-K140 WeakPolarHBondContact O-CG 3.36Å; V136-K140 PolarHBondContact O-N 2.7Å; V136-V168 HydrophobicContact CG1-CG1 4.47Å; V136-V168 HydrophobicContact CG2-CG1 4.01Å; V136-V168 HydrophobicContact CG2-CG2 3.68Å; V136-L352 HydrophobicContact CG2-CD2 4.46Å; V136-I355 HydrophobicContact CG1-CG1 3.96Å; V136-I355 HydrophobicContact CG2-CD1 4.31Å
137	N	94.3	Very high	93.9	Very high	72 Å²	72	43.1 Å²	43.1	39%	0.385	22%	0.215	S	C	.	.	H	α-helix	trans	-62.3	-36.7	178.6	-67.6	-20.9	0	0	0	112.4	Q133 R134 N135 H141	Q133-N137 VanDerWaalsContact O-CG 3.29Å; Q133-N137 PolarHBondContact O-N 3.02Å; Q133-N137 PolarHBondContact O-ND2 3.08Å; R134-N137 PolarHBondContact O-N 3.41Å; N135-N137 VanDerWaalsContact C-N 3.32Å; N135-N137 PolarHBondContact O-N 3.02Å; N137-H141 PolarHBondContact O-CD2 3.05Å
138	I	95.4	Very high	94.5	Very high	52 Å²	52	48.7 Å²	48.7	27%	0.267	23%	0.228	S	C	.	.	H	α-helix	trans	-66.4	-46.2	173	-66.5	166.9	0	0	0	110.2	V120 R134 N135 V136 K140 H141 I142	V120-I138 HydrophobicContact CB-CD1 4.35Å; V120-I138 HydrophobicContact CG1-CD1 3.53Å; V120-I138 HydrophobicContact CG2-CD1 4.14Å; R134-I138 WeakPolarHBondContact O-CG1 3.23Å; R134-I138 PolarHBondContact O-N 3.22Å; R134-I138 VanDerWaalsContact O-N 3.17Å; N135-I138 WeakPolarHBondContact O-CB 3.21Å; N135-I138 PolarHBondContact O-N 3.29Å; N135-I138 VanDerWaalsContact O-N 3.17Å; V136-I138 VanDerWaalsContact C-N 3.29Å; V136-I138 PolarHBondContact O-N 3.01Å; I138-K140 VanDerWaalsContact C-N 3.27Å; I138-K140 PolarHBondContact O-N 3.35Å; I138-H141 PolarHBondContact O-N 2.9Å; I138-I142 HydrophobicContact CG2-CD1 3.52Å; I138-I142 HydrophobicContact CG2-CG1 4.19Å; I138-I142 WeakPolarHBondContact O-CG1 3.19Å; I138-I142 PolarHBondContact O-N 3.11Å
139	F	98	Very high	95.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.9	-30.5	-176.5	-85.9	43.2	0	0	0	112.6	V116 A118 N135 V136 H141 I142 I143 V157 L165 V168 T169 L172	V116-F139 HydrophobicContact CG1-CE1 4.17Å; V116-F139 HydrophobicContact CG1-CE2 4.27Å; V116-F139 HydrophobicContact CG1-CZ 3.72Å; A118-F139 WeakPolarHBondContact O-CE1 3.48Å; N135-F139 WeakPolarHBondContact O-CB 3.28Å; N135-F139 WeakPolarHBondContact O-CD1 3.48Å; N135-F139 PolarHBondContact O-N 3.13Å; V136-F139 PolarHBondContact O-N 2.62Å; V136-F139 VanDerWaalsContact O-N 3.12Å; F139-H141 PolarHBondContact O-N 3.27Å; F139-I142 PolarHBondContact O-N 3.02Å; F139-I142 VanDerWaalsContact O-N 3.13Å; F139-I143 HydrophobicContact CB-CG1 4.05Å; F139-I143 HydrophobicContact CD2-CD1 4.04Å; F139-I143 HydrophobicContact CD2-CG1 3.83Å; F139-I143 HydrophobicContact CE2-CD1 4.37Å; F139-I143 HydrophobicContact CG-CG1 4.18Å; F139-I143 WeakPolarHBondContact O-CB 3.26Å; F139-I143 WeakPolarHBondContact O-CG1 3.36Å; F139-I143 PolarHBondContact O-N 3.47Å; F139-V157 HydrophobicContact CE2-CG1 4.08Å; F139-V157 HydrophobicContact CZ-CG1 4.23Å; F139-L165 HydrophobicContact CE1-CD1 4.34Å; F139-L165 HydrophobicContact CE2-CB 3.98Å; F139-L165 HydrophobicContact CZ-CB 4.18Å; F139-L165 HydrophobicContact CZ-CD1 4.1Å; F139-V168 HydrophobicContact CB-CG1 4.18Å; F139-V168 HydrophobicContact CD2-CG1 4.36Å; F139-T169 VanDerWaalsContact CD2-OG1 3.31Å; F139-T169 WeakPolarHBondContact CD2-OG1 3.28Å; F139-T169 WeakPolarHBondContact CE2-OG1 3.2Å; F139-L172 HydrophobicContact CB-CD1 3.82Å
140	K	96.6	Very high	95.8	Very high	54 Å²	54	44.6 Å²	44.6	24%	0.235	21%	0.209	C	C	.	.	H	α-helix	trans	-58.3	-29.2	171.9	-74.1	173.2	-176.8	177.6	0	114.1	V136 I138 P144 L172 D354	V136-K140 WeakPolarHBondContact O-CG 3.36Å; V136-K140 PolarHBondContact O-N 2.7Å; I138-K140 VanDerWaalsContact C-N 3.27Å; I138-K140 PolarHBondContact O-N 3.35Å; K140-P144 VanDerWaalsContact O-CD 3.28Å; K140-P144 WeakPolarHBondContact O-CD 3.28Å; K140-P144 WeakPolarHBondContact O-CG 3.14Å; K140-L172 HydrophobicContact CG-CD1 4.14Å; K140-L172 HydrophobicContact CG-CD2 4.03Å; K140-D354 WeakPolarHBondContact CE-O 3.48Å; K140-D354 PolarHBondContact NZ-O 2.92Å
141	H	96.4	Very high	96.3	Very high	146 Å²	146	43.4 Å²	43.4	68%	0.676	21%	0.206	S	C	*	.	H	α-helix	trans	-90.4	-25.7	177.5	-62.3	-62.1	0	0	0	112.4	N137 I138 F139 Q145	N137-H141 PolarHBondContact O-CD2 3.05Å; I138-H141 PolarHBondContact O-N 2.9Å; F139-H141 PolarHBondContact O-N 3.27Å; H141-Q145 VanDerWaalsContact O-CG 3.27Å; H141-Q145 WeakPolarHBondContact O-CG 3.38Å
142	I	98.1	Very high	96.6	Very high	13 Å²	13	48.6 Å²	48.6	7%	0.067	23%	0.234	C	C	.	.	H	α-helix	trans	-88.2	-58.5	-176.2	-62.9	-175.2	0	0	0	111.5	V48 Y105 A118 I138 F139 Q145 I146	V48-I142 HydrophobicContact CG1-CD1 4.17Å; V48-I142 HydrophobicContact CG1-CG2 3.9Å; Y105-I142 HydrophobicContact CE1-CG2 4.2Å; Y105-I142 WeakPolarHBondContact OH-CG1 2.98Å; Y105-I142 WeakPolarHBondContact OH-CG2 3.19Å; A118-I142 HydrophobicContact CB-CD1 3.66Å; I138-I142 HydrophobicContact CG2-CD1 3.52Å; I138-I142 HydrophobicContact CG2-CG1 4.19Å; I138-I142 WeakPolarHBondContact O-CG1 3.19Å; I138-I142 PolarHBondContact O-N 3.11Å; F139-I142 PolarHBondContact O-N 3.02Å; F139-I142 VanDerWaalsContact O-N 3.13Å; I142-Q145 PolarHBondContact O-N 3.26Å; I142-Q145 VanDerWaalsContact O-N 3.17Å; I142-I146 HydrophobicContact CG2-CD1 3.6Å; I142-I146 HydrophobicContact CG2-CG1 4.31Å; I142-I146 WeakPolarHBondContact O-CG1 3.3Å; I142-I146 PolarHBondContact O-N 3.25Å; I142-I146 VanDerWaalsContact O-N 3.11Å
143	I	98.6	Very high	97	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.5	-46	-166.2	-57.8	-54.1	0	0	0	112.4	V116 F139 Q145 I146 V147 T169 L172	V116-I143 HydrophobicContact CG2-CD1 4.16Å; F139-I143 HydrophobicContact CB-CG1 4.05Å; F139-I143 HydrophobicContact CD2-CD1 4.04Å; F139-I143 HydrophobicContact CD2-CG1 3.83Å; F139-I143 HydrophobicContact CE2-CD1 4.37Å; F139-I143 HydrophobicContact CG-CG1 4.18Å; F139-I143 WeakPolarHBondContact O-CB 3.26Å; F139-I143 WeakPolarHBondContact O-CG1 3.36Å; F139-I143 PolarHBondContact O-N 3.47Å; I143-Q145 VanDerWaalsContact C-N 3.26Å; I143-Q145 PolarHBondContact O-N 2.86Å; I143-I146 HydrophobicContact CD1-CD1 4.08Å; I143-I146 WeakPolarHBondContact O-CB 3.39Å; I143-I146 PolarHBondContact O-N 3.05Å; I143-V147 PolarHBondContact O-N 3.14Å; I143-T169 HydrophobicContact CD1-CG2 3.76Å; I143-T169 HydrophobicContact CG1-CG2 4.21Å; I143-T169 HydrophobicContact CG2-CG2 4.17Å; I143-L172 HydrophobicContact CB-CB 4.1Å; I143-L172 HydrophobicContact CG2-CB 3.97Å
144	P	98.6	Very high	97.3	Very high	56 Å²	56	46.9 Å²	46.9	36%	0.364	23%	0.226	S	C	.	.	H	α-helix	trans	-62	-32.6	177.4	-25.7	37.3	0	0	0	113.5	K140 R148	K140-P144 VanDerWaalsContact O-CD 3.28Å; K140-P144 WeakPolarHBondContact O-CD 3.28Å; K140-P144 WeakPolarHBondContact O-CG 3.14Å; P144-R148 VanDerWaalsContact O-CB 3.28Å; P144-R148 WeakPolarHBondContact O-CB 3.49Å; P144-R148 PolarHBondContact O-N 3.41Å
145	Q	98.6	Very high	97.5	Very high	65 Å²	65	43.5 Å²	43.5	30%	0.304	21%	0.213	S	C	.	.	H	α-helix	trans	-69.8	-40.8	176.6	-63.4	-63.4	-31.5	0	0	111.4	Y105 H141 I142 I143 V147 R148 Y149	Y105-Q145 HydrophobicContact CD1-CB 3.71Å; Y105-Q145 HydrophobicContact CD2-CB 3.81Å; Y105-Q145 HydrophobicContact CD2-CG 4.18Å; Y105-Q145 HydrophobicContact CE1-CB 4.29Å; Y105-Q145 HydrophobicContact CE2-CB 4.37Å; Y105-Q145 HydrophobicContact CG-CB 3.45Å; Y105-Q145 VanDerWaalsContact CG-CB 3.45Å; Y105-Q145 HydrophobicContact CG-CG 4.29Å; H141-Q145 VanDerWaalsContact O-CG 3.27Å; H141-Q145 WeakPolarHBondContact O-CG 3.38Å; I142-Q145 PolarHBondContact O-N 3.26Å; I142-Q145 VanDerWaalsContact O-N 3.17Å; I143-Q145 VanDerWaalsContact C-N 3.26Å; I143-Q145 PolarHBondContact O-N 2.86Å; Q145-V147 PolarHBondContact O-N 3.11Å; Q145-R148 WeakPolarHBondContact O-CB 3.21Å; Q145-R148 PolarHBondContact O-N 3.41Å; Q145-Y149 WeakPolarHBondContact O-CD2 3.17Å; Q145-Y149 PolarHBondContact O-N 3.37Å
146	I	98.6	Very high	97.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-55.8	-53.8	175.1	-67.6	167.6	0	0	0	110.4	V48 Y105 V114 V116 I142 I143 R148 Y149 S150 I155	V48-I146 HydrophobicContact CG2-CD1 4.09Å; V48-I146 HydrophobicContact CG2-CG1 4.47Å; Y105-I146 HydrophobicContact CD1-CG1 4.01Å; Y105-I146 HydrophobicContact CE1-CD1 4.49Å; Y105-I146 HydrophobicContact CE1-CG1 3.76Å; V114-I146 HydrophobicContact CB-CG2 4.05Å; V114-I146 HydrophobicContact CG1-CD1 3.77Å; V114-I146 HydrophobicContact CG1-CG1 4.12Å; V114-I146 HydrophobicContact CG1-CG2 3.92Å; V114-I146 HydrophobicContact CG2-CG2 3.81Å; V116-I146 HydrophobicContact CG2-CD1 3.78Å; I142-I146 HydrophobicContact CG2-CD1 3.6Å; I142-I146 HydrophobicContact CG2-CG1 4.31Å; I142-I146 WeakPolarHBondContact O-CG1 3.3Å; I142-I146 PolarHBondContact O-N 3.25Å; I142-I146 VanDerWaalsContact O-N 3.11Å; I143-I146 HydrophobicContact CD1-CD1 4.08Å; I143-I146 WeakPolarHBondContact O-CB 3.39Å; I143-I146 PolarHBondContact O-N 3.05Å; I146-R148 VanDerWaalsContact C-N 3.3Å; I146-R148 PolarHBondContact O-N 2.86Å; I146-Y149 PolarHBondContact O-N 3.35Å; I146-S150 PolarHBondContact O-N 3.12Å; I146-I155 HydrophobicContact CG2-CD1 4.13Å; I146-I155 HydrophobicContact CG2-CG1 4.44Å
147	V	98.6	Very high	97.9	Very high	27 Å²	27	43.5 Å²	43.5	16%	0.164	21%	0.214	C	C	.	.	H	α-helix	trans	-68.8	-31.4	-175.6	-175.2	0	0	0	0	111.6	I143 Q145 Y149 S150 P151 I155 L175	I143-V147 PolarHBondContact O-N 3.14Å; Q145-V147 PolarHBondContact O-N 3.11Å; V147-Y149 VanDerWaalsContact C-N 3.29Å; V147-Y149 PolarHBondContact O-N 2.98Å; V147-S150 CarbonylContact O-C 3.55Å; V147-P151 VanDerWaalsContact O-CA 3.26Å; V147-P151 WeakPolarHBondContact O-CA 3.28Å; V147-P151 VanDerWaalsContact O-N 3.16Å; V147-I155 HydrophobicContact CG2-CD1 4.38Å; V147-L175 HydrophobicContact CG1-CD2 4.35Å; V147-L175 HydrophobicContact CG2-CD1 4.22Å; V147-L175 HydrophobicContact CG2-CG 4.24Å
148	R	98.6	Very high	98.1	Very high	172 Å²	172	40.4 Å²	40.4	65%	0.649	20%	0.197	S	C	*	.	H	α-helix	trans	-57.4	-41.5	173.8	178	-179.4	-179.3	176.9	1.2	112.5	P144 Q145 I146	P144-R148 VanDerWaalsContact O-CB 3.28Å; P144-R148 WeakPolarHBondContact O-CB 3.49Å; P144-R148 PolarHBondContact O-N 3.41Å; Q145-R148 WeakPolarHBondContact O-CB 3.21Å; Q145-R148 PolarHBondContact O-N 3.41Å; I146-R148 VanDerWaalsContact C-N 3.3Å; I146-R148 PolarHBondContact O-N 2.86Å
149	Y	98.6	Very high	98.2	Very high	56 Å²	56	38.3 Å²	38.3	22%	0.22	19%	0.187	C	C	.	.	H	α-helix	trans	-97.9	-20	-176.3	-67.2	-69	0	0	0	113.6	Y105 A109 N110 Q145 I146 V147	Y105-Y149 VanDerWaalsContact C-CD2 3.44Å; Y105-Y149 WeakPolarHBondContact O-CD2 3.44Å; A109-Y149 VanDerWaalsContact CA-O 3.32Å; A109-Y149 WeakPolarHBondContact CA-O 3.37Å; N110-Y149 PolarHBondContact N-O 3.06Å; N110-Y149 VanDerWaalsContact N-O 3.16Å; Q145-Y149 WeakPolarHBondContact O-CD2 3.17Å; Q145-Y149 PolarHBondContact O-N 3.37Å; I146-Y149 PolarHBondContact O-N 3.35Å; V147-Y149 VanDerWaalsContact C-N 3.29Å; V147-Y149 PolarHBondContact O-N 2.98Å
150	S	98.6	Very high	98	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.014	21%	0.208	C	C	.	.			trans	-137.2	69.4	179.3	-59.6	0	0	0	0	110.7	T108 N110 S111 I146 V147 D152 C153	T108-S150 PolarHBondContact O-OG 2.87Å; N110-S150 PolarHBondContact N-OG 3.01Å; S111-S150 WeakPolarHBondContact CB-OG 3.34Å; S111-S150 PolarHBondContact N-OG 2.9Å; I146-S150 PolarHBondContact O-N 3.12Å; V147-S150 CarbonylContact O-C 3.55Å; S150-D152 PolarHBondContact O-N 3.02Å; S150-D152 VanDerWaalsContact O-N 3.14Å; S150-C153 PolarHBondContact O-N 3.22Å; S150-C153 PolarHBondContact O-SG 3.38Å
151	P	98.1	Very high	97.9	Very high	69 Å²	69	40.4 Å²	40.4	45%	0.448	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-19.8	-174.3	26.7	-36.1	0	0	0	113.6	V147 L175	V147-P151 VanDerWaalsContact O-CA 3.26Å; V147-P151 WeakPolarHBondContact O-CA 3.28Å; V147-P151 VanDerWaalsContact O-N 3.16Å; P151-L175 WeakPolarHBondContact O-CD2 3.37Å
152	D	96.8	Very high	97.9	Very high	124 Å²	124	33.5 Å²	33.5	66%	0.663	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-101.3	4.1	-178.4	-68.3	-49.2	0	0	0	114.9	S150 R179	S150-D152 PolarHBondContact O-N 3.02Å; S150-D152 VanDerWaalsContact O-N 3.14Å; D152-R179 IonicContact OD1-NH1 2.78Å; D152-R179 PolarHBondContact OD1-NH1 3.4Å
153	C	98.7	Very high	97.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-69	159.6	-176.2	71.6	0	0	0	0	113.5	S111 R112 V114 S150	S111-C153 VanDerWaalsContact O-CB 3.24Å; S111-C153 WeakPolarHBondContact O-CB 3.46Å; R112-C153 WeakPolarHBondContact O-CA 3.24Å; V114-C153 HydrophobicContact CG2-CB 3.98Å; S150-C153 PolarHBondContact O-N 3.22Å; S150-C153 PolarHBondContact O-SG 3.38Å
154	I	98.9	Very high	97.8	Very high	5 Å²	5	33 Å²	33	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	130.6	160.2	-64	158.4	0	0	0	107.6	R112 I113 V114 R179 I181 L285 S319 G321	R112-I154 PolarHBondContact O-N 3.4Å; I113-I154 CarbonylContact C-O 3.57Å; I113-I154 WeakPolarHBondContact CA-O 3.47Å; V114-I154 PolarHBondContact N-O 3.36Å; I154-R179 CarbonylContact C-O 3.55Å; I154-R179 WeakPolarHBondContact CA-O 3.3Å; I154-R179 HydrophobicContact CG1-CB 4.36Å; I154-R179 HydrophobicContact CG1-CG 4.2Å; I154-I181 HydrophobicContact CG2-CD1 3.84Å; I154-I181 HydrophobicContact CG2-CG1 4.29Å; I154-L285 HydrophobicContact CD1-CD2 4.31Å; I154-L285 HydrophobicContact CG2-CD1 4.09Å; I154-S319 WeakPolarHBondContact CD1-O 3.5Å; I154-G321 VanDerWaalsContact CD1-N 3.35Å
155	I	98.9	Very high	97.8	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.1	177.3	-55.6	179.6	0	0	0	109.2	V114 V116 I146 V147 V157 T169 L175 R179 I181	V114-I155 CarbonylContact O-C 3.57Å; V114-I155 WeakPolarHBondContact O-CA 3.31Å; V116-I155 HydrophobicContact CG2-CG2 3.8Å; I146-I155 HydrophobicContact CG2-CD1 4.13Å; I146-I155 HydrophobicContact CG2-CG1 4.44Å; V147-I155 HydrophobicContact CG2-CD1 4.38Å; I155-V157 HydrophobicContact CG2-CG2 4.12Å; I155-T169 HydrophobicContact CB-CG2 4.35Å; I155-T169 HydrophobicContact CD1-CG2 4.04Å; I155-T169 HydrophobicContact CG2-CG2 3.87Å; I155-L175 HydrophobicContact CD1-CD1 3.7Å; I155-L175 HydrophobicContact CG1-CD1 3.95Å; I155-R179 PolarHBondContact N-O 3.03Å; I155-I181 PolarHBondContact O-N 3.17Å
156	I	98.9	Very high	97.8	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	109.5	169.5	-52.7	176.5	0	0	0	108.1	I113 V114 V115 V116 V158 I181 L281 L285	I113-I156 HydrophobicContact CG2-CD1 3.74Å; I113-I156 HydrophobicContact CG2-CG1 4.05Å; V114-I156 PolarHBondContact O-N 3.48Å; V115-I156 CarbonylContact C-O 3.53Å; V115-I156 WeakPolarHBondContact CA-O 3.37Å; V115-I156 HydrophobicContact CG2-CB 4.49Å; V115-I156 HydrophobicContact CG2-CD1 4.44Å; V116-I156 PolarHBondContact N-O 3.18Å; I156-V158 HydrophobicContact CG2-CG2 4.26Å; I156-I181 CarbonylContact C-O 3.51Å; I156-I181 VanDerWaalsContact CA-O 3.28Å; I156-I181 WeakPolarHBondContact CA-O 3.44Å; I156-L281 HydrophobicContact CD1-CB 4.38Å; I156-L281 HydrophobicContact CG2-CD1 4.44Å; I156-L285 HydrophobicContact CD1-CD1 3.72Å; I156-L285 HydrophobicContact CG1-CD1 4.09Å
157	V	98.9	Very high	97.8	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	124.6	176.1	-174	0	0	0	0	109	F139 I155 V162 L165 T169 I181 G182 S183	F139-V157 HydrophobicContact CE2-CG1 4.08Å; F139-V157 HydrophobicContact CZ-CG1 4.23Å; I155-V157 HydrophobicContact CG2-CG2 4.12Å; V157-V162 HydrophobicContact CG1-CG2 4.48Å; V157-V162 VanDerWaalsContact O-CG2 3.23Å; V157-V162 WeakPolarHBondContact O-CG2 3.14Å; V157-L165 HydrophobicContact CG1-CB 4.05Å; V157-T169 HydrophobicContact CG2-CG2 3.87Å; V157-T169 WeakPolarHBondContact CG2-OG1 3.42Å; V157-I181 PolarHBondContact N-O 3.39Å; V157-G182 CarbonylContact O-C 3.54Å; V157-G182 WeakPolarHBondContact O-CA 3.33Å; V157-S183 PolarHBondContact O-N 3.37Å
158	V	98.6	Very high	97.8	Very high	7 Å²	7	27.3 Å²	27.3	4%	0.042	13%	0.133	C	C	.	.			trans	-115.7	-23.4	178.2	-173.5	0	0	0	0	111	V53 V115 V116 T117 I156 I274 V278	V53-V158 HydrophobicContact CG1-CG1 3.81Å; V115-V158 HydrophobicContact CG1-CG2 3.67Å; V116-V158 PolarHBondContact O-N 3.36Å; T117-V158 HydrophobicContact CG2-CB 4.12Å; T117-V158 HydrophobicContact CG2-CG2 4.27Å; I156-V158 HydrophobicContact CG2-CG2 4.26Å; V158-I274 HydrophobicContact CG1-CD1 3.97Å; V158-I274 HydrophobicContact CG1-CG1 3.65Å; V158-V278 HydrophobicContact CG1-CG2 4.32Å; V158-V278 HydrophobicContact CG2-CG2 3.62Å
159	S	96.9	Very high	97.8	Very high	7 Å²	7	19.1 Å²	19.1	5%	0.049	10%	0.102	C	C	.	.	S	Bend	trans	-58.4	141.8	178.2	-52.1	0	0	0	0	111.7	V116 T117 A118 V162	V116-S159 PolarHBondContact O-N 2.99Å; V116-S159 PolarHBondContact O-OG 3Å; T117-S159 VanDerWaalsContact C-OG 3.25Å; A118-S159 WeakPolarHBondContact O-CB 3.16Å; A118-S159 PolarHBondContact O-OG 3.28Å; S159-V162 WeakPolarHBondContact O-CA 3.36Å; S159-V162 PolarHBondContact O-N 2.83Å
160	N	93.3	Very high	97.7	Very high	83 Å²	83	18.4 Å²	18.4	44%	0.444	10%	0.099	S	C	.	.	S	Bend	trans	-100.4	147.3	-176.9	-78	-53.8	0	0	0	113.2	V162 L165 H215	N160-V162 PolarHBondContact OD1-N 2.9Å; N160-L165 WeakPolarHBondContact O-CD1 3.36Å; N160-H215 PolarHBondContact OD1-CD2 3.14Å
161	P	94.3	Very high	97.7	Very high	16 Å²	16	21.6 Å²	21.6	10%	0.104	11%	0.113	C	C	.	.	S	Bend	cis	-76.3	120.1	-0.2	29.2	-32.3	0	0	0	112.1	V132 D163 V164 L165	V132-P161 HydrophobicContact CG2-CG 3.39Å; P161-D163 PolarHBondContact O-N 3.32Å; P161-V164 HydrophobicContact CG-CB 4.35Å; P161-V164 PolarHBondContact O-N 3.08Å; P161-L165 WeakPolarHBondContact O-CB 3.23Å; P161-L165 WeakPolarHBondContact O-CG 3.44Å; P161-L165 PolarHBondContact O-N 2.93Å
162	V	97.1	Very high	97.7	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.006	10%	0.099	C	C	.	.	H	α-helix	trans	-63.6	-39.7	-161.7	65.2	0	0	0	0	113.7	V157 S159 N160 L165 T166 H215	V157-V162 HydrophobicContact CG1-CG2 4.48Å; V157-V162 VanDerWaalsContact O-CG2 3.23Å; V157-V162 WeakPolarHBondContact O-CG2 3.14Å; S159-V162 WeakPolarHBondContact O-CA 3.36Å; S159-V162 PolarHBondContact O-N 2.83Å; N160-V162 PolarHBondContact OD1-N 2.9Å; V162-L165 PolarHBondContact O-N 2.78Å; V162-T166 VanDerWaalsContact O-CB 3.3Å; V162-T166 WeakPolarHBondContact O-CB 3.45Å; V162-T166 PolarHBondContact O-N 3.01Å; V162-T166 PolarHBondContact O-OG1 2.91Å; V162-H215 HydrophobicContact CG1-CB 3.55Å
163	D	97.9	Very high	97.8	Very high	2 Å²	2	14.4 Å²	14.4	1%	0.011	7%	0.071	C	C	.	.	H	α-helix	trans	-64.4	-48.2	-177.7	-61.7	-57.5	0	0	0	111.9	P161 T166 Y167 H215 S296 Y310 L345	P161-D163 PolarHBondContact O-N 3.32Å; D163-T166 WeakPolarHBondContact O-CB 3.22Å; D163-T166 PolarHBondContact O-N 3.16Å; D163-Y167 PolarHBondContact O-N 3.17Å; D163-Y167 VanDerWaalsContact O-N 3.12Å; D163-H215 PolarHBondContact OD2-N 3.35Å; D163-S296 WeakPolarHBondContact OD1-CB 3.3Å; D163-S296 PolarHBondContact OD1-OG 3.19Å; D163-Y310 WeakPolarHBondContact CB-O 3.25Å; D163-Y310 WeakPolarHBondContact O-CB 3.18Å; D163-L345 HydrophobicContact CB-CD1 3.91Å; D163-L345 HydrophobicContact CB-CD2 3.92Å
164	V	96.8	Very high	97.8	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-66.4	-41.8	177.1	-175.3	0	0	0	0	111.1	V132 P161 T166 Y167 V168 L345 I348 Q349 L352	V132-V164 HydrophobicContact CG1-CG1 3.64Å; V132-V164 HydrophobicContact CG2-CG1 4.44Å; P161-V164 HydrophobicContact CG-CB 4.35Å; P161-V164 PolarHBondContact O-N 3.08Å; V164-T166 VanDerWaalsContact C-N 3.26Å; V164-T166 PolarHBondContact O-N 3.39Å; V164-Y167 WeakPolarHBondContact O-CB 3.47Å; V164-Y167 PolarHBondContact O-N 2.84Å; V164-V168 HydrophobicContact CG1-CG2 4.48Å; V164-V168 VanDerWaalsContact O-CG2 3.23Å; V164-V168 WeakPolarHBondContact O-CG2 3.48Å; V164-V168 PolarHBondContact O-N 3.25Å; V164-L345 HydrophobicContact CG2-CD2 3.63Å; V164-I348 HydrophobicContact CG1-CG2 4.34Å; V164-I348 HydrophobicContact CG2-CG2 4.29Å; V164-Q349 HydrophobicContact CG1-CG 4.14Å; V164-L352 HydrophobicContact CG1-CD1 3.72Å
165	L	97.8	Very high	97.8	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-70.7	-22.5	178.3	-66.1	-175.8	0	0	0	113	N135 F139 V157 N160 P161 V162 T169	N135-L165 HydrophobicContact CB-CD1 3.86Å; N135-L165 HydrophobicContact CB-CD2 3.64Å; N135-L165 HydrophobicContact CB-CG 4.4Å; F139-L165 HydrophobicContact CE1-CD1 4.34Å; F139-L165 HydrophobicContact CE2-CB 3.98Å; F139-L165 HydrophobicContact CZ-CB 4.18Å; F139-L165 HydrophobicContact CZ-CD1 4.1Å; V157-L165 HydrophobicContact CG1-CB 4.05Å; N160-L165 WeakPolarHBondContact O-CD1 3.36Å; P161-L165 WeakPolarHBondContact O-CB 3.23Å; P161-L165 WeakPolarHBondContact O-CG 3.44Å; P161-L165 PolarHBondContact O-N 2.93Å; V162-L165 PolarHBondContact O-N 2.78Å; L165-T169 VanDerWaalsContact O-CB 3.31Å; L165-T169 WeakPolarHBondContact O-CB 3.39Å; L165-T169 PolarHBondContact O-N 2.8Å; L165-T169 PolarHBondContact O-OG1 3.35Å
166	T	98.7	Very high	97.7	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-70.9	-44.6	170.6	-55.8	0	0	0	0	110.6	V162 D163 V164 V168 T169 W170 V180 G182 Y310	V162-T166 VanDerWaalsContact O-CB 3.3Å; V162-T166 WeakPolarHBondContact O-CB 3.45Å; V162-T166 PolarHBondContact O-N 3.01Å; V162-T166 PolarHBondContact O-OG1 2.91Å; D163-T166 WeakPolarHBondContact O-CB 3.22Å; D163-T166 PolarHBondContact O-N 3.16Å; V164-T166 VanDerWaalsContact C-N 3.26Å; V164-T166 PolarHBondContact O-N 3.39Å; T166-V168 PolarHBondContact O-N 3.23Å; T166-T169 WeakPolarHBondContact O-CB 3.44Å; T166-T169 PolarHBondContact O-N 3.27Å; T166-W170 PolarHBondContact O-N 3.48Å; T166-V180 HydrophobicContact CG2-CG1 3.88Å; T166-G182 WeakPolarHBondContact OG1-CA 3.47Å; T166-Y310 HydrophobicContact CG2-CD1 3.31Å; T166-Y310 HydrophobicContact CG2-CE1 3.57Å; T166-Y310 HydrophobicContact CG2-CG 4.09Å
167	Y	98.3	Very high	97.7	Very high	28 Å²	28	25.4 Å²	25.4	11%	0.11	14%	0.143	C	C	.	.	H	α-helix	trans	-57.5	-48.5	171.1	168.7	-93.5	0	0	0	112	D163 V164 T169 W170 K171 E308 Y310 Q349 I355	D163-Y167 PolarHBondContact O-N 3.17Å; D163-Y167 VanDerWaalsContact O-N 3.12Å; V164-Y167 WeakPolarHBondContact O-CB 3.47Å; V164-Y167 PolarHBondContact O-N 2.84Å; Y167-T169 VanDerWaalsContact C-N 3.31Å; Y167-T169 PolarHBondContact O-N 3.13Å; Y167-W170 AromaticContact CD2-CE3 3.94Å; Y167-W170 HydrophobicContact CD2-CE3 3.94Å; Y167-W170 HydrophobicContact CD2-CZ3 4.11Å; Y167-W170 HydrophobicContact CE2-CE3 4.13Å; Y167-W170 AromaticContact CE2-CZ3 3.92Å; Y167-W170 HydrophobicContact CE2-CZ3 3.92Å; Y167-W170 WeakPolarHBondContact O-CB 3.36Å; Y167-W170 PolarHBondContact O-N 2.82Å; Y167-W170 VanDerWaalsContact O-N 3.13Å; Y167-K171 HydrophobicContact CD1-CG 4.42Å; Y167-K171 HydrophobicContact CE1-CG 3.96Å; Y167-K171 HydrophobicContact CE2-CD 4.33Å; Y167-K171 HydrophobicContact CE2-CG 4.07Å; Y167-K171 PolarHBondContact O-N 3.25Å; Y167-K171 WeakPolarHBondContact OH-CE 3.35Å; Y167-E308 WeakPolarHBondContact CD2-O 3.28Å; Y167-E308 HydrophobicContact CE2-CB 4.37Å; Y167-E308 WeakPolarHBondContact CE2-O 3.24Å; Y167-Y310 HydrophobicContact CD2-CD2 4.33Å; Y167-Q349 HydrophobicContact CD1-CG 4.01Å; Y167-Q349 HydrophobicContact CE1-CG 4.33Å; Y167-Q349 HydrophobicContact CG-CG 4.34Å; Y167-I355 HydrophobicContact CE1-CD1 4.44Å
168	V	98.1	Very high	97.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.4	-44.7	177.3	171.9	0	0	0	0	110.7	V136 F139 V164 T166 W170 K171 L172 L352 I355	V136-V168 HydrophobicContact CG1-CG1 4.47Å; V136-V168 HydrophobicContact CG2-CG1 4.01Å; V136-V168 HydrophobicContact CG2-CG2 3.68Å; F139-V168 HydrophobicContact CB-CG1 4.18Å; F139-V168 HydrophobicContact CD2-CG1 4.36Å; V164-V168 HydrophobicContact CG1-CG2 4.48Å; V164-V168 VanDerWaalsContact O-CG2 3.23Å; V164-V168 WeakPolarHBondContact O-CG2 3.48Å; V164-V168 PolarHBondContact O-N 3.25Å; T166-V168 PolarHBondContact O-N 3.23Å; V168-W170 VanDerWaalsContact C-N 3.32Å; V168-W170 PolarHBondContact O-N 2.81Å; V168-K171 PolarHBondContact O-N 2.73Å; V168-L172 HydrophobicContact CG1-CD1 3.6Å; V168-L172 HydrophobicContact CG1-CG 4.19Å; V168-L172 WeakPolarHBondContact O-CB 3.48Å; V168-L172 VanDerWaalsContact O-CG 3.29Å; V168-L172 WeakPolarHBondContact O-CG 3.23Å; V168-L172 PolarHBondContact O-N 3.28Å; V168-L352 HydrophobicContact CG2-CD1 4.01Å; V168-I355 HydrophobicContact CG2-CD1 3.78Å
169	T	98.6	Very high	97.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-60.3	-43.5	176.6	-62.9	0	0	0	0	111.4	F139 I143 I155 V157 L165 T166 Y167 S173 V180	F139-T169 VanDerWaalsContact CD2-OG1 3.31Å; F139-T169 WeakPolarHBondContact CD2-OG1 3.28Å; F139-T169 WeakPolarHBondContact CE2-OG1 3.2Å; I143-T169 HydrophobicContact CD1-CG2 3.76Å; I143-T169 HydrophobicContact CG1-CG2 4.21Å; I143-T169 HydrophobicContact CG2-CG2 4.17Å; I155-T169 HydrophobicContact CB-CG2 4.35Å; I155-T169 HydrophobicContact CD1-CG2 4.04Å; I155-T169 HydrophobicContact CG2-CG2 3.87Å; V157-T169 HydrophobicContact CG2-CG2 3.87Å; V157-T169 WeakPolarHBondContact CG2-OG1 3.42Å; L165-T169 VanDerWaalsContact O-CB 3.31Å; L165-T169 WeakPolarHBondContact O-CB 3.39Å; L165-T169 PolarHBondContact O-N 2.8Å; L165-T169 PolarHBondContact O-OG1 3.35Å; T166-T169 WeakPolarHBondContact O-CB 3.44Å; T166-T169 PolarHBondContact O-N 3.27Å; Y167-T169 VanDerWaalsContact C-N 3.31Å; Y167-T169 PolarHBondContact O-N 3.13Å; T169-S173 WeakPolarHBondContact O-CB 3.27Å; T169-S173 PolarHBondContact O-N 2.85Å; T169-S173 PolarHBondContact O-OG 3.42Å; T169-V180 HydrophobicContact CG2-CG1 3.7Å
170	W	98.6	Very high	97.8	Very high	41 Å²	41	30.8 Å²	30.8	16%	0.155	17%	0.165	C	C	.	.	H	α-helix	trans	-60.3	-49.8	177.6	168.1	55.7	0	0	0	111.5	T166 Y167 V168 S173 G174 L175 V180 M298 E308 Y310	T166-W170 PolarHBondContact O-N 3.48Å; Y167-W170 AromaticContact CD2-CE3 3.94Å; Y167-W170 HydrophobicContact CD2-CE3 3.94Å; Y167-W170 HydrophobicContact CD2-CZ3 4.11Å; Y167-W170 HydrophobicContact CE2-CE3 4.13Å; Y167-W170 AromaticContact CE2-CZ3 3.92Å; Y167-W170 HydrophobicContact CE2-CZ3 3.92Å; Y167-W170 WeakPolarHBondContact O-CB 3.36Å; Y167-W170 PolarHBondContact O-N 2.82Å; Y167-W170 VanDerWaalsContact O-N 3.13Å; V168-W170 VanDerWaalsContact C-N 3.32Å; V168-W170 PolarHBondContact O-N 2.81Å; W170-S173 PolarHBondContact O-N 3.17Å; W170-S173 PolarHBondContact O-OG 3.48Å; W170-G174 PolarHBondContact O-N 3.32Å; W170-L175 PolarHBondContact NE1-O 2.67Å; W170-V180 HydrophobicContact CB-CB 4.24Å; W170-V180 HydrophobicContact CB-CG1 4.08Å; W170-V180 HydrophobicContact CB-CG2 4.38Å; W170-M298 HydrophobicContact CD2-CE 4.31Å; W170-M298 HydrophobicContact CE3-CE 3.68Å; W170-M298 HydrophobicContact CH2-CE 3.48Å; W170-M298 VanDerWaalsContact CH2-CE 3.48Å; W170-M298 HydrophobicContact CZ2-CE 4.16Å; W170-M298 HydrophobicContact CZ3-CE 3.19Å; W170-E308 HydrophobicContact CZ3-CB 4.5Å; W170-Y310 HydrophobicContact CB-CE2 4.09Å; W170-Y310 HydrophobicContact CD2-CE2 4.08Å; W170-Y310 AromaticContact CE3-CE2 3.84Å; W170-Y310 HydrophobicContact CE3-CE2 3.84Å; W170-Y310 HydrophobicContact CG-CE2 4.19Å
171	K	97.9	Very high	98.1	Very high	69 Å²	69	26.9 Å²	26.9	30%	0.3	14%	0.144	S	C	.	.	H	α-helix	trans	-61.5	-47.4	178.2	-66.5	-61.5	-169.1	-172	0	112.8	Y167 V168 S173 E308 I355	Y167-K171 HydrophobicContact CD1-CG 4.42Å; Y167-K171 HydrophobicContact CE1-CG 3.96Å; Y167-K171 HydrophobicContact CE2-CD 4.33Å; Y167-K171 HydrophobicContact CE2-CG 4.07Å; Y167-K171 PolarHBondContact O-N 3.25Å; Y167-K171 WeakPolarHBondContact OH-CE 3.35Å; V168-K171 PolarHBondContact O-N 2.73Å; K171-S173 PolarHBondContact O-N 3.13Å; K171-E308 IonicContact NZ-OE1 3.08Å; K171-E308 IonicContact NZ-OE2 3.98Å; K171-E308 PolarHBondContact NZ-OE2 3.01Å; K171-I355 HydrophobicContact CB-CG2 3.31Å; K171-I355 HydrophobicContact CG-CG2 3.74Å
172	L	98.2	Very high	98.3	Very high	31 Å²	31	26.1 Å²	26.1	16%	0.162	14%	0.139	C	C	.	.	H	α-helix	trans	-70.9	-27.9	-178.6	-68.1	176.5	0	0	0	113.8	F139 K140 I143 V168 I355	F139-L172 HydrophobicContact CB-CD1 3.82Å; K140-L172 HydrophobicContact CG-CD1 4.14Å; K140-L172 HydrophobicContact CG-CD2 4.03Å; I143-L172 HydrophobicContact CB-CB 4.1Å; I143-L172 HydrophobicContact CG2-CB 3.97Å; V168-L172 HydrophobicContact CG1-CD1 3.6Å; V168-L172 HydrophobicContact CG1-CG 4.19Å; V168-L172 WeakPolarHBondContact O-CB 3.48Å; V168-L172 VanDerWaalsContact O-CG 3.29Å; V168-L172 WeakPolarHBondContact O-CG 3.23Å; V168-L172 PolarHBondContact O-N 3.28Å; L172-I355 WeakPolarHBondContact CD2-OXT 3.28Å
173	S	98.4	Very high	98.3	Very high	12 Å²	12	26.3 Å²	26.3	8%	0.084	14%	0.141	C	C	.	.	H	α-helix	trans	-81.7	-31.3	-177.7	64.4	0	0	0	0	113	T169 W170 K171 L175	T169-S173 WeakPolarHBondContact O-CB 3.27Å; T169-S173 PolarHBondContact O-N 2.85Å; T169-S173 PolarHBondContact O-OG 3.42Å; W170-S173 PolarHBondContact O-N 3.17Å; W170-S173 PolarHBondContact O-OG 3.48Å; K171-S173 PolarHBondContact O-N 3.13Å; S173-L175 PolarHBondContact O-N 3.33Å; S173-L175 PolarHBondContact OG-N 3.32Å
174	G	98.1	Very high	98.4	Very high	68 Å²	68	26.3 Å²	26.3	70%	0.701	14%	0.141	S	C	*	.			trans	65	9.5	-168.2	0	0	0	0	0	113.8	W170	W170-G174 PolarHBondContact O-N 3.32Å
175	L	98.6	Very high	98.4	Very high	8 Å²	8	26.3 Å²	26.3	4%	0.042	14%	0.141	C	C	.	.			trans	-69.7	152.4	176.1	-72.1	175.3	0	0	0	110.3	V147 P151 I155 W170 S173 V180	V147-L175 HydrophobicContact CG1-CD2 4.35Å; V147-L175 HydrophobicContact CG2-CD1 4.22Å; V147-L175 HydrophobicContact CG2-CG 4.24Å; P151-L175 WeakPolarHBondContact O-CD2 3.37Å; I155-L175 HydrophobicContact CD1-CD1 3.7Å; I155-L175 HydrophobicContact CG1-CD1 3.95Å; W170-L175 PolarHBondContact NE1-O 2.67Å; S173-L175 PolarHBondContact O-N 3.33Å; S173-L175 PolarHBondContact OG-N 3.32Å; L175-V180 HydrophobicContact CB-CG2 3.86Å; L175-V180 HydrophobicContact CD1-CG2 4.17Å
176	P	98.6	Very high	98.5	Very high	49 Å²	49	27.1 Å²	27.1	32%	0.318	15%	0.146	S	C	.	.			trans	-64.7	141.5	172.2	31.6	-37.6	0	0	0	109.6	H178 R179	P176-H178 VanDerWaalsContact CB-CE1 3.44Å; P176-H178 WeakPolarHBondContact CB-CE1 3.12Å; P176-H178 WeakPolarHBondContact CB-ND1 3.47Å; P176-H178 WeakPolarHBondContact CG-CE1 3.49Å; P176-H178 PolarHBondContact O-N 3.31Å; P176-R179 VanDerWaalsContact CD-NH2 3.27Å; P176-R179 HydrophobicContact CG-CB 4.41Å; P176-R179 HydrophobicContact CG-CG 4.14Å; P176-R179 PolarHBondContact O-N 3.14Å
177	K	98.3	Very high	98.5	Very high	111 Å²	111	28 Å²	28	48%	0.483	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-47.9	-34.6	-170.9	61	-178	178.8	178.4	0	115.5	R179 V180 M298 Y310	K177-R179 VanDerWaalsContact C-N 3.26Å; K177-R179 PolarHBondContact O-N 3.44Å; K177-V180 PolarHBondContact O-N 3.06Å; K177-M298 HydrophobicContact CB-CB 4.27Å; K177-M298 HydrophobicContact CD-CB 4.04Å; K177-M298 HydrophobicContact CD-CG 4.01Å; K177-Y310 PolarHBondContact O-OH 3.44Å
178	H	98.7	Very high	98.4	Very high	78 Å²	78	27 Å²	27	36%	0.361	15%	0.147	S	C	.	.	G	3₁₀ helix	trans	-69.6	-16.8	180	67.1	-70.2	0	0	0	114.6	P176 G320 G321 V322	P176-H178 VanDerWaalsContact CB-CE1 3.44Å; P176-H178 WeakPolarHBondContact CB-CE1 3.12Å; P176-H178 WeakPolarHBondContact CB-ND1 3.47Å; P176-H178 WeakPolarHBondContact CG-CE1 3.49Å; P176-H178 PolarHBondContact O-N 3.31Å; H178-G320 PolarHBondContact CD2-O 3.38Å; H178-G321 CarbonylContact O-C 3.57Å; H178-G321 WeakPolarHBondContact O-CA 3.41Å; H178-V322 HydrophobicContact CB-CB 4.35Å; H178-V322 WeakPolarHBondContact CB-O 3.31Å; H178-V322 PolarHBondContact O-N 3.41Å
179	R	98.8	Very high	98.5	Very high	50 Å²	50	27.2 Å²	27.2	19%	0.189	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-95.7	1.3	177.1	-68	-164.4	-72	-173.6	-0.6	113.7	D152 I154 I155 P176 K177	D152-R179 IonicContact OD1-NH1 2.78Å; D152-R179 PolarHBondContact OD1-NH1 3.4Å; I154-R179 CarbonylContact C-O 3.55Å; I154-R179 WeakPolarHBondContact CA-O 3.3Å; I154-R179 HydrophobicContact CG1-CB 4.36Å; I154-R179 HydrophobicContact CG1-CG 4.2Å; I155-R179 PolarHBondContact N-O 3.03Å; P176-R179 VanDerWaalsContact CD-NH2 3.27Å; P176-R179 HydrophobicContact CG-CB 4.41Å; P176-R179 HydrophobicContact CG-CG 4.14Å; P176-R179 PolarHBondContact O-N 3.14Å; K177-R179 VanDerWaalsContact C-N 3.26Å; K177-R179 PolarHBondContact O-N 3.44Å
180	V	98.9	Very high	98.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	114.6	176.7	-177	0	0	0	0	108.5	T166 T169 W170 L175 K177	T166-V180 HydrophobicContact CG2-CG1 3.88Å; T169-V180 HydrophobicContact CG2-CG1 3.7Å; W170-V180 HydrophobicContact CB-CB 4.24Å; W170-V180 HydrophobicContact CB-CG1 4.08Å; W170-V180 HydrophobicContact CB-CG2 4.38Å; L175-V180 HydrophobicContact CB-CG2 3.86Å; L175-V180 HydrophobicContact CD1-CG2 4.17Å; K177-V180 PolarHBondContact O-N 3.06Å
181	I	98.8	Very high	98.4	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	133.6	-169.7	-50.3	179.7	0	0	0	107.9	I154 I155 I156 V157 L285 V295 L317 V322	I154-I181 HydrophobicContact CG2-CD1 3.84Å; I154-I181 HydrophobicContact CG2-CG1 4.29Å; I155-I181 PolarHBondContact O-N 3.17Å; I156-I181 CarbonylContact C-O 3.51Å; I156-I181 VanDerWaalsContact CA-O 3.28Å; I156-I181 WeakPolarHBondContact CA-O 3.44Å; V157-I181 PolarHBondContact N-O 3.39Å; I181-L285 HydrophobicContact CD1-CD1 4.31Å; I181-L285 HydrophobicContact CD1-CD2 4.04Å; I181-V295 HydrophobicContact CG2-CB 3.74Å; I181-V295 HydrophobicContact CG2-CG1 4.26Å; I181-V295 HydrophobicContact CG2-CG2 3.75Å; I181-L317 HydrophobicContact CD1-CD2 4.07Å; I181-V322 HydrophobicContact CD1-CG2 3.93Å; I181-V322 HydrophobicContact CG1-CG2 3.9Å
182	G	98.8	Very high	98.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	147.2	167.4	0	0	0	0	0	110.8	V157 T166 G184 V295 S296	V157-G182 CarbonylContact O-C 3.54Å; V157-G182 WeakPolarHBondContact O-CA 3.33Å; T166-G182 WeakPolarHBondContact OG1-CA 3.47Å; G182-G184 PolarHBondContact O-N 3.18Å; G182-G184 VanDerWaalsContact O-N 3.08Å; G182-V295 WeakPolarHBondContact O-CB 3.44Å; G182-S296 PolarHBondContact N-O 3.17Å; G182-S296 PolarHBondContact O-N 2.87Å
183	S	98.7	Very high	98.4	Very high	5 Å²	5	28.2 Å²	28.2	4%	0.035	16%	0.159	C	C	.	.			trans	-55.3	-29.1	174.5	63.1	0	0	0	0	112.2	V157 N186	V157-S183 PolarHBondContact O-N 3.37Å; S183-N186 VanDerWaalsContact O-CB 3.3Å; S183-N186 WeakPolarHBondContact O-CB 3.08Å; S183-N186 PolarHBondContact O-N 3.4Å
184	G	98.2	Very high	98.4	Very high	2 Å²	2	33.3 Å²	33.3	2%	0.021	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	-142.8	170.2	0	0	0	0	0	112.7	G182 N186 S312	G182-G184 PolarHBondContact O-N 3.18Å; G182-G184 VanDerWaalsContact O-N 3.08Å; G184-N186 VanDerWaalsContact C-N 3.26Å; G184-N186 PolarHBondContact O-N 3.05Å; G184-S312 WeakPolarHBondContact CA-OG 3.35Å
185	T	98.5	Very high	98.4	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.8	19.3	-179.4	59.1	0	0	0	0	113.4	L187 D188 S189 I211 H215 P294 S312	T185-L187 PolarHBondContact O-N 3.4Å; T185-D188 PolarHBondContact O-N 3.17Å; T185-S189 WeakPolarHBondContact O-CB 3.21Å; T185-S189 PolarHBondContact O-N 3.44Å; T185-S189 PolarHBondContact O-OG 2.87Å; T185-I211 WeakPolarHBondContact CB-O 3.33Å; T185-I211 HydrophobicContact CG2-CG2 4.09Å; T185-I211 PolarHBondContact OG1-O 3.45Å; T185-H215 HydrophobicContact CG2-CB 4.46Å; T185-P294 CarbonylContact C-O 3.58Å; T185-S312 PolarHBondContact N-OG 2.9Å; T185-S312 WeakPolarHBondContact OG1-CB 3.32Å; T185-S312 PolarHBondContact OG1-OG 3.15Å
186	N	98.8	Very high	98.3	Very high	17 Å²	17	30.8 Å²	30.8	9%	0.091	15%	0.15	C	C	.	.	H	α-helix	trans	-61.8	-45.9	178.4	-171.6	46.7	0	0	0	111.3	S183 G184 A190 S277 L281 P294 V295	S183-N186 VanDerWaalsContact O-CB 3.3Å; S183-N186 WeakPolarHBondContact O-CB 3.08Å; S183-N186 PolarHBondContact O-N 3.4Å; G184-N186 VanDerWaalsContact C-N 3.26Å; G184-N186 PolarHBondContact O-N 3.05Å; N186-A190 PolarHBondContact O-N 2.9Å; N186-S277 PolarHBondContact ND2-OG 3.39Å; N186-L281 HydrophobicContact CB-CD2 4.5Å; N186-P294 WeakPolarHBondContact CA-O 3.39Å; N186-P294 PolarHBondContact N-O 3.23Å; N186-P294 WeakPolarHBondContact OD1-CD 3.4Å; N186-V295 HydrophobicContact CB-CG1 4.4Å
187	L	98.3	Very high	98.3	Very high	19 Å²	19	28.5 Å²	28.5	10%	0.099	14%	0.135	C	C	.	.	H	α-helix	trans	-69.3	-37.1	175.5	176.8	58.7	0	0	0	112	T185 A190 R191 A273 I274	T185-L187 PolarHBondContact O-N 3.4Å; L187-A190 WeakPolarHBondContact O-CB 3.43Å; L187-A190 PolarHBondContact O-N 2.84Å; L187-R191 HydrophobicContact CD1-CG 4.4Å; L187-R191 WeakPolarHBondContact O-CG 3.35Å; L187-R191 PolarHBondContact O-N 2.87Å; L187-A273 HydrophobicContact CD1-CB 3.66Å; L187-A273 HydrophobicContact CD2-CB 4.36Å; L187-I274 HydrophobicContact CD2-CB 3.99Å; L187-I274 HydrophobicContact CD2-CD1 4.25Å
188	D	97.8	Very high	98.2	Very high	6 Å²	6	28.6 Å²	28.6	3%	0.032	14%	0.141	C	C	.	.	H	α-helix	trans	-67.2	-40.6	179.5	-59.6	-26.1	0	0	0	111.2	T185 A190 R191 F192 I211 H215 V256	T185-D188 PolarHBondContact O-N 3.17Å; D188-A190 VanDerWaalsContact C-N 3.33Å; D188-A190 PolarHBondContact O-N 2.88Å; D188-R191 PolarHBondContact O-N 3.15Å; D188-R191 IonicContact OD1-NH1 3.42Å; D188-R191 PolarHBondContact OD1-NH1 3.04Å; D188-F192 WeakPolarHBondContact O-CB 3.41Å; D188-F192 PolarHBondContact O-N 2.88Å; D188-I211 HydrophobicContact CB-CB 4.25Å; D188-I211 HydrophobicContact CB-CG1 4.47Å; D188-I211 HydrophobicContact CB-CG2 4.11Å; D188-H215 IonicContact OD1-CE1 2.62Å; D188-H215 IonicContact OD1-ND1 3.25Å; D188-H215 IonicContact OD2-CE1 3.1Å; D188-H215 PolarHBondContact OD2-CE1 3.08Å; D188-H215 VanDerWaalsContact OD2-CE1 3.32Å; D188-H215 IonicContact OD2-CG 2.59Å; D188-H215 IonicContact OD2-ND1 2.7Å; D188-H215 PolarHBondContact OD2-ND1 3.23Å; D188-V256 HydrophobicContact CB-CG1 3.75Å; D188-V256 WeakPolarHBondContact O-CG1 3.46Å
189	S	98.5	Very high	98.1	Very high	4 Å²	4	29.2 Å²	29.2	3%	0.028	14%	0.143	C	C	.	.	H	α-helix	trans	-62.5	-39.7	171.4	-63.6	0	0	0	0	111.6	T185 F192 R193 I211 P294	T185-S189 WeakPolarHBondContact O-CB 3.21Å; T185-S189 PolarHBondContact O-N 3.44Å; T185-S189 PolarHBondContact O-OG 2.87Å; S189-F192 PolarHBondContact O-N 3.43Å; S189-R193 WeakPolarHBondContact O-CB 3.42Å; S189-R193 WeakPolarHBondContact O-CG 3.49Å; S189-R193 PolarHBondContact O-N 3.46Å; S189-I211 PolarHBondContact OG-N 2.88Å; S189-I211 PolarHBondContact OG-O 3.32Å; S189-P294 WeakPolarHBondContact OG-CG 3.44Å
190	A	98.4	Very high	98	Very high	52 Å²	52	30.2 Å²	30.2	43%	0.43	15%	0.151	S	C	.	.	H	α-helix	trans	-63.6	-40.9	174.6	0	0	0	0	0	112.5	N186 L187 D188 R193 F194	N186-A190 PolarHBondContact O-N 2.9Å; L187-A190 WeakPolarHBondContact O-CB 3.43Å; L187-A190 PolarHBondContact O-N 2.84Å; D188-A190 VanDerWaalsContact C-N 3.33Å; D188-A190 PolarHBondContact O-N 2.88Å; A190-R193 PolarHBondContact O-N 2.93Å; A190-F194 WeakPolarHBondContact O-CB 3.47Å; A190-F194 PolarHBondContact O-N 2.75Å
191	R	97.8	Very high	97.9	Very high	35 Å²	35	33.6 Å²	33.6	13%	0.132	19%	0.186	C	C	.	.	H	α-helix	trans	-65.3	-43.5	174.4	-73.7	168.6	169.4	162	-8.6	111.8	L187 D188 R193 F194 L195 V256	L187-R191 HydrophobicContact CD1-CG 4.4Å; L187-R191 WeakPolarHBondContact O-CG 3.35Å; L187-R191 PolarHBondContact O-N 2.87Å; D188-R191 PolarHBondContact O-N 3.15Å; D188-R191 IonicContact OD1-NH1 3.42Å; D188-R191 PolarHBondContact OD1-NH1 3.04Å; R191-R193 PolarHBondContact O-N 2.78Å; R191-F194 WeakPolarHBondContact O-CB 3.32Å; R191-F194 PolarHBondContact O-N 3.3Å; R191-L195 WeakPolarHBondContact O-CG 3.24Å; R191-L195 PolarHBondContact O-N 2.89Å; R191-V256 HydrophobicContact CB-CG1 4.14Å; R191-V256 HydrophobicContact CB-CG2 4.11Å
192	F	98	Very high	97.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.1	-50.3	176	-175.7	-115.7	0	0	0	110.3	D188 S189 F194 L195 M196 F207 I211 W223 T226 T252 V256	D188-F192 WeakPolarHBondContact O-CB 3.41Å; D188-F192 PolarHBondContact O-N 2.88Å; S189-F192 PolarHBondContact O-N 3.43Å; F192-F194 VanDerWaalsContact C-N 3.3Å; F192-F194 PolarHBondContact O-N 2.83Å; F192-L195 PolarHBondContact O-N 3.35Å; F192-M196 HydrophobicContact CD1-CG 4.26Å; F192-M196 HydrophobicContact CD2-CG 4.03Å; F192-M196 HydrophobicContact CE1-CG 4.02Å; F192-M196 HydrophobicContact CE2-CG 3.77Å; F192-M196 HydrophobicContact CE2-SD 3.81Å; F192-M196 HydrophobicContact CG-CG 4.26Å; F192-M196 HydrophobicContact CZ-CE 4.32Å; F192-M196 HydrophobicContact CZ-CG 3.77Å; F192-M196 HydrophobicContact CZ-SD 3.9Å; F192-M196 WeakPolarHBondContact O-CB 3.34Å; F192-M196 WeakPolarHBondContact O-CG 3.21Å; F192-M196 PolarHBondContact O-N 2.83Å; F192-F207 HydrophobicContact CD1-CE1 4.37Å; F192-F207 HydrophobicContact CE1-CE1 4.09Å; F192-I211 HydrophobicContact CB-CD1 4.02Å; F192-I211 HydrophobicContact CB-CG1 3.74Å; F192-I211 HydrophobicContact CD1-CD1 4.09Å; F192-I211 HydrophobicContact CD1-CG1 4.41Å; F192-I211 HydrophobicContact CD2-CD1 3.91Å; F192-I211 HydrophobicContact CE2-CD1 4.41Å; F192-I211 HydrophobicContact CG-CD1 3.74Å; F192-I211 HydrophobicContact CG-CG1 4.02Å; F192-W223 AromaticContact CE2-CH2 3.64Å; F192-W223 HydrophobicContact CE2-CH2 3.64Å; F192-W223 HydrophobicContact CE2-CZ2 4.18Å; F192-W223 HydrophobicContact CE2-CZ3 4.07Å; F192-W223 HydrophobicContact CZ-CE3 4.22Å; F192-W223 AromaticContact CZ-CH2 3.73Å; F192-W223 HydrophobicContact CZ-CH2 3.73Å; F192-W223 HydrophobicContact CZ-CZ2 4.33Å; F192-W223 AromaticContact CZ-CZ3 3.68Å; F192-W223 HydrophobicContact CZ-CZ3 3.68Å; F192-T226 HydrophobicContact CE1-CG2 3.83Å; F192-T226 HydrophobicContact CZ-CG2 4.08Å; F192-T252 HydrophobicContact CD2-CG2 3.96Å; F192-T252 HydrophobicContact CE2-CG2 4.05Å; F192-V256 VanDerWaalsContact CA-CG2 3.5Å; F192-V256 HydrophobicContact CB-CG2 3.82Å; F192-V256 HydrophobicContact CD2-CG2 4.14Å
193	R	98.4	Very high	97.9	Very high	76 Å²	76	42.6 Å²	42.6	29%	0.287	23%	0.229	S	C	.	.	H	α-helix	trans	-60.4	-37.6	176.4	-67.1	171.4	68.9	177.2	8.7	112.8	S189 A190 R191 A197 S204 S205 F207	S189-R193 WeakPolarHBondContact O-CB 3.42Å; S189-R193 WeakPolarHBondContact O-CG 3.49Å; S189-R193 PolarHBondContact O-N 3.46Å; A190-R193 PolarHBondContact O-N 2.93Å; R191-R193 PolarHBondContact O-N 2.78Å; R193-A197 WeakPolarHBondContact O-CB 3.35Å; R193-A197 PolarHBondContact O-N 3.03Å; R193-S204 PolarHBondContact NE-O 3.04Å; R193-S204 PolarHBondContact NH2-O 3.39Å; R193-S205 PolarHBondContact NH2-O 3.15Å; R193-F207 HydrophobicContact CB-CD1 4.23Å; R193-F207 HydrophobicContact CG-CD1 4.06Å; R193-F207 PolarHBondContact NE-O 3.36Å; R193-F207 PolarHBondContact NH2-O 2.91Å; R193-F207 VanDerWaalsContact NH2-O 3.09Å
194	F	98.1	Very high	97.9	Very high	119 Å²	119	44.2 Å²	44.2	52%	0.522	24%	0.241	S	C	.	.	H	α-helix	trans	-61.8	-54.7	174.6	166.9	-103.4	0	0	0	111.7	A190 R191 F192 M196 A197 D198	A190-F194 WeakPolarHBondContact O-CB 3.47Å; A190-F194 PolarHBondContact O-N 2.75Å; R191-F194 WeakPolarHBondContact O-CB 3.32Å; R191-F194 PolarHBondContact O-N 3.3Å; F192-F194 VanDerWaalsContact C-N 3.3Å; F192-F194 PolarHBondContact O-N 2.83Å; F194-M196 PolarHBondContact O-N 3.18Å; F194-A197 PolarHBondContact O-N 3.37Å; F194-D198 WeakPolarHBondContact O-CB 3.42Å; F194-D198 PolarHBondContact O-N 3.13Å
195	L	97.2	Very high	97.8	Very high	23 Å²	23	47.6 Å²	47.6	12%	0.12	26%	0.264	C	S	.	.	H	α-helix	trans	-65	-39.9	-177.1	-67.4	171.3	0	0	0	112.5	R191 F192 K199 T252 M255 V256	R191-L195 WeakPolarHBondContact O-CG 3.24Å; R191-L195 PolarHBondContact O-N 2.89Å; F192-L195 PolarHBondContact O-N 3.35Å; L195-K199 PolarHBondContact O-N 2.81Å; L195-K199 VanDerWaalsContact O-N 3.16Å; L195-T252 HydrophobicContact CB-CG2 3.47Å; L195-T252 VanDerWaalsContact CB-CG2 3.47Å; L195-T252 HydrophobicContact CD1-CG2 4.06Å; L195-T252 HydrophobicContact CG-CG2 4.43Å; L195-M255 HydrophobicContact CD1-CB 3.73Å; L195-M255 HydrophobicContact CD1-CE 4.49Å; L195-M255 HydrophobicContact CD2-CE 3.86Å; L195-V256 HydrophobicContact CD1-CG2 3.85Å
196	M	97.3	Very high	97.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.3	-43.9	176.2	-66.1	-64	-70.1	0	0	111.4	F192 F194 K199 L200 F207 W223 L233 W249 T252	F192-M196 HydrophobicContact CD1-CG 4.26Å; F192-M196 HydrophobicContact CD2-CG 4.03Å; F192-M196 HydrophobicContact CE1-CG 4.02Å; F192-M196 HydrophobicContact CE2-CG 3.77Å; F192-M196 HydrophobicContact CE2-SD 3.81Å; F192-M196 HydrophobicContact CG-CG 4.26Å; F192-M196 HydrophobicContact CZ-CE 4.32Å; F192-M196 HydrophobicContact CZ-CG 3.77Å; F192-M196 HydrophobicContact CZ-SD 3.9Å; F192-M196 WeakPolarHBondContact O-CB 3.34Å; F192-M196 WeakPolarHBondContact O-CG 3.21Å; F192-M196 PolarHBondContact O-N 2.83Å; F194-M196 PolarHBondContact O-N 3.18Å; M196-K199 PolarHBondContact O-N 3.39Å; M196-L200 WeakPolarHBondContact O-CG 3.39Å; M196-L200 PolarHBondContact O-N 3.24Å; M196-F207 HydrophobicContact CB-CD1 3.71Å; M196-F207 HydrophobicContact CB-CD2 3.92Å; M196-F207 HydrophobicContact CB-CE1 3.44Å; M196-F207 VanDerWaalsContact CB-CE1 3.44Å; M196-F207 HydrophobicContact CB-CE2 3.68Å; M196-F207 HydrophobicContact CB-CG 3.95Å; M196-F207 HydrophobicContact CB-CZ 3.44Å; M196-F207 VanDerWaalsContact CB-CZ 3.44Å; M196-F207 HydrophobicContact CE-CE1 4.42Å; M196-F207 HydrophobicContact CE-CE2 3.91Å; M196-F207 HydrophobicContact CE-CZ 3.5Å; M196-F207 HydrophobicContact CG-CD1 4.32Å; M196-F207 HydrophobicContact CG-CE1 3.61Å; M196-F207 HydrophobicContact CG-CE2 4.31Å; M196-F207 HydrophobicContact CG-CZ 3.62Å; M196-F207 HydrophobicContact SD-CZ 4.42Å; M196-W223 HydrophobicContact CE-CZ3 3.83Å; M196-W223 HydrophobicContact SD-CH2 4.32Å; M196-W223 HydrophobicContact SD-CZ3 4.13Å; M196-L233 HydrophobicContact CE-CD2 3.87Å; M196-W249 HydrophobicContact CE-CD2 4.17Å; M196-W249 HydrophobicContact CE-CE3 3.28Å; M196-W249 HydrophobicContact CE-CH2 4.48Å; M196-W249 HydrophobicContact CE-CZ3 3.45Å; M196-W249 VanDerWaalsContact CE-CZ3 3.45Å; M196-W249 HydrophobicContact SD-CE3 3.41Å; M196-W249 HydrophobicContact SD-CZ3 3.64Å; M196-T252 HydrophobicContact CG-CG2 3.96Å; M196-T252 HydrophobicContact SD-CG2 3.63Å
197	A	97.6	Very high	97.8	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-68.6	-35.9	179.4	0	0	0	0	0	112.7	R193 F194 L200 G201 I202 F207	R193-A197 WeakPolarHBondContact O-CB 3.35Å; R193-A197 PolarHBondContact O-N 3.03Å; F194-A197 PolarHBondContact O-N 3.37Å; A197-L200 CarbonylContact O-C 3.59Å; A197-L200 PolarHBondContact O-N 2.98Å; A197-L200 VanDerWaalsContact O-N 3.16Å; A197-G201 PolarHBondContact O-N 2.84Å; A197-I202 CarbonylContact C-O 3.53Å; A197-I202 HydrophobicContact CB-CG1 3.93Å; A197-I202 WeakPolarHBondContact CB-O 3.5Å; A197-I202 PolarHBondContact O-N 2.96Å; A197-F207 HydrophobicContact CB-CB 4Å
198	D	97.1	Very high	97.8	Very high	112 Å²	112	51.6 Å²	51.6	60%	0.599	29%	0.29	S	S	*	.	H	α-helix	trans	-61.7	-47.5	175.1	-170.1	64.8	0	0	0	111.3	F194 L200 G201	F194-D198 WeakPolarHBondContact O-CB 3.42Å; F194-D198 PolarHBondContact O-N 3.13Å; D198-L200 PolarHBondContact O-N 3.41Å; D198-G201 PolarHBondContact O-N 3.1Å; D198-G201 VanDerWaalsContact O-N 3.07Å
199	K	96.1	Very high	97.8	Very high	92 Å²	92	51.5 Å²	51.5	40%	0.4	29%	0.29	S	S	.	.	H	α-helix	trans	-56.6	-32.7	173	-78.8	-173.8	169.4	-176.8	0	113.1	L195 M196 W249 T252	L195-K199 PolarHBondContact O-N 2.81Å; L195-K199 VanDerWaalsContact O-N 3.16Å; M196-K199 PolarHBondContact O-N 3.39Å; K199-W249 HydrophobicContact CB-CH2 3.71Å; K199-W249 HydrophobicContact CB-CZ3 3.75Å; K199-W249 HydrophobicContact CD-CE3 3.81Å; K199-W249 HydrophobicContact CD-CH2 4.02Å; K199-W249 HydrophobicContact CD-CZ3 3.5Å; K199-W249 VanDerWaalsContact CD-CZ3 3.5Å; K199-W249 HydrophobicContact CG-CZ3 4.25Å; K199-T252 WeakPolarHBondContact CE-OG1 3.33Å; K199-T252 PolarHBondContact NZ-OG1 2.96Å
200	L	96.6	Very high	97.7	Very high	71 Å²	71	54.4 Å²	54.4	37%	0.372	30%	0.301	S	S	.	.	H	α-helix	trans	-91.9	-4.9	-179.4	-65.2	174.2	0	0	0	113.9	M196 A197 D198 I202 F207 V228 W249	M196-L200 WeakPolarHBondContact O-CG 3.39Å; M196-L200 PolarHBondContact O-N 3.24Å; A197-L200 CarbonylContact O-C 3.59Å; A197-L200 PolarHBondContact O-N 2.98Å; A197-L200 VanDerWaalsContact O-N 3.16Å; D198-L200 PolarHBondContact O-N 3.41Å; L200-I202 VanDerWaalsContact C-N 3.33Å; L200-I202 HydrophobicContact CB-CD1 4.29Å; L200-I202 HydrophobicContact CB-CG1 4.05Å; L200-I202 HydrophobicContact CD1-CD1 4.29Å; L200-I202 PolarHBondContact O-N 3.42Å; L200-F207 HydrophobicContact CD1-CD2 3.81Å; L200-F207 HydrophobicContact CD1-CE2 4.01Å; L200-V228 HydrophobicContact CD1-CG2 3.89Å; L200-W249 HydrophobicContact CD2-CH2 3.79Å; L200-W249 HydrophobicContact CD2-CZ2 4.24Å; L200-W249 HydrophobicContact CG-CH2 3.96Å
201	G	97.8	Very high	97.7	Very high	70 Å²	70	51.9 Å²	51.9	72%	0.722	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	29.3	-176.5	0	0	0	0	0	114.5	A197 D198	A197-G201 PolarHBondContact O-N 2.84Å; D198-G201 PolarHBondContact O-N 3.1Å; D198-G201 VanDerWaalsContact O-N 3.07Å
202	I	98.6	Very high	97.8	Very high	64 Å²	64	50.2 Å²	50.2	33%	0.328	27%	0.274	S	S	.	.	S	Bend	trans	-121.7	168.5	179.3	65.4	177.2	0	0	0	111.6	A197 L200 F207 V228	A197-I202 CarbonylContact C-O 3.53Å; A197-I202 HydrophobicContact CB-CG1 3.93Å; A197-I202 WeakPolarHBondContact CB-O 3.5Å; A197-I202 PolarHBondContact O-N 2.96Å; L200-I202 VanDerWaalsContact C-N 3.33Å; L200-I202 HydrophobicContact CB-CD1 4.29Å; L200-I202 HydrophobicContact CB-CG1 4.05Å; L200-I202 HydrophobicContact CD1-CD1 4.29Å; L200-I202 PolarHBondContact O-N 3.42Å; I202-F207 HydrophobicContact CD1-CB 4.36Å; I202-V228 HydrophobicContact CD1-CB 4.44Å; I202-V228 HydrophobicContact CD1-CG1 3.82Å; I202-V228 HydrophobicContact CD1-CG2 3.68Å
203	H	98.6	Very high	97.7	Very high	126 Å²	126	50.2 Å²	50.2	58%	0.583	27%	0.274	S	S	*	.			trans	-75.7	143.4	174.4	-170.3	-99.6	0	0	0	111.4	S205 S206	H203-S205 VanDerWaalsContact ND1-CB 3.33Å; H203-S205 WeakPolarHBondContact ND1-CB 3.41Å; H203-S205 PolarHBondContact ND1-N 3.45Å; H203-S205 VanDerWaalsContact ND1-N 3.19Å; H203-S205 PolarHBondContact ND1-OG 3.25Å; H203-S205 PolarHBondContact O-N 2.79Å; H203-S205 VanDerWaalsContact O-N 3.13Å; H203-S206 WeakPolarHBondContact O-CB 3.46Å; H203-S206 PolarHBondContact O-N 2.83Å
204	S	97.9	Very high	97.7	Very high	40 Å²	40	46.8 Å²	46.8	28%	0.28	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-60.1	-25.5	-177.8	61.8	0	0	0	0	114.3	R193 S206 F207	R193-S204 PolarHBondContact NE-O 3.04Å; R193-S204 PolarHBondContact NH2-O 3.39Å; S204-S206 PolarHBondContact O-N 3.24Å; S204-F207 PolarHBondContact O-N 3.29Å; S204-F207 VanDerWaalsContact O-O 3.11Å
205	S	97.3	Very high	97.5	Very high	72 Å²	72	43.2 Å²	43.2	50%	0.503	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-65.5	-24.8	173.1	68.2	0	0	0	0	113.3	R193 H203	R193-S205 PolarHBondContact NH2-O 3.15Å; H203-S205 VanDerWaalsContact ND1-CB 3.33Å; H203-S205 WeakPolarHBondContact ND1-CB 3.41Å; H203-S205 PolarHBondContact ND1-N 3.45Å; H203-S205 VanDerWaalsContact ND1-N 3.19Å; H203-S205 PolarHBondContact ND1-OG 3.25Å; H203-S205 PolarHBondContact O-N 2.79Å; H203-S205 VanDerWaalsContact O-N 3.13Å
206	S	98.1	Very high	97.1	Very high	63 Å²	63	43 Å²	43	44%	0.441	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-93.1	-9.9	-177.6	-57.2	0	0	0	0	113.1	H203 S204	H203-S206 WeakPolarHBondContact O-CB 3.46Å; H203-S206 PolarHBondContact O-N 2.83Å; S204-S206 PolarHBondContact O-N 3.24Å
207	F	98.4	Very high	96.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	132.9	169.7	-174.2	-88.9	0	0	0	110	F192 R193 M196 A197 L200 I202 S204 T226 V228 L233	F192-F207 HydrophobicContact CD1-CE1 4.37Å; F192-F207 HydrophobicContact CE1-CE1 4.09Å; R193-F207 HydrophobicContact CB-CD1 4.23Å; R193-F207 HydrophobicContact CG-CD1 4.06Å; R193-F207 PolarHBondContact NE-O 3.36Å; R193-F207 PolarHBondContact NH2-O 2.91Å; R193-F207 VanDerWaalsContact NH2-O 3.09Å; M196-F207 HydrophobicContact CB-CD1 3.71Å; M196-F207 HydrophobicContact CB-CD2 3.92Å; M196-F207 HydrophobicContact CB-CE1 3.44Å; M196-F207 VanDerWaalsContact CB-CE1 3.44Å; M196-F207 HydrophobicContact CB-CE2 3.68Å; M196-F207 HydrophobicContact CB-CG 3.95Å; M196-F207 HydrophobicContact CB-CZ 3.44Å; M196-F207 VanDerWaalsContact CB-CZ 3.44Å; M196-F207 HydrophobicContact CE-CE1 4.42Å; M196-F207 HydrophobicContact CE-CE2 3.91Å; M196-F207 HydrophobicContact CE-CZ 3.5Å; M196-F207 HydrophobicContact CG-CD1 4.32Å; M196-F207 HydrophobicContact CG-CE1 3.61Å; M196-F207 HydrophobicContact CG-CE2 4.31Å; M196-F207 HydrophobicContact CG-CZ 3.62Å; M196-F207 HydrophobicContact SD-CZ 4.42Å; A197-F207 HydrophobicContact CB-CB 4Å; L200-F207 HydrophobicContact CD1-CD2 3.81Å; L200-F207 HydrophobicContact CD1-CE2 4.01Å; I202-F207 HydrophobicContact CD1-CB 4.36Å; S204-F207 PolarHBondContact O-N 3.29Å; S204-F207 VanDerWaalsContact O-O 3.11Å; F207-T226 HydrophobicContact CZ-CG2 4.22Å; F207-V228 HydrophobicContact CD2-CG2 3.6Å; F207-V228 HydrophobicContact CE2-CG2 4.22Å; F207-L233 HydrophobicContact CE2-CD1 4.34Å; F207-L233 HydrophobicContact CE2-CD2 3.82Å; F207-L233 HydrophobicContact CZ-CD2 4.3Å
208	N	97.9	Very high	96.3	Very high	58 Å²	58	50.6 Å²	50.6	31%	0.31	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	126	175.2	-61	-58.5	0	0	0	109.6	T226 N227	N208-T226 WeakPolarHBondContact O-CA 3.46Å; N208-N227 WeakPolarHBondContact CB-ND2 3.44Å; N208-N227 PolarHBondContact N-O 2.97Å; N208-N227 PolarHBondContact ND2-OD1 2.83Å; N208-N227 PolarHBondContact O-N 3.46Å
209	G	97.4	Very high	96.2	Very high	3 Å²	3	45.5 Å²	45.5	3%	0.031	27%	0.265	C	S	.	.			trans	-168.2	153.2	177.3	0	0	0	0	0	109.8
210	W	98.2	Very high	96.3	Very high	65 Å²	65	41.2 Å²	41.2	25%	0.246	25%	0.246	C	C	.	.			trans	-130.7	131.3	-171.2	-56.1	91.9	0	0	0	110	L212 V222 I292 P294 P314 M328	W210-L212 HydrophobicContact CB-CD2 4.2Å; W210-L212 HydrophobicContact CB-CG 4.42Å; W210-V222 HydrophobicContact CB-CB 4.42Å; W210-V222 HydrophobicContact CB-CG2 4.41Å; W210-V222 PolarHBondContact O-N 3.16Å; W210-I292 HydrophobicContact CH2-CB 4.34Å; W210-I292 HydrophobicContact CH2-CG2 3.7Å; W210-I292 HydrophobicContact CZ3-CG2 4.11Å; W210-P294 HydrophobicContact CE3-CB 4.04Å; W210-P294 HydrophobicContact CE3-CG 3.84Å; W210-P294 HydrophobicContact CZ3-CB 4.38Å; W210-P294 HydrophobicContact CZ3-CG 4.02Å; W210-P314 HydrophobicContact CE3-CB 4.31Å; W210-P314 HydrophobicContact CE3-CG 4.47Å; W210-P314 HydrophobicContact CZ3-CB 4.14Å; W210-M328 HydrophobicContact CG-CE 4.45Å
211	I	98.3	Very high	96.4	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124.7	162.3	-57	-55.5	0	0	0	106.3	T185 D188 S189 F192 V220 P221	T185-I211 WeakPolarHBondContact CB-O 3.33Å; T185-I211 HydrophobicContact CG2-CG2 4.09Å; T185-I211 PolarHBondContact OG1-O 3.45Å; D188-I211 HydrophobicContact CB-CB 4.25Å; D188-I211 HydrophobicContact CB-CG1 4.47Å; D188-I211 HydrophobicContact CB-CG2 4.11Å; S189-I211 PolarHBondContact OG-N 2.88Å; S189-I211 PolarHBondContact OG-O 3.32Å; F192-I211 HydrophobicContact CB-CD1 4.02Å; F192-I211 HydrophobicContact CB-CG1 3.74Å; F192-I211 HydrophobicContact CD1-CD1 4.09Å; F192-I211 HydrophobicContact CD1-CG1 4.41Å; F192-I211 HydrophobicContact CD2-CD1 3.91Å; F192-I211 HydrophobicContact CE2-CD1 4.41Å; F192-I211 HydrophobicContact CG-CD1 3.74Å; F192-I211 HydrophobicContact CG-CG1 4.02Å; I211-V220 CarbonylContact C-O 3.58Å; I211-V220 WeakPolarHBondContact CA-O 3.27Å; I211-P221 HydrophobicContact CD1-CB 3.66Å
212	L	98.3	Very high	96.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	-173.9	-178.8	-57.5	-172.8	0	0	0	111	W210 V220 V222 P294 S312 L313 P314 M328 L330	W210-L212 HydrophobicContact CB-CD2 4.2Å; W210-L212 HydrophobicContact CB-CG 4.42Å; L212-V220 HydrophobicContact CB-CB 4.5Å; L212-V220 PolarHBondContact N-O 3.4Å; L212-V220 PolarHBondContact O-N 3.18Å; L212-V222 HydrophobicContact CB-CG2 4.45Å; L212-V222 HydrophobicContact CD1-CG2 3.6Å; L212-V222 HydrophobicContact CG-CG2 3.72Å; L212-P294 HydrophobicContact CD2-CB 4Å; L212-S312 WeakPolarHBondContact CB-O 3.23Å; L212-L313 HydrophobicContact CD1-CD2 4.27Å; L212-P314 HydrophobicContact CD2-CG 4.01Å; L212-M328 HydrophobicContact CD1-SD 3.71Å; L212-L330 HydrophobicContact CD1-CD2 4.41Å
213	G	97.6	Very high	96.3	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	81.2	-151.8	174.5	0	0	0	0	0	113	S312	G213-S312 PolarHBondContact N-O 3.45Å; G213-S312 VanDerWaalsContact O-CB 3.3Å; G213-S312 WeakPolarHBondContact O-CB 3.43Å; G213-S312 PolarHBondContact O-N 3.44Å; G213-S312 PolarHBondContact O-OG 2.9Å
214	E	96.9	Very high	96.2	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.019	17%	0.166	C	C	.	.	S	Bend	trans	-66.1	137.8	175.3	173.4	-177.6	167	0	0	110.4	R128 G216 T218 S219 L345	R128-E214 IonicContact CZ-OE1 3.44Å; R128-E214 IonicContact NH1-OE1 3.85Å; R128-E214 PolarHBondContact NH1-OE1 3.42Å; R128-E214 IonicContact NH2-OE1 3.84Å; R128-E214 PolarHBondContact NH2-OE1 2.85Å; E214-G216 PolarHBondContact O-N 3.44Å; E214-T218 VanDerWaalsContact CB-OG1 3.3Å; E214-T218 WeakPolarHBondContact CB-OG1 3.36Å; E214-T218 WeakPolarHBondContact CG-OG1 3.46Å; E214-T218 PolarHBondContact OE2-OG1 3.33Å; E214-S219 VanDerWaalsContact O-CA 3.24Å; E214-S219 WeakPolarHBondContact O-CA 3.04Å; E214-S219 WeakPolarHBondContact O-CB 3.37Å; E214-S219 PolarHBondContact O-N 2.89Å; E214-L345 HydrophobicContact CB-CD1 3.92Å; E214-L345 HydrophobicContact CB-CG 4.29Å; E214-L345 HydrophobicContact CG-CD1 4.24Å; E214-L345 HydrophobicContact CG-CD2 4.03Å; E214-L345 HydrophobicContact CG-CG 4.22Å
215	H	95.1	Very high	96.1	Very high	44 Å²	44	27.1 Å²	27.1	20%	0.204	16%	0.162	C	C	.	.	S	Bend	trans	-69.7	110.7	167.3	174.1	53.7	0	0	0	110.1	N160 V162 D163 T185 D188	N160-H215 PolarHBondContact OD1-CD2 3.14Å; V162-H215 HydrophobicContact CG1-CB 3.55Å; D163-H215 PolarHBondContact OD2-N 3.35Å; T185-H215 HydrophobicContact CG2-CB 4.46Å; D188-H215 IonicContact OD1-CE1 2.62Å; D188-H215 IonicContact OD1-ND1 3.25Å; D188-H215 IonicContact OD2-CE1 3.1Å; D188-H215 PolarHBondContact OD2-CE1 3.08Å; D188-H215 VanDerWaalsContact OD2-CE1 3.32Å; D188-H215 IonicContact OD2-CG 2.59Å; D188-H215 IonicContact OD2-ND1 2.7Å; D188-H215 PolarHBondContact OD2-ND1 3.23Å
216	G	89.1	Confident	96.1	Very high	18 Å²	18	23.7 Å²	23.7	19%	0.186	14%	0.138	C	C	.	.	S	Bend	trans	134	-144.8	177.1	0	0	0	0	0	112.7	E214 T218 S219	E214-G216 PolarHBondContact O-N 3.44Å; G216-T218 PolarHBondContact O-N 3.09Å; G216-S219 VanDerWaalsContact O-CB 3.23Å; G216-S219 WeakPolarHBondContact O-CB 3.34Å; G216-S219 PolarHBondContact O-N 3.2Å; G216-S219 VanDerWaalsContact O-N 3.09Å; G216-S219 PolarHBondContact O-OG 2.84Å
217	D	85.8	Confident	96.1	Very high	107 Å²	107	22.3 Å²	22.3	57%	0.572	13%	0.126	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-26.5	-167.5	-55.7	-14.4	0	0	0	113.7	V257 Y261	D217-V257 HydrophobicContact CB-CG1 4.49Å; D217-V257 WeakPolarHBondContact OD1-CG1 3.46Å; D217-Y261 PolarHBondContact OD1-OH 3.35Å
218	T	91.8	Very high	96.1	Very high	54 Å²	54	24.3 Å²	24.3	33%	0.331	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	19.3	179.8	55.1	0	0	0	0	112.3	E214 G216 S341	E214-T218 VanDerWaalsContact CB-OG1 3.3Å; E214-T218 WeakPolarHBondContact CB-OG1 3.36Å; E214-T218 WeakPolarHBondContact CG-OG1 3.46Å; E214-T218 PolarHBondContact OE2-OG1 3.33Å; G216-T218 PolarHBondContact O-N 3.09Å; T218-S341 PolarHBondContact O-OG 2.89Å
219	S	95.8	Very high	96.1	Very high	5 Å²	5	26.1 Å²	26.1	4%	0.035	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	148.6	173.4	61.5	0	0	0	0	111.8	E214 G216 P221 H253	E214-S219 VanDerWaalsContact O-CA 3.24Å; E214-S219 WeakPolarHBondContact O-CA 3.04Å; E214-S219 WeakPolarHBondContact O-CB 3.37Å; E214-S219 PolarHBondContact O-N 2.89Å; G216-S219 VanDerWaalsContact O-CB 3.23Å; G216-S219 WeakPolarHBondContact O-CB 3.34Å; G216-S219 PolarHBondContact O-N 3.2Å; G216-S219 VanDerWaalsContact O-N 3.09Å; G216-S219 PolarHBondContact O-OG 2.84Å; S219-P221 WeakPolarHBondContact O-CD 3.41Å; S219-H253 PolarHBondContact O-CE1 3.49Å; S219-H253 PolarHBondContact O-NE2 3.05Å; S219-H253 PolarHBondContact OG-NE2 3.22Å
220	V	97.8	Very high	96	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.012	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	106.4	-169.9	-177.3	0	0	0	0	110.4	I211 L212 V222 E334 Q337	I211-V220 CarbonylContact C-O 3.58Å; I211-V220 WeakPolarHBondContact CA-O 3.27Å; L212-V220 HydrophobicContact CB-CB 4.5Å; L212-V220 PolarHBondContact N-O 3.4Å; L212-V220 PolarHBondContact O-N 3.18Å; V220-V222 PolarHBondContact O-N 3.11Å; V220-E334 HydrophobicContact CG1-CB 4.46Å; V220-Q337 HydrophobicContact CG1-CB 4.08Å; V220-Q337 HydrophobicContact CG2-CB 3.8Å
221	P	97.3	Very high	96	Very high	7 Å²	7	29.5 Å²	29.5	5%	0.045	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	118.9	172.6	31.6	-33	0	0	0	110.4	I211 S219 W223 H253	I211-P221 HydrophobicContact CD1-CB 3.66Å; S219-P221 WeakPolarHBondContact O-CD 3.41Å; P221-W223 VanDerWaalsContact C-N 3.35Å; P221-W223 HydrophobicContact CB-CZ2 4.26Å; P221-W223 PolarHBondContact O-N 2.84Å; P221-H253 HydrophobicContact CB-CB 4.09Å; P221-H253 HydrophobicContact CG-CB 4.05Å
222	V	97.8	Very high	96	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	21%	0.21	C	C	.	.			trans	-86	78.3	179.9	-172.7	0	0	0	0	109.8	W210 L212 V220 S224 G225 M328 L330 E334	W210-V222 HydrophobicContact CB-CB 4.42Å; W210-V222 HydrophobicContact CB-CG2 4.41Å; W210-V222 PolarHBondContact O-N 3.16Å; L212-V222 HydrophobicContact CB-CG2 4.45Å; L212-V222 HydrophobicContact CD1-CG2 3.6Å; L212-V222 HydrophobicContact CG-CG2 3.72Å; V220-V222 PolarHBondContact O-N 3.11Å; V222-S224 WeakPolarHBondContact CG1-OG 3.42Å; V222-S224 PolarHBondContact O-N 2.86Å; V222-G225 PolarHBondContact O-N 3.07Å; V222-G225 VanDerWaalsContact O-N 3.13Å; V222-M328 HydrophobicContact CB-CE 4.43Å; V222-M328 HydrophobicContact CG1-CE 3.78Å; V222-L330 HydrophobicContact CB-CD2 4.42Å; V222-L330 HydrophobicContact CG1-CD2 3.58Å; V222-L330 HydrophobicContact CG2-CD2 3.87Å; V222-E334 WeakPolarHBondContact CA-OE1 3.27Å
223	W	97.1	Very high	95.9	Very high	23 Å²	23	32.4 Å²	32.4	9%	0.087	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-58.9	-36.9	179.6	-66.9	109.6	0	0	0	111.9	F192 M196 P221 G225 T226 I240 G241 W249 H253 E334	F192-W223 AromaticContact CE2-CH2 3.64Å; F192-W223 HydrophobicContact CE2-CH2 3.64Å; F192-W223 HydrophobicContact CE2-CZ2 4.18Å; F192-W223 HydrophobicContact CE2-CZ3 4.07Å; F192-W223 HydrophobicContact CZ-CE3 4.22Å; F192-W223 AromaticContact CZ-CH2 3.73Å; F192-W223 HydrophobicContact CZ-CH2 3.73Å; F192-W223 HydrophobicContact CZ-CZ2 4.33Å; F192-W223 AromaticContact CZ-CZ3 3.68Å; F192-W223 HydrophobicContact CZ-CZ3 3.68Å; M196-W223 HydrophobicContact CE-CZ3 3.83Å; M196-W223 HydrophobicContact SD-CH2 4.32Å; M196-W223 HydrophobicContact SD-CZ3 4.13Å; P221-W223 VanDerWaalsContact C-N 3.35Å; P221-W223 HydrophobicContact CB-CZ2 4.26Å; P221-W223 PolarHBondContact O-N 2.84Å; W223-G225 PolarHBondContact O-N 3.2Å; W223-G225 VanDerWaalsContact O-N 3.13Å; W223-T226 HydrophobicContact CE3-CG2 4.19Å; W223-T226 PolarHBondContact O-N 2.8Å; W223-T226 PolarHBondContact O-OG1 3.47Å; W223-I240 HydrophobicContact CE3-CD1 4.35Å; W223-I240 HydrophobicContact CE3-CG1 4.11Å; W223-I240 HydrophobicContact CZ3-CD1 4.39Å; W223-I240 HydrophobicContact CZ3-CG1 4.25Å; W223-G241 VanDerWaalsContact CE2-CA 3.49Å; W223-W249 HydrophobicContact CH2-CB 4.1Å; W223-W249 VanDerWaalsContact CH2-O 3.23Å; W223-W249 WeakPolarHBondContact CH2-O 3.37Å; W223-W249 HydrophobicContact CZ3-CB 4.05Å; W223-H253 HydrophobicContact CZ2-CB 4.2Å; W223-E334 PolarHBondContact N-OE1 2.83Å; W223-E334 VanDerWaalsContact N-OE1 3.12Å
224	S	96.4	Very high	95.8	Very high	26 Å²	26	35.3 Å²	35.3	18%	0.182	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-60.5	-23.1	178	69.8	0	0	0	0	113.7	V222 N232 Q234 E334	V222-S224 WeakPolarHBondContact CG1-OG 3.42Å; V222-S224 PolarHBondContact O-N 2.86Å; S224-N232 PolarHBondContact O-ND2 3.29Å; S224-Q234 VanDerWaalsContact CA-OE1 3.24Å; S224-E334 WeakPolarHBondContact CB-OE1 3.42Å; S224-E334 PolarHBondContact N-OE1 3.26Å; S224-E334 VanDerWaalsContact N-OE1 3.09Å; S224-E334 VanDerWaalsContact OG-CD 3.25Å; S224-E334 PolarHBondContact OG-OE1 3Å; S224-E334 PolarHBondContact OG-OE2 3.2Å
225	G	95.6	Very high	95.7	Very high	19 Å²	19	40.4 Å²	40.4	20%	0.196	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-98.7	-5	178.9	0	0	0	0	0	114.9	V222 W223 N227	V222-G225 PolarHBondContact O-N 3.07Å; V222-G225 VanDerWaalsContact O-N 3.13Å; W223-G225 PolarHBondContact O-N 3.2Å; W223-G225 VanDerWaalsContact O-N 3.13Å; G225-N227 PolarHBondContact O-N 3.47Å; G225-N227 PolarHBondContact O-ND2 3.24Å
226	T	97	Very high	95.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	28%	0.282	C	S	.	.			trans	-70.2	128.5	-175.6	58.6	0	0	0	0	112	F192 F207 N208 W223 N232 L233	F192-T226 HydrophobicContact CE1-CG2 3.83Å; F192-T226 HydrophobicContact CZ-CG2 4.08Å; F207-T226 HydrophobicContact CZ-CG2 4.22Å; N208-T226 WeakPolarHBondContact O-CA 3.46Å; W223-T226 HydrophobicContact CE3-CG2 4.19Å; W223-T226 PolarHBondContact O-N 2.8Å; W223-T226 PolarHBondContact O-OG1 3.47Å; T226-N232 WeakPolarHBondContact O-CA 3.37Å; T226-L233 PolarHBondContact O-N 3.01Å
227	N	98.3	Very high	96.2	Very high	34 Å²	34	45 Å²	45	18%	0.182	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	156.7	-178	70	89.2	0	0	0	114.1	N208 G225 G230 V231	N208-N227 WeakPolarHBondContact CB-ND2 3.44Å; N208-N227 PolarHBondContact N-O 2.97Å; N208-N227 PolarHBondContact ND2-OD1 2.83Å; N208-N227 PolarHBondContact O-N 3.46Å; G225-N227 PolarHBondContact O-N 3.47Å; G225-N227 PolarHBondContact O-ND2 3.24Å; N227-G230 PolarHBondContact OD1-N 2.87Å; N227-V231 WeakPolarHBondContact CA-O 3.41Å; N227-V231 VanDerWaalsContact CB-O 3.27Å; N227-V231 WeakPolarHBondContact CB-O 3.47Å
228	V	98.5	Very high	96.6	Very high	41 Å²	41	44.1 Å²	44.1	25%	0.248	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.8	165.8	177.2	0	0	0	0	108.1	L200 I202 F207 G230 V231 L233	L200-V228 HydrophobicContact CD1-CG2 3.89Å; I202-V228 HydrophobicContact CD1-CB 4.44Å; I202-V228 HydrophobicContact CD1-CG1 3.82Å; I202-V228 HydrophobicContact CD1-CG2 3.68Å; F207-V228 HydrophobicContact CD2-CG2 3.6Å; F207-V228 HydrophobicContact CE2-CG2 4.22Å; V228-G230 PolarHBondContact O-N 3.32Å; V228-V231 PolarHBondContact N-O 2.96Å; V228-V231 VanDerWaalsContact N-O 3.1Å; V228-V231 WeakPolarHBondContact O-CB 3.44Å; V228-V231 PolarHBondContact O-N 2.86Å; V228-L233 HydrophobicContact CG2-CD1 4.39Å
229	A	97.3	Very high	96.8	Very high	97 Å²	97	45.1 Å²	45.1	80%	0.802	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	31.8	-177.2	0	0	0	0	0	114.1	V231	A229-V231 VanDerWaalsContact C-N 3.3Å; A229-V231 PolarHBondContact O-N 2.89Å
230	G	96.8	Very high	96.8	Very high	58 Å²	58	45 Å²	45	60%	0.598	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-6.1	-177.4	0	0	0	0	0	115.2	N227 V228 N232	N227-G230 PolarHBondContact OD1-N 2.87Å; V228-G230 PolarHBondContact O-N 3.32Å; G230-N232 PolarHBondContact O-N 3.3Å
231	V	98.2	Very high	96.5	Very high	81 Å²	81	45.7 Å²	45.7	49%	0.491	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	111.4	172.3	-175.6	0	0	0	0	108.7	N227 V228 A229 L236	N227-V231 WeakPolarHBondContact CA-O 3.41Å; N227-V231 VanDerWaalsContact CB-O 3.27Å; N227-V231 WeakPolarHBondContact CB-O 3.47Å; V228-V231 PolarHBondContact N-O 2.96Å; V228-V231 VanDerWaalsContact N-O 3.1Å; V228-V231 WeakPolarHBondContact O-CB 3.44Å; V228-V231 PolarHBondContact O-N 2.86Å; A229-V231 VanDerWaalsContact C-N 3.3Å; A229-V231 PolarHBondContact O-N 2.89Å; V231-L236 HydrophobicContact CG1-CD1 3.97Å; V231-L236 HydrophobicContact CG1-CD2 4.49Å; V231-L236 HydrophobicContact CG1-CG 4.34Å
232	N	97.4	Very high	96.4	Very high	41 Å²	41	47.5 Å²	47.5	22%	0.219	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	129.4	-179.4	-179.6	-79.7	0	0	0	111	S224 T226 G230 Q234 T235	S224-N232 PolarHBondContact O-ND2 3.29Å; T226-N232 WeakPolarHBondContact O-CA 3.37Å; G230-N232 PolarHBondContact O-N 3.3Å; N232-Q234 WeakPolarHBondContact OD1-CA 3.27Å; N232-Q234 VanDerWaalsContact OD1-CB 3.3Å; N232-Q234 WeakPolarHBondContact OD1-CB 3.4Å; N232-Q234 PolarHBondContact OD1-N 2.95Å; N232-T235 PolarHBondContact O-N 3.5Å; N232-T235 PolarHBondContact OD1-N 3.19Å; N232-T235 PolarHBondContact OD1-OG1 2.92Å
233	L	96.6	Very high	96.1	Very high	19 Å²	19	53.7 Å²	53.7	10%	0.099	34%	0.335	C	S	.	.	H	α-helix	trans	-70.6	-34.7	-176.5	-87.9	64.4	0	0	0	112.4	M196 F207 T226 V228 T235 L236 N237 I240	M196-L233 HydrophobicContact CE-CD2 3.87Å; F207-L233 HydrophobicContact CE2-CD1 4.34Å; F207-L233 HydrophobicContact CE2-CD2 3.82Å; F207-L233 HydrophobicContact CZ-CD2 4.3Å; T226-L233 PolarHBondContact O-N 3.01Å; V228-L233 HydrophobicContact CG2-CD1 4.39Å; L233-T235 PolarHBondContact O-N 3.49Å; L233-L236 WeakPolarHBondContact O-CB 3.46Å; L233-L236 PolarHBondContact O-N 3.49Å; L233-N237 PolarHBondContact O-N 3.33Å; L233-I240 HydrophobicContact CB-CD1 3.75Å; L233-I240 HydrophobicContact CD2-CD1 3.84Å; L233-I240 HydrophobicContact CG-CD1 4.34Å
234	Q	95.1	Very high	96	Very high	61 Å²	61	60.2 Å²	60.2	29%	0.285	36%	0.364	S	S	.	.	H	α-helix	trans	-67.7	-21.7	177.7	-165.2	171.8	18.1	0	0	112.7	S224 N232 L236 N237 P238 I240	S224-Q234 VanDerWaalsContact CA-OE1 3.24Å; N232-Q234 WeakPolarHBondContact OD1-CA 3.27Å; N232-Q234 VanDerWaalsContact OD1-CB 3.3Å; N232-Q234 WeakPolarHBondContact OD1-CB 3.4Å; N232-Q234 PolarHBondContact OD1-N 2.95Å; Q234-L236 VanDerWaalsContact C-N 3.32Å; Q234-N237 WeakPolarHBondContact CA-O 3.5Å; Q234-N237 CarbonylContact O-C 3.32Å; Q234-P238 WeakPolarHBondContact O-CA 3.47Å; Q234-I240 HydrophobicContact CB-CG2 3.76Å; Q234-I240 HydrophobicContact CG-CG2 3.96Å
235	T	95.9	Very high	95.9	Very high	111 Å²	111	59.5 Å²	59.5	68%	0.681	36%	0.358	S	S	*	.	H	α-helix	trans	-71.9	-28	170.6	-54.4	0	0	0	0	112.2	N232 L233	N232-T235 PolarHBondContact O-N 3.5Å; N232-T235 PolarHBondContact OD1-N 3.19Å; N232-T235 PolarHBondContact OD1-OG1 2.92Å; L233-T235 PolarHBondContact O-N 3.49Å
236	L	96.6	Very high	95.8	Very high	128 Å²	128	68 Å²	68	67%	0.67	39%	0.393	S	S	*	.	H	α-helix	trans	-87.5	-40.8	178.2	-57.5	178.8	0	0	0	111.8	V231 L233 Q234	V231-L236 HydrophobicContact CG1-CD1 3.97Å; V231-L236 HydrophobicContact CG1-CD2 4.49Å; V231-L236 HydrophobicContact CG1-CG 4.34Å; L233-L236 WeakPolarHBondContact O-CB 3.46Å; L233-L236 PolarHBondContact O-N 3.49Å; Q234-L236 VanDerWaalsContact C-N 3.32Å
237	N	96.6	Very high	95.7	Very high	32 Å²	32	74 Å²	74	17%	0.171	42%	0.421	C	S	.	.			trans	-126.8	93.5	174.4	176.4	3.8	0	0	0	108.8	L233 Q234 N239 I240 D245	L233-N237 PolarHBondContact O-N 3.33Å; Q234-N237 WeakPolarHBondContact CA-O 3.5Å; Q234-N237 CarbonylContact O-C 3.32Å; N237-N239 PolarHBondContact O-N 3.29Å; N237-N239 VanDerWaalsContact O-N 3.11Å; N237-N239 PolarHBondContact OD1-N 3.25Å; N237-N239 VanDerWaalsContact OD1-N 3.13Å; N237-I240 HydrophobicContact CB-CB 4.17Å; N237-I240 VanDerWaalsContact O-CB 3.27Å; N237-I240 WeakPolarHBondContact O-CB 3.19Å; N237-I240 VanDerWaalsContact O-CG2 3.27Å; N237-I240 WeakPolarHBondContact O-CG2 3.41Å; N237-I240 PolarHBondContact O-N 2.89Å; N237-I240 PolarHBondContact OD1-N 3.19Å; N237-D245 PolarHBondContact ND2-OD1 3.16Å
238	P	95.6	Very high	95.5	Very high	88 Å²	88	75 Å²	75	57%	0.571	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-23.9	179.9	-27.5	36.5	0	0	0	114.6	Q234	Q234-P238 WeakPolarHBondContact O-CA 3.47Å
239	N	95.9	Very high	95.3	Very high	75 Å²	75	73.9 Å²	73.9	40%	0.401	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-1	179.1	-64	-21.9	0	0	0	112.6	N237 G241 T242 F244 D245	N237-N239 PolarHBondContact O-N 3.29Å; N237-N239 VanDerWaalsContact O-N 3.11Å; N237-N239 PolarHBondContact OD1-N 3.25Å; N237-N239 VanDerWaalsContact OD1-N 3.13Å; N239-G241 PolarHBondContact O-N 3.46Å; N239-T242 VanDerWaalsContact O-CB 3.31Å; N239-T242 WeakPolarHBondContact O-CB 3.45Å; N239-T242 WeakPolarHBondContact O-CG2 3.3Å; N239-T242 PolarHBondContact O-N 3.07Å; N239-T242 PolarHBondContact O-OG1 3.21Å; N239-F244 HydrophobicContact CB-CB 4.26Å; N239-F244 PolarHBondContact ND2-O 2.8Å; N239-D245 WeakPolarHBondContact O-CB 3.22Å
240	I	94.9	Very high	95.1	Very high	3 Å²	3	72.6 Å²	72.6	2%	0.015	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	132.5	-176.1	-162.8	172.9	0	0	0	111.3	W223 L233 Q234 N237 T242 W249	W223-I240 HydrophobicContact CE3-CD1 4.35Å; W223-I240 HydrophobicContact CE3-CG1 4.11Å; W223-I240 HydrophobicContact CZ3-CD1 4.39Å; W223-I240 HydrophobicContact CZ3-CG1 4.25Å; L233-I240 HydrophobicContact CB-CD1 3.75Å; L233-I240 HydrophobicContact CD2-CD1 3.84Å; L233-I240 HydrophobicContact CG-CD1 4.34Å; Q234-I240 HydrophobicContact CB-CG2 3.76Å; Q234-I240 HydrophobicContact CG-CG2 3.96Å; N237-I240 HydrophobicContact CB-CB 4.17Å; N237-I240 VanDerWaalsContact O-CB 3.27Å; N237-I240 WeakPolarHBondContact O-CB 3.19Å; N237-I240 VanDerWaalsContact O-CG2 3.27Å; N237-I240 WeakPolarHBondContact O-CG2 3.41Å; N237-I240 PolarHBondContact O-N 2.89Å; N237-I240 PolarHBondContact OD1-N 3.19Å; I240-T242 PolarHBondContact O-N 2.63Å; I240-W249 HydrophobicContact CD1-CB 4.14Å; I240-W249 HydrophobicContact CD1-CD2 4.17Å; I240-W249 HydrophobicContact CD1-CG 3.82Å; I240-W249 HydrophobicContact CG1-CB 3.61Å; I240-W249 HydrophobicContact CG1-CG 3.67Å
241	G	92.1	Very high	94.9	Very high	16 Å²	16	74.3 Å²	74.3	17%	0.165	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.1	-2.3	-179.2	0	0	0	0	0	115.1	W223 N239 D245	W223-G241 VanDerWaalsContact CE2-CA 3.49Å; N239-G241 PolarHBondContact O-N 3.46Å; G241-D245 PolarHBondContact N-OD2 2.6Å
242	T	93.8	Very high	94.7	Very high	44 Å²	44	70.5 Å²	70.5	27%	0.27	36%	0.363	S	S	.	.	S	Bend	trans	-100	172.2	175.9	78.5	0	0	0	0	112.1	N239 I240 F244 D245	N239-T242 VanDerWaalsContact O-CB 3.31Å; N239-T242 WeakPolarHBondContact O-CB 3.45Å; N239-T242 WeakPolarHBondContact O-CG2 3.3Å; N239-T242 PolarHBondContact O-N 3.07Å; N239-T242 PolarHBondContact O-OG1 3.21Å; I240-T242 PolarHBondContact O-N 2.63Å; T242-F244 PolarHBondContact O-N 3.01Å; T242-F244 PolarHBondContact OG1-N 3.06Å; T242-D245 VanDerWaalsContact O-CB 3.31Å; T242-D245 WeakPolarHBondContact O-CB 3.34Å; T242-D245 PolarHBondContact O-N 3.45Å
243	D	92.9	Very high	94.5	Very high	130 Å²	130	70.1 Å²	70.1	70%	0.695	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-16.6	174.2	-70.7	-21.4	0	0	0	114.3	D245 K250	D243-D245 VanDerWaalsContact C-N 3.34Å; D243-K250 IonicContact OD1-NZ 2.68Å; D243-K250 PolarHBondContact OD1-NZ 3.47Å
244	F	94.3	Very high	94.3	Very high	161 Å²	161	75 Å²	75	71%	0.706	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	6.8	179.7	-54.3	-73.7	0	0	0	113.2	N239 T242 E246	N239-F244 HydrophobicContact CB-CB 4.26Å; N239-F244 PolarHBondContact ND2-O 2.8Å; T242-F244 PolarHBondContact O-N 3.01Å; T242-F244 PolarHBondContact OG1-N 3.06Å; F244-E246 PolarHBondContact O-N 2.89Å
245	D	94.6	Very high	94.2	Very high	11 Å²	11	75.9 Å²	75.9	6%	0.059	39%	0.386	C	S	.	.			trans	-77	108.1	177.7	-170.8	2.5	0	0	0	111.6	N237 N239 G241 T242 D243 E247 N248 W249	N237-D245 PolarHBondContact ND2-OD1 3.16Å; N239-D245 WeakPolarHBondContact O-CB 3.22Å; G241-D245 PolarHBondContact N-OD2 2.6Å; T242-D245 VanDerWaalsContact O-CB 3.31Å; T242-D245 WeakPolarHBondContact O-CB 3.34Å; T242-D245 PolarHBondContact O-N 3.45Å; D243-D245 VanDerWaalsContact C-N 3.34Å; D245-E247 PolarHBondContact O-N 2.83Å; D245-E247 PolarHBondContact OD1-N 3.28Å; D245-E247 VanDerWaalsContact OD1-N 3.16Å; D245-N248 PolarHBondContact O-N 2.89Å; D245-W249 WeakPolarHBondContact OD2-CB 3.32Å; D245-W249 VanDerWaalsContact OD2-CD1 3.23Å; D245-W249 PolarHBondContact OD2-N 3.19Å
246	E	94.1	Very high	94	Very high	198 Å²	198	70.7 Å²	70.7	93%	0.925	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-25.8	179	-63.7	-174.2	177	0	0	112.8	F244 N248	F244-E246 PolarHBondContact O-N 2.89Å; E246-N248 VanDerWaalsContact C-N 3.33Å
247	E	94.6	Very high	93.7	Very high	124 Å²	124	65.6 Å²	65.6	58%	0.579	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-4.4	176.8	-66.6	-179.6	-144.3	0	0	112.8	D245 W249	D245-E247 PolarHBondContact O-N 2.83Å; D245-E247 PolarHBondContact OD1-N 3.28Å; D245-E247 VanDerWaalsContact OD1-N 3.16Å; E247-W249 VanDerWaalsContact C-N 3.33Å; E247-W249 VanDerWaalsContact CB-CD1 3.5Å; E247-W249 PolarHBondContact O-N 3.44Å; E247-W249 PolarHBondContact OE2-NE1 2.9Å
248	N	93.6	Very high	93.4	Very high	55 Å²	55	66.9 Å²	66.9	29%	0.294	33%	0.334	S	S	.	.			trans	52.3	43.2	176.7	-163.8	34.1	0	0	0	113.7	D245 E246 K250 E251	D245-N248 PolarHBondContact O-N 2.89Å; E246-N248 VanDerWaalsContact C-N 3.33Å; N248-K250 PolarHBondContact O-N 2.78Å; N248-K250 WeakPolarHBondContact OD1-CE 3.43Å; N248-K250 WeakPolarHBondContact OD1-CG 3.32Å; N248-E251 WeakPolarHBondContact ND2-CB 3.28Å; N248-E251 PolarHBondContact ND2-OE2 2.62Å; N248-E251 VanDerWaalsContact O-CB 3.27Å; N248-E251 WeakPolarHBondContact O-CB 3.3Å; N248-E251 PolarHBondContact O-N 2.92Å
249	W	94	Very high	93	Very high	18 Å²	18	63.9 Å²	63.9	7%	0.068	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-27.5	179.7	-71.7	91.5	0	0	0	112.8	M196 K199 L200 W223 I240 D245 E247 E251 T252	M196-W249 HydrophobicContact CE-CD2 4.17Å; M196-W249 HydrophobicContact CE-CE3 3.28Å; M196-W249 HydrophobicContact CE-CH2 4.48Å; M196-W249 HydrophobicContact CE-CZ3 3.45Å; M196-W249 VanDerWaalsContact CE-CZ3 3.45Å; M196-W249 HydrophobicContact SD-CE3 3.41Å; M196-W249 HydrophobicContact SD-CZ3 3.64Å; K199-W249 HydrophobicContact CB-CH2 3.71Å; K199-W249 HydrophobicContact CB-CZ3 3.75Å; K199-W249 HydrophobicContact CD-CE3 3.81Å; K199-W249 HydrophobicContact CD-CH2 4.02Å; K199-W249 HydrophobicContact CD-CZ3 3.5Å; K199-W249 VanDerWaalsContact CD-CZ3 3.5Å; K199-W249 HydrophobicContact CG-CZ3 4.25Å; L200-W249 HydrophobicContact CD2-CH2 3.79Å; L200-W249 HydrophobicContact CD2-CZ2 4.24Å; L200-W249 HydrophobicContact CG-CH2 3.96Å; W223-W249 HydrophobicContact CH2-CB 4.1Å; W223-W249 VanDerWaalsContact CH2-O 3.23Å; W223-W249 WeakPolarHBondContact CH2-O 3.37Å; W223-W249 HydrophobicContact CZ3-CB 4.05Å; I240-W249 HydrophobicContact CD1-CB 4.14Å; I240-W249 HydrophobicContact CD1-CD2 4.17Å; I240-W249 HydrophobicContact CD1-CG 3.82Å; I240-W249 HydrophobicContact CG1-CB 3.61Å; I240-W249 HydrophobicContact CG1-CG 3.67Å; D245-W249 WeakPolarHBondContact OD2-CB 3.32Å; D245-W249 VanDerWaalsContact OD2-CD1 3.23Å; D245-W249 PolarHBondContact OD2-N 3.19Å; E247-W249 VanDerWaalsContact C-N 3.33Å; E247-W249 VanDerWaalsContact CB-CD1 3.5Å; E247-W249 PolarHBondContact O-N 3.44Å; E247-W249 PolarHBondContact OE2-NE1 2.9Å; W249-E251 PolarHBondContact O-N 3.49Å; W249-E251 VanDerWaalsContact O-N 3.1Å; W249-T252 VanDerWaalsContact O-CB 3.23Å; W249-T252 WeakPolarHBondContact O-CB 3.14Å; W249-T252 PolarHBondContact O-N 3.2Å; W249-T252 PolarHBondContact O-OG1 2.94Å
250	K	92.9	Very high	92.2	Very high	70 Å²	70	61.4 Å²	61.4	30%	0.304	31%	0.306	S	S	.	.	H	α-helix	trans	-54	-29.6	173.8	73.3	-179.9	-174	-170.4	0	113.2	D243 N248 T252 H253 K254	D243-K250 IonicContact OD1-NZ 2.68Å; D243-K250 PolarHBondContact OD1-NZ 3.47Å; N248-K250 PolarHBondContact O-N 2.78Å; N248-K250 WeakPolarHBondContact OD1-CE 3.43Å; N248-K250 WeakPolarHBondContact OD1-CG 3.32Å; K250-T252 PolarHBondContact O-N 2.71Å; K250-H253 PolarHBondContact O-N 3.14Å; K250-H253 VanDerWaalsContact O-N 3.1Å; K250-K254 PolarHBondContact O-N 3.14Å
251	E	93.8	Very high	91.8	Very high	95 Å²	95	67.3 Å²	67.3	44%	0.444	33%	0.329	S	S	.	.	H	α-helix	trans	-60.6	-29.7	176.3	-176.1	172	-158.7	0	0	111.9	N248 W249 H253 K254 M255	N248-E251 WeakPolarHBondContact ND2-CB 3.28Å; N248-E251 PolarHBondContact ND2-OE2 2.62Å; N248-E251 VanDerWaalsContact O-CB 3.27Å; N248-E251 WeakPolarHBondContact O-CB 3.3Å; N248-E251 PolarHBondContact O-N 2.92Å; W249-E251 PolarHBondContact O-N 3.49Å; W249-E251 VanDerWaalsContact O-N 3.1Å; E251-H253 VanDerWaalsContact C-N 3.32Å; E251-H253 PolarHBondContact O-N 2.74Å; E251-K254 WeakPolarHBondContact O-CB 3.45Å; E251-K254 PolarHBondContact O-N 3.37Å; E251-M255 HydrophobicContact CG-CG 4.39Å; E251-M255 HydrophobicContact CG-SD 4.49Å; E251-M255 WeakPolarHBondContact O-CG 3.38Å; E251-M255 PolarHBondContact O-N 2.79Å
252	T	92.9	Very high	91.7	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62.6	-38.2	176.4	-62.1	0	0	0	0	111.8	F192 L195 M196 K199 W249 K250 M255 V256	F192-T252 HydrophobicContact CD2-CG2 3.96Å; F192-T252 HydrophobicContact CE2-CG2 4.05Å; L195-T252 HydrophobicContact CB-CG2 3.47Å; L195-T252 VanDerWaalsContact CB-CG2 3.47Å; L195-T252 HydrophobicContact CD1-CG2 4.06Å; L195-T252 HydrophobicContact CG-CG2 4.43Å; M196-T252 HydrophobicContact CG-CG2 3.96Å; M196-T252 HydrophobicContact SD-CG2 3.63Å; K199-T252 WeakPolarHBondContact CE-OG1 3.33Å; K199-T252 PolarHBondContact NZ-OG1 2.96Å; W249-T252 VanDerWaalsContact O-CB 3.23Å; W249-T252 WeakPolarHBondContact O-CB 3.14Å; W249-T252 PolarHBondContact O-N 3.2Å; W249-T252 PolarHBondContact O-OG1 2.94Å; K250-T252 PolarHBondContact O-N 2.71Å; T252-M255 PolarHBondContact O-N 2.68Å; T252-V256 WeakPolarHBondContact O-CG2 3.41Å; T252-V256 PolarHBondContact O-N 3.19Å
253	H	93	Very high	91.6	Very high	33 Å²	33	73 Å²	73	15%	0.153	35%	0.352	C	S	.	.	H	α-helix	trans	-67	-42.4	173.8	172.9	-120.1	0	0	0	111.5	S219 P221 W223 K250 E251 M255 V256 V257	S219-H253 PolarHBondContact O-CE1 3.49Å; S219-H253 PolarHBondContact O-NE2 3.05Å; S219-H253 PolarHBondContact OG-NE2 3.22Å; P221-H253 HydrophobicContact CB-CB 4.09Å; P221-H253 HydrophobicContact CG-CB 4.05Å; W223-H253 HydrophobicContact CZ2-CB 4.2Å; K250-H253 PolarHBondContact O-N 3.14Å; K250-H253 VanDerWaalsContact O-N 3.1Å; E251-H253 VanDerWaalsContact C-N 3.32Å; E251-H253 PolarHBondContact O-N 2.74Å; H253-M255 VanDerWaalsContact C-N 3.31Å; H253-M255 PolarHBondContact O-N 2.89Å; H253-V256 WeakPolarHBondContact O-CB 3.43Å; H253-V256 PolarHBondContact O-N 3.13Å; H253-V257 PolarHBondContact O-N 3.11Å; H253-V257 VanDerWaalsContact O-N 3.14Å
254	K	92.4	Very high	91.3	Very high	122 Å²	122	70.4 Å²	70.4	53%	0.53	34%	0.337	S	S	.	.	H	α-helix	trans	-56.9	-44.7	173.5	178	167.1	175.3	46.3	0	111.9	K250 E251 V256 V257 D258	K250-K254 PolarHBondContact O-N 3.14Å; E251-K254 WeakPolarHBondContact O-CB 3.45Å; E251-K254 PolarHBondContact O-N 3.37Å; K254-V256 VanDerWaalsContact C-N 3.3Å; K254-V256 PolarHBondContact O-N 2.69Å; K254-V257 PolarHBondContact O-N 2.63Å; K254-D258 WeakPolarHBondContact CE-OD2 3.35Å; K254-D258 VanDerWaalsContact CG-OD2 3.3Å; K254-D258 WeakPolarHBondContact CG-OD2 3.33Å; K254-D258 IonicContact NZ-OD1 2.71Å; K254-D258 IonicContact NZ-OD2 3.37Å; K254-D258 PolarHBondContact NZ-OD2 3.36Å; K254-D258 VanDerWaalsContact O-CB 3.31Å; K254-D258 WeakPolarHBondContact O-CB 3.36Å; K254-D258 VanDerWaalsContact O-CG 3.26Å; K254-D258 PolarHBondContact O-N 3.19Å
255	M	93.3	Very high	91.2	Very high	80 Å²	80	71.6 Å²	71.6	39%	0.394	34%	0.342	S	S	.	.	H	α-helix	trans	-61.3	-35.6	174.8	-70.3	175	73	0	0	112.5	L195 E251 T252 H253 D258 S259	L195-M255 HydrophobicContact CD1-CB 3.73Å; L195-M255 HydrophobicContact CD1-CE 4.49Å; L195-M255 HydrophobicContact CD2-CE 3.86Å; E251-M255 HydrophobicContact CG-CG 4.39Å; E251-M255 HydrophobicContact CG-SD 4.49Å; E251-M255 WeakPolarHBondContact O-CG 3.38Å; E251-M255 PolarHBondContact O-N 2.79Å; T252-M255 PolarHBondContact O-N 2.68Å; H253-M255 VanDerWaalsContact C-N 3.31Å; H253-M255 PolarHBondContact O-N 2.89Å; M255-D258 PolarHBondContact O-N 3.22Å; M255-S259 WeakPolarHBondContact O-CA 3.45Å; M255-S259 VanDerWaalsContact O-CB 3.27Å; M255-S259 WeakPolarHBondContact O-CB 3.2Å; M255-S259 PolarHBondContact O-N 3.01Å; M255-S259 PolarHBondContact O-OG 2.89Å
256	V	92.9	Very high	91.2	Very high	1 Å²	1	77.7 Å²	77.7	1%	0.006	37%	0.374	C	S	.	.	H	α-helix	trans	-62.5	-48.4	176.3	170.1	0	0	0	0	111.1	D188 R191 F192 L195 T252 H253 K254 S259	D188-V256 HydrophobicContact CB-CG1 3.75Å; D188-V256 WeakPolarHBondContact O-CG1 3.46Å; R191-V256 HydrophobicContact CB-CG1 4.14Å; R191-V256 HydrophobicContact CB-CG2 4.11Å; F192-V256 VanDerWaalsContact CA-CG2 3.5Å; F192-V256 HydrophobicContact CB-CG2 3.82Å; F192-V256 HydrophobicContact CD2-CG2 4.14Å; L195-V256 HydrophobicContact CD1-CG2 3.85Å; T252-V256 WeakPolarHBondContact O-CG2 3.41Å; T252-V256 PolarHBondContact O-N 3.19Å; H253-V256 WeakPolarHBondContact O-CB 3.43Å; H253-V256 PolarHBondContact O-N 3.13Å; K254-V256 VanDerWaalsContact C-N 3.3Å; K254-V256 PolarHBondContact O-N 2.69Å; V256-S259 WeakPolarHBondContact O-CB 3.34Å; V256-S259 PolarHBondContact O-N 2.79Å
257	V	89.8	Confident	91.2	Very high	21 Å²	21	72 Å²	72	13%	0.127	35%	0.346	C	S	.	.	H	α-helix	trans	-61.6	-48.3	176.5	176.2	0	0	0	0	109.9	D217 H253 K254 S259 Y261	D217-V257 HydrophobicContact CB-CG1 4.49Å; D217-V257 WeakPolarHBondContact OD1-CG1 3.46Å; H253-V257 PolarHBondContact O-N 3.11Å; H253-V257 VanDerWaalsContact O-N 3.14Å; K254-V257 PolarHBondContact O-N 2.63Å; V257-S259 VanDerWaalsContact C-N 3.29Å; V257-S259 PolarHBondContact O-N 2.88Å; V257-Y261 HydrophobicContact CG1-CE2 4.37Å
258	D	90.6	Very high	91	Very high	59 Å²	59	67.9 Å²	67.9	32%	0.316	34%	0.337	S	S	.	.	H	α-helix	trans	-69.4	-24.4	-177	-68.8	-19.8	0	0	0	113.1	K254 M255 A260 Y261 E262	K254-D258 WeakPolarHBondContact CE-OD2 3.35Å; K254-D258 VanDerWaalsContact CG-OD2 3.3Å; K254-D258 WeakPolarHBondContact CG-OD2 3.33Å; K254-D258 IonicContact NZ-OD1 2.71Å; K254-D258 IonicContact NZ-OD2 3.37Å; K254-D258 PolarHBondContact NZ-OD2 3.36Å; K254-D258 VanDerWaalsContact O-CB 3.31Å; K254-D258 WeakPolarHBondContact O-CB 3.36Å; K254-D258 VanDerWaalsContact O-CG 3.26Å; K254-D258 PolarHBondContact O-N 3.19Å; M255-D258 PolarHBondContact O-N 3.22Å; D258-A260 VanDerWaalsContact C-N 3.27Å; D258-A260 PolarHBondContact O-N 3.45Å; D258-Y261 PolarHBondContact O-N 2.96Å; D258-Y261 VanDerWaalsContact O-N 3.07Å; D258-E262 PolarHBondContact O-N 2.88Å
259	S	86.3	Confident	90.8	Very high	25 Å²	25	68.9 Å²	68.9	18%	0.175	34%	0.337	C	S	.	.	H	α-helix	trans	-57	-37.7	-177.4	-74	0	0	0	0	113	M255 V256 V257 V263	M255-S259 WeakPolarHBondContact O-CA 3.45Å; M255-S259 VanDerWaalsContact O-CB 3.27Å; M255-S259 WeakPolarHBondContact O-CB 3.2Å; M255-S259 PolarHBondContact O-N 3.01Å; M255-S259 PolarHBondContact O-OG 2.89Å; V256-S259 WeakPolarHBondContact O-CB 3.34Å; V256-S259 PolarHBondContact O-N 2.79Å; V257-S259 VanDerWaalsContact C-N 3.29Å; V257-S259 PolarHBondContact O-N 2.88Å; S259-V263 WeakPolarHBondContact O-CB 3.46Å; S259-V263 VanDerWaalsContact O-CG2 3.22Å; S259-V263 WeakPolarHBondContact O-CG2 3.33Å; S259-V263 PolarHBondContact O-N 3.5Å
260	A	79.9	Confident	90.7	Very high	24 Å²	24	69.9 Å²	69.9	20%	0.198	35%	0.346	C	S	.	.	H	α-helix	trans	-65.7	-46.1	178.3	0	0	0	0	0	110.8	D258 I264	D258-A260 VanDerWaalsContact C-N 3.27Å; D258-A260 PolarHBondContact O-N 3.45Å; A260-I264 WeakPolarHBondContact O-CB 3.24Å; A260-I264 WeakPolarHBondContact O-CD1 3.49Å; A260-I264 WeakPolarHBondContact O-CG1 3.42Å; A260-I264 PolarHBondContact O-N 2.99Å
261	Y	85.4	Confident	90.8	Very high	127 Å²	127	67.2 Å²	67.2	50%	0.498	33%	0.334	S	S	.	.	H	α-helix	trans	-66.2	-41.4	179.6	-58	-65	0	0	0	111.7	D217 V257 D258 I264 K265	D217-Y261 PolarHBondContact OD1-OH 3.35Å; V257-Y261 HydrophobicContact CG1-CE2 4.37Å; D258-Y261 PolarHBondContact O-N 2.96Å; D258-Y261 VanDerWaalsContact O-N 3.07Å; Y261-I264 PolarHBondContact O-N 2.94Å; Y261-K265 WeakPolarHBondContact O-CB 3.3Å; Y261-K265 PolarHBondContact O-N 3.24Å
262	E	90.9	Very high	91	Very high	120 Å²	120	70 Å²	70	56%	0.561	34%	0.341	S	S	*	.	H	α-helix	trans	-64.3	-46.4	177.6	-174	173.1	-162.9	0	0	111.9	D258 I264 K265 L266	D258-E262 PolarHBondContact O-N 2.88Å; E262-I264 VanDerWaalsContact C-N 3.31Å; E262-I264 PolarHBondContact O-N 3.07Å; E262-K265 WeakPolarHBondContact O-CB 3.4Å; E262-K265 PolarHBondContact O-N 3.07Å; E262-K265 VanDerWaalsContact O-N 3.16Å; E262-L266 HydrophobicContact CG-CD1 3.96Å; E262-L266 HydrophobicContact CG-CG 4.49Å; E262-L266 WeakPolarHBondContact O-CG 3.48Å; E262-L266 PolarHBondContact O-N 3.16Å
263	V	91	Very high	91.2	Very high	58 Å²	58	72.3 Å²	72.3	35%	0.352	36%	0.36	S	S	.	.	H	α-helix	trans	-61.6	-41	176	171.4	0	0	0	0	111.1	S259 L266 K267 T270	S259-V263 WeakPolarHBondContact O-CB 3.46Å; S259-V263 VanDerWaalsContact O-CG2 3.22Å; S259-V263 WeakPolarHBondContact O-CG2 3.33Å; S259-V263 PolarHBondContact O-N 3.5Å; V263-L266 PolarHBondContact O-N 3.16Å; V263-K267 VanDerWaalsContact O-CB 3.26Å; V263-K267 WeakPolarHBondContact O-CB 3.26Å; V263-K267 PolarHBondContact O-N 2.97Å; V263-T270 HydrophobicContact CB-CG2 4.42Å; V263-T270 HydrophobicContact CG1-CG2 4.04Å
264	I	87.9	Confident	91.5	Very high	77 Å²	77	71.5 Å²	71.5	40%	0.395	36%	0.357	S	S	.	.	H	α-helix	trans	-64.2	-41.9	176	-69.4	165.7	0	0	0	110.6	A260 Y261 E262 L266 G268 T270	A260-I264 WeakPolarHBondContact O-CB 3.24Å; A260-I264 WeakPolarHBondContact O-CD1 3.49Å; A260-I264 WeakPolarHBondContact O-CG1 3.42Å; A260-I264 PolarHBondContact O-N 2.99Å; Y261-I264 PolarHBondContact O-N 2.94Å; E262-I264 VanDerWaalsContact C-N 3.31Å; E262-I264 PolarHBondContact O-N 3.07Å; I264-L266 VanDerWaalsContact C-N 3.32Å; I264-L266 PolarHBondContact O-N 2.87Å; I264-G268 WeakPolarHBondContact O-CA 3.27Å; I264-G268 PolarHBondContact O-N 2.79Å; I264-T270 HydrophobicContact CD1-CG2 4.32Å; I264-T270 HydrophobicContact CG1-CG2 3.9Å
265	K	91.2	Very high	91.8	Very high	186 Å²	186	65.7 Å²	65.7	81%	0.809	33%	0.332	S	S	*	.	H	α-helix	trans	-60.9	-40	176.9	-178	-177	177	-175.3	0	112.1	Y261 E262	Y261-K265 WeakPolarHBondContact O-CB 3.3Å; Y261-K265 PolarHBondContact O-N 3.24Å; E262-K265 WeakPolarHBondContact O-CB 3.4Å; E262-K265 PolarHBondContact O-N 3.07Å; E262-K265 VanDerWaalsContact O-N 3.16Å
266	L	94.3	Very high	92.1	Very high	138 Å²	138	66.4 Å²	66.4	72%	0.723	34%	0.336	S	S	*	.	H	α-helix	trans	-83.4	-40.3	-176.6	-66.9	172.6	0	0	0	113.5	E262 V263 I264	E262-L266 HydrophobicContact CG-CD1 3.96Å; E262-L266 HydrophobicContact CG-CG 4.49Å; E262-L266 WeakPolarHBondContact O-CG 3.48Å; E262-L266 PolarHBondContact O-N 3.16Å; V263-L266 PolarHBondContact O-N 3.16Å; I264-L266 VanDerWaalsContact C-N 3.32Å; I264-L266 PolarHBondContact O-N 2.87Å
267	K	93.9	Very high	92.3	Very high	78 Å²	78	66.8 Å²	66.8	34%	0.339	34%	0.339	S	S	.	.	H	α-helix	trans	-107.5	-19.2	-171.4	-172.1	179.5	179	-176.3	0	113.8	V263 Y269 N271 W272	V263-K267 VanDerWaalsContact O-CB 3.26Å; V263-K267 WeakPolarHBondContact O-CB 3.26Å; V263-K267 PolarHBondContact O-N 2.97Å; K267-Y269 VanDerWaalsContact C-N 3.34Å; K267-Y269 HydrophobicContact CD-CE2 4.23Å; K267-Y269 VanDerWaalsContact CE-CE2 3.43Å; K267-Y269 HydrophobicContact CG-CE1 4.43Å; K267-Y269 HydrophobicContact CG-CE2 4.41Å; K267-N271 PolarHBondContact NZ-OD1 2.83Å; K267-W272 VanDerWaalsContact NZ-CD1 3.26Å; K267-W272 VanDerWaalsContact NZ-NE1 3.15Å
268	G	90.4	Very high	92.8	Very high	38 Å²	38	65.8 Å²	65.8	39%	0.392	33%	0.333	S	S	.	.	S	Bend	trans	86	-7.3	-174.7	0	0	0	0	0	115.2	R121 I264	R121-G268 PolarHBondContact NH1-O 3.22Å; I264-G268 WeakPolarHBondContact O-CA 3.27Å; I264-G268 PolarHBondContact O-N 2.79Å
269	Y	90.2	Very high	93.2	Very high	76 Å²	76	63 Å²	63	30%	0.298	32%	0.318	S	S	.	.	S	Bend	trans	-169.1	162.2	179.5	53.9	-89	0	0	0	112.2	Q52 K267 N271	Q52-Y269 HydrophobicContact CB-CD2 3.69Å; Q52-Y269 HydrophobicContact CB-CE2 4Å; Q52-Y269 HydrophobicContact CB-CG 4.28Å; Q52-Y269 HydrophobicContact CG-CD1 4.28Å; Q52-Y269 HydrophobicContact CG-CD2 3.69Å; Q52-Y269 HydrophobicContact CG-CE1 4.39Å; Q52-Y269 HydrophobicContact CG-CE2 3.78Å; Q52-Y269 HydrophobicContact CG-CG 3.96Å; K267-Y269 VanDerWaalsContact C-N 3.34Å; K267-Y269 HydrophobicContact CD-CE2 4.23Å; K267-Y269 VanDerWaalsContact CE-CE2 3.43Å; K267-Y269 HydrophobicContact CG-CE1 4.43Å; K267-Y269 HydrophobicContact CG-CE2 4.41Å; Y269-N271 HydrophobicContact CD2-CB 4.22Å; Y269-N271 HydrophobicContact CE2-CB 4.41Å
270	T	90.8	Very high	93.8	Very high	40 Å²	40	63.2 Å²	63.2	25%	0.245	32%	0.318	C	S	.	.			trans	-102.2	146.8	165.6	61	0	0	0	0	110	V53 V263 I264	V53-T270 WeakPolarHBondContact CG2-O 3.46Å; V263-T270 HydrophobicContact CB-CG2 4.42Å; V263-T270 HydrophobicContact CG1-CG2 4.04Å; I264-T270 HydrophobicContact CD1-CG2 4.32Å; I264-T270 HydrophobicContact CG1-CG2 3.9Å
271	N	95.6	Very high	94.7	Very high	13 Å²	13	62.1 Å²	62.1	7%	0.07	31%	0.308	C	S	.	.			trans	-157.2	-53.8	175.4	66.5	-28.4	0	0	0	113.5	Q52 A56 K267 Y269 I274 G275	Q52-N271 HydrophobicContact CB-CB 3.99Å; Q52-N271 VanDerWaalsContact O-CB 3.31Å; Q52-N271 WeakPolarHBondContact O-CB 3.34Å; A56-N271 HydrophobicContact CB-CB 3.88Å; A56-N271 WeakPolarHBondContact CB-O 3.43Å; K267-N271 PolarHBondContact NZ-OD1 2.83Å; Y269-N271 HydrophobicContact CD2-CB 4.22Å; Y269-N271 HydrophobicContact CE2-CB 4.41Å; N271-I274 WeakPolarHBondContact O-CG2 3.41Å; N271-I274 PolarHBondContact O-N 3.07Å; N271-G275 PolarHBondContact O-N 3.21Å
272	W	98.2	Very high	95.3	Very high	154 Å²	154	56.1 Å²	56.1	58%	0.583	29%	0.285	S	S	*	.	H	α-helix	trans	-65.1	-52.7	-168.5	-58.7	136.9	0	0	0	113.3	A56 K267 I274 G275 L276	A56-W272 HydrophobicContact CB-CE3 3.97Å; A56-W272 HydrophobicContact CB-CZ3 4.21Å; K267-W272 VanDerWaalsContact NZ-CD1 3.26Å; K267-W272 VanDerWaalsContact NZ-NE1 3.15Å; W272-I274 VanDerWaalsContact C-N 3.32Å; W272-I274 PolarHBondContact O-N 3.17Å; W272-G275 PolarHBondContact O-N 2.92Å; W272-L276 WeakPolarHBondContact O-CG 3.34Å; W272-L276 PolarHBondContact O-N 3.22Å
273	A	98.1	Very high	95.7	Very high	49 Å²	49	51.6 Å²	51.6	41%	0.405	26%	0.264	S	S	.	.	H	α-helix	trans	-64	-38.5	-177.4	0	0	0	0	0	112.1	L187 S277	L187-A273 HydrophobicContact CD1-CB 3.66Å; L187-A273 HydrophobicContact CD2-CB 4.36Å; A273-S277 WeakPolarHBondContact O-CB 3.1Å; A273-S277 PolarHBondContact O-N 2.87Å
274	I	98.1	Very high	96.1	Very high	16 Å²	16	48.9 Å²	48.9	8%	0.082	25%	0.247	C	C	.	.	H	α-helix	trans	-70.4	-38.9	175.8	-174.7	60.4	0	0	0	112	V53 V158 L187 N271 W272 L276 S277 V278	V53-I274 HydrophobicContact CG1-CG1 4.3Å; V53-I274 HydrophobicContact CG1-CG2 3.95Å; V53-I274 HydrophobicContact CG2-CG2 4.12Å; V158-I274 HydrophobicContact CG1-CD1 3.97Å; V158-I274 HydrophobicContact CG1-CG1 3.65Å; L187-I274 HydrophobicContact CD2-CB 3.99Å; L187-I274 HydrophobicContact CD2-CD1 4.25Å; N271-I274 WeakPolarHBondContact O-CG2 3.41Å; N271-I274 PolarHBondContact O-N 3.07Å; W272-I274 VanDerWaalsContact C-N 3.32Å; W272-I274 PolarHBondContact O-N 3.17Å; I274-L276 VanDerWaalsContact C-N 3.35Å; I274-L276 PolarHBondContact O-N 3.44Å; I274-S277 WeakPolarHBondContact O-CB 3.21Å; I274-S277 PolarHBondContact O-N 3.24Å; I274-V278 HydrophobicContact CD1-CG2 4.18Å; I274-V278 HydrophobicContact CG1-CG2 4.37Å; I274-V278 WeakPolarHBondContact O-CG2 3.36Å; I274-V278 PolarHBondContact O-N 3.26Å
275	G	98.8	Very high	96.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.5	-42.8	174.3	0	0	0	0	0	112.8	N271 W272 V278 A279	N271-G275 PolarHBondContact O-N 3.21Å; W272-G275 PolarHBondContact O-N 2.92Å; G275-V278 PolarHBondContact O-N 3.34Å; G275-A279 WeakPolarHBondContact O-CB 3.36Å; G275-A279 PolarHBondContact O-N 3.39Å
276	L	98.9	Very high	96.9	Very high	94 Å²	94	37 Å²	37	49%	0.492	19%	0.193	S	C	.	.	H	α-helix	trans	-66.1	-40.8	174.3	-68.1	172.1	0	0	0	112.3	W272 I274 A279 D280	W272-L276 WeakPolarHBondContact O-CG 3.34Å; W272-L276 PolarHBondContact O-N 3.22Å; I274-L276 VanDerWaalsContact C-N 3.35Å; I274-L276 PolarHBondContact O-N 3.44Å; L276-A279 PolarHBondContact O-N 2.83Å; L276-D280 PolarHBondContact O-N 3.37Å
277	S	98.8	Very high	97.1	Very high	10 Å²	10	36.6 Å²	36.6	7%	0.07	18%	0.182	C	C	.	.	H	α-helix	trans	-60.4	-47	175.7	178.6	0	0	0	0	111.4	N186 A273 I274 A279 D280 L281	N186-S277 PolarHBondContact ND2-OG 3.39Å; A273-S277 WeakPolarHBondContact O-CB 3.1Å; A273-S277 PolarHBondContact O-N 2.87Å; I274-S277 WeakPolarHBondContact O-CB 3.21Å; I274-S277 PolarHBondContact O-N 3.24Å; S277-A279 PolarHBondContact O-N 3.5Å; S277-D280 PolarHBondContact O-N 3.21Å; S277-L281 WeakPolarHBondContact O-CG 3.26Å; S277-L281 PolarHBondContact O-N 3.16Å; S277-L281 VanDerWaalsContact O-N 3.14Å
278	V	98.9	Very high	97.3	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.7	-37.3	177.8	171.8	0	0	0	0	111.8	C57 V115 V158 I274 G275 D280 L281 T282	C57-V278 HydrophobicContact CB-CG1 4.29Å; V115-V278 HydrophobicContact CG1-CG1 3.76Å; V115-V278 HydrophobicContact CG2-CG1 3.96Å; V158-V278 HydrophobicContact CG1-CG2 4.32Å; V158-V278 HydrophobicContact CG2-CG2 3.62Å; I274-V278 HydrophobicContact CD1-CG2 4.18Å; I274-V278 HydrophobicContact CG1-CG2 4.37Å; I274-V278 WeakPolarHBondContact O-CG2 3.36Å; I274-V278 PolarHBondContact O-N 3.26Å; G275-V278 PolarHBondContact O-N 3.34Å; V278-D280 VanDerWaalsContact C-N 3.33Å; V278-D280 PolarHBondContact O-N 3.42Å; V278-L281 PolarHBondContact O-N 2.78Å; V278-T282 WeakPolarHBondContact O-CB 3.43Å; V278-T282 PolarHBondContact O-N 3.27Å; V278-T282 PolarHBondContact O-OG1 3.31Å
279	A	98.9	Very high	97.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65	-35.7	174.9	0	0	0	0	0	112.4	I61 L66 G275 L276 S277 T282 E283	I61-A279 HydrophobicContact CG1-CB 4.33Å; L66-A279 WeakPolarHBondContact CD1-O 3.41Å; G275-A279 WeakPolarHBondContact O-CB 3.36Å; G275-A279 PolarHBondContact O-N 3.39Å; L276-A279 PolarHBondContact O-N 2.83Å; S277-A279 PolarHBondContact O-N 3.5Å; A279-T282 PolarHBondContact O-N 2.77Å; A279-E283 WeakPolarHBondContact O-CB 3.08Å; A279-E283 PolarHBondContact O-N 2.75Å
280	D	98.9	Very high	98.1	Very high	30 Å²	30	39 Å²	39	16%	0.16	19%	0.193	C	C	.	.	H	α-helix	trans	-66.5	-38.5	174.5	-164.7	58.1	0	0	0	112.6	R64 L276 S277 V278 S284 R291 H293	R64-D280 IonicContact NH1-OD1 2.75Å; R64-D280 PolarHBondContact NH1-OD1 2.94Å; L276-D280 PolarHBondContact O-N 3.37Å; S277-D280 PolarHBondContact O-N 3.21Å; V278-D280 VanDerWaalsContact C-N 3.33Å; V278-D280 PolarHBondContact O-N 3.42Å; D280-S284 PolarHBondContact O-N 3.34Å; D280-S284 PolarHBondContact O-OG 3.32Å; D280-S284 VanDerWaalsContact O-OG 3.04Å; D280-R291 IonicContact OD1-CZ 3.77Å; D280-R291 IonicContact OD1-NH1 3.8Å; D280-R291 PolarHBondContact OD1-NH1 3.45Å; D280-R291 IonicContact OD1-NH2 2.78Å; D280-R291 PolarHBondContact OD1-NH2 2.97Å; D280-R291 IonicContact OD2-CZ 3.44Å; D280-R291 IonicContact OD2-NH1 3.67Å; D280-R291 IonicContact OD2-NH2 3.83Å; D280-R291 PolarHBondContact OD2-NH2 3.45Å; D280-R291 VanDerWaalsContact OD2-NH2 3.08Å; D280-H293 IonicContact OD2-CE1 2.93Å; D280-H293 PolarHBondContact OD2-CE1 2.86Å; D280-H293 VanDerWaalsContact OD2-CE1 3.23Å; D280-H293 IonicContact OD2-ND1 2.75Å
281	L	98.9	Very high	98.5	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-49.6	171.7	-62.6	179.7	0	0	0	111.1	I156 N186 S277 V278 E283 S284 L285 H293 V295 L317	I156-L281 HydrophobicContact CD1-CB 4.38Å; I156-L281 HydrophobicContact CG2-CD1 4.44Å; N186-L281 HydrophobicContact CB-CD2 4.5Å; S277-L281 WeakPolarHBondContact O-CG 3.26Å; S277-L281 PolarHBondContact O-N 3.16Å; S277-L281 VanDerWaalsContact O-N 3.14Å; V278-L281 PolarHBondContact O-N 2.78Å; L281-E283 VanDerWaalsContact C-N 3.27Å; L281-E283 PolarHBondContact O-N 2.68Å; L281-S284 PolarHBondContact O-N 3.05Å; L281-S284 VanDerWaalsContact O-N 3.15Å; L281-L285 WeakPolarHBondContact O-CG 3.26Å; L281-L285 PolarHBondContact O-N 2.74Å; L281-L285 VanDerWaalsContact O-N 3.1Å; L281-H293 HydrophobicContact CD2-CB 3.73Å; L281-V295 HydrophobicContact CD1-CG1 3.98Å; L281-V295 HydrophobicContact CD2-CG1 3.53Å; L281-V295 HydrophobicContact CG-CG1 4.42Å; L281-L317 HydrophobicContact CD2-CD1 3.84Å
282	T	98.9	Very high	98.7	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-57.9	-41.5	179.8	-57.4	0	0	0	0	110.8	V45 I61 L66 I113 V278 A279 L285 M286	V45-T282 HydrophobicContact CG2-CG2 4.35Å; I61-T282 HydrophobicContact CD1-CG2 4.45Å; I61-T282 HydrophobicContact CG1-CG2 4.36Å; L66-T282 HydrophobicContact CB-CG2 4.44Å; L66-T282 HydrophobicContact CD1-CG2 3.91Å; I113-T282 HydrophobicContact CD1-CG2 3.88Å; V278-T282 WeakPolarHBondContact O-CB 3.43Å; V278-T282 PolarHBondContact O-N 3.27Å; V278-T282 PolarHBondContact O-OG1 3.31Å; A279-T282 PolarHBondContact O-N 2.77Å; T282-L285 PolarHBondContact O-N 2.9Å; T282-M286 WeakPolarHBondContact O-CB 3.32Å; T282-M286 PolarHBondContact O-N 2.95Å
283	E	98.9	Very high	98.7	Very high	26 Å²	26	37.3 Å²	37.3	12%	0.121	19%	0.186	C	C	.	.	H	α-helix	trans	-61.7	-45.3	177.5	-175.9	171.3	-166.9	0	0	112	R64 L66 A279 L281 L285 M286 R287 M289	R64-E283 IonicContact CZ-OE2 3.59Å; R64-E283 IonicContact NH1-OE2 3.38Å; R64-E283 PolarHBondContact NH1-OE2 3.24Å; L66-E283 HydrophobicContact CD1-CB 3.99Å; L66-E283 HydrophobicContact CD2-CB 3.81Å; L66-E283 HydrophobicContact CD2-CG 3.81Å; A279-E283 WeakPolarHBondContact O-CB 3.08Å; A279-E283 PolarHBondContact O-N 2.75Å; L281-E283 VanDerWaalsContact C-N 3.27Å; L281-E283 PolarHBondContact O-N 2.68Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 2.92Å; E283-M286 PolarHBondContact O-N 3.31Å; E283-R287 HydrophobicContact CG-CG 4.38Å; E283-R287 VanDerWaalsContact O-CB 3.3Å; E283-R287 WeakPolarHBondContact O-CB 3.39Å; E283-R287 PolarHBondContact O-N 2.99Å; E283-R287 IonicContact OE1-CZ 2.68Å; E283-R287 IonicContact OE1-NE 3.58Å; E283-R287 IonicContact OE1-NH1 3.27Å; E283-R287 PolarHBondContact OE1-NH1 2.72Å; E283-M289 HydrophobicContact CG-SD 3.95Å
284	S	98.8	Very high	98.7	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-41.1	179.8	-59.6	0	0	0	0	112.2	D280 L281 N288 M289 H293	D280-S284 PolarHBondContact O-N 3.34Å; D280-S284 PolarHBondContact O-OG 3.32Å; D280-S284 VanDerWaalsContact O-OG 3.04Å; L281-S284 PolarHBondContact O-N 3.05Å; L281-S284 VanDerWaalsContact O-N 3.15Å; S284-N288 PolarHBondContact O-N 3.14Å; S284-M289 PolarHBondContact O-N 3.35Å; S284-H293 WeakPolarHBondContact CB-NE2 3.36Å; S284-H293 PolarHBondContact OG-CE1 3.43Å; S284-H293 PolarHBondContact OG-NE2 2.72Å
285	L	98.8	Very high	98.8	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-70.9	-46.8	177	-63.8	169.8	0	0	0	111.7	R112 I113 I154 I156 I181 L281 T282 E283 L317 N318 S319	R112-L285 PolarHBondContact NH2-O 2.82Å; R112-L285 VanDerWaalsContact NH2-O 3.13Å; I113-L285 HydrophobicContact CD1-CB 3.61Å; I113-L285 HydrophobicContact CD1-CD1 4.21Å; I154-L285 HydrophobicContact CD1-CD2 4.31Å; I154-L285 HydrophobicContact CG2-CD1 4.09Å; I156-L285 HydrophobicContact CD1-CD1 3.72Å; I156-L285 HydrophobicContact CG1-CD1 4.09Å; I181-L285 HydrophobicContact CD1-CD1 4.31Å; I181-L285 HydrophobicContact CD1-CD2 4.04Å; L281-L285 WeakPolarHBondContact O-CG 3.26Å; L281-L285 PolarHBondContact O-N 2.74Å; L281-L285 VanDerWaalsContact O-N 3.1Å; T282-L285 PolarHBondContact O-N 2.9Å; E283-L285 VanDerWaalsContact C-N 3.32Å; E283-L285 PolarHBondContact O-N 2.92Å; L285-L317 HydrophobicContact CD2-CB 3.93Å; L285-L317 HydrophobicContact CD2-CD1 4.44Å; L285-L317 HydrophobicContact CD2-CD2 4.48Å; L285-N318 WeakPolarHBondContact CD2-O 3.41Å; L285-S319 VanDerWaalsContact O-CA 3.23Å; L285-S319 WeakPolarHBondContact O-CA 3.25Å; L285-S319 PolarHBondContact O-N 3.49Å
286	M	98.5	Very high	98.8	Very high	12 Å²	12	34.4 Å²	34.4	6%	0.059	16%	0.164	C	C	.	.	H	α-helix	trans	-68.5	-43.1	-175.4	-170.4	62.5	78	0	0	111.9	N43 V45 L66 R112 I113 T282 E283 N288	N43-M286 HydrophobicContact CB-CE 3.92Å; N43-M286 HydrophobicContact CB-CG 4.44Å; N43-M286 HydrophobicContact CB-SD 3.53Å; N43-M286 VanDerWaalsContact CB-SD 3.53Å; N43-M286 VanDerWaalsContact O-CE 3.32Å; N43-M286 WeakPolarHBondContact O-CE 3.37Å; N43-M286 PolarHBondContact OD1-SD 2.96Å; V45-M286 HydrophobicContact CG2-CE 3.57Å; L66-M286 WeakPolarHBondContact O-CG 3.36Å; R112-M286 HydrophobicContact CB-CE 4.43Å; R112-M286 HydrophobicContact CG-SD 4.48Å; R112-M286 PolarHBondContact NH1-O 3.44Å; R112-M286 PolarHBondContact NH1-SD 3.4Å; R112-M286 VanDerWaalsContact NH1-SD 3.35Å; R112-M286 PolarHBondContact NH2-O 2.6Å; I113-M286 HydrophobicContact CD1-CB 4.3Å; I113-M286 HydrophobicContact CD1-CE 4.01Å; I113-M286 HydrophobicContact CG1-CE 4.35Å; T282-M286 WeakPolarHBondContact O-CB 3.32Å; T282-M286 PolarHBondContact O-N 2.95Å; E283-M286 PolarHBondContact O-N 3.31Å; M286-N288 VanDerWaalsContact C-N 3.35Å
287	R	98.6	Very high	98.8	Very high	130 Å²	130	30.3 Å²	30.3	49%	0.491	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	6.4	-177.6	-60.2	-176.5	176.6	-178.1	-8.2	113.7	R64 E283 M289	R64-R287 PolarHBondContact O-NH2 3.46Å; E283-R287 HydrophobicContact CG-CG 4.38Å; E283-R287 VanDerWaalsContact O-CB 3.3Å; E283-R287 WeakPolarHBondContact O-CB 3.39Å; E283-R287 PolarHBondContact O-N 2.99Å; E283-R287 IonicContact OE1-CZ 2.68Å; E283-R287 IonicContact OE1-NE 3.58Å; E283-R287 IonicContact OE1-NH1 3.27Å; E283-R287 PolarHBondContact OE1-NH1 2.72Å; R287-M289 VanDerWaalsContact C-N 3.34Å; R287-M289 HydrophobicContact CB-CG 3.7Å; R287-M289 HydrophobicContact CB-SD 4.28Å; R287-M289 PolarHBondContact O-N 2.88Å
288	N	98.6	Very high	98.7	Very high	76 Å²	76	30.2 Å²	30.2	41%	0.406	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	45.9	177.1	-167.2	38.9	0	0	0	113.1	S284 M286 N318 S319	S284-N288 PolarHBondContact O-N 3.14Å; M286-N288 VanDerWaalsContact C-N 3.35Å; N288-N318 VanDerWaalsContact OD1-CB 3.23Å; N288-N318 WeakPolarHBondContact OD1-CB 3.37Å; N288-S319 PolarHBondContact OD1-N 2.98Å; N288-S319 PolarHBondContact OD1-OG 3.46Å; N288-S319 VanDerWaalsContact OD1-OG 3.11Å
289	M	98.7	Very high	98.7	Very high	79 Å²	79	30.2 Å²	30.2	39%	0.389	14%	0.142	S	C	.	.			trans	-82.1	-16.6	-164	-59.3	-174.2	74.1	0	0	115	E283 S284 R287 R291	E283-M289 HydrophobicContact CG-SD 3.95Å; S284-M289 PolarHBondContact O-N 3.35Å; R287-M289 VanDerWaalsContact C-N 3.34Å; R287-M289 HydrophobicContact CB-CG 3.7Å; R287-M289 HydrophobicContact CB-SD 4.28Å; R287-M289 PolarHBondContact O-N 2.88Å; M289-R291 HydrophobicContact CB-CB 4.48Å; M289-R291 HydrophobicContact CB-CG 3.91Å; M289-R291 HydrophobicContact CE-CG 4.37Å; M289-R291 PolarHBondContact O-N 3.28Å
290	N	98.6	Very high	98.6	Very high	87 Å²	87	34.3 Å²	34.3	47%	0.465	16%	0.161	S	C	.	.			trans	52.8	35.7	-169.6	-62.8	-54.3	0	0	0	112.9	V316 L317 N318	N290-V316 HydrophobicContact CB-CG1 3.74Å; N290-L317 WeakPolarHBondContact CA-O 3.4Å; N290-L317 PolarHBondContact N-O 2.93Å; N290-N318 WeakPolarHBondContact OD1-CB 3.25Å; N290-N318 PolarHBondContact OD1-ND2 3.12Å
291	R	98.7	Very high	98.5	Very high	92 Å²	92	36.2 Å²	36.2	35%	0.347	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	148.3	174.1	-77.1	-177.5	64.5	-159	-12.4	110.1	D280 M289 H293 L317	D280-R291 IonicContact OD1-CZ 3.77Å; D280-R291 IonicContact OD1-NH1 3.8Å; D280-R291 PolarHBondContact OD1-NH1 3.45Å; D280-R291 IonicContact OD1-NH2 2.78Å; D280-R291 PolarHBondContact OD1-NH2 2.97Å; D280-R291 IonicContact OD2-CZ 3.44Å; D280-R291 IonicContact OD2-NH1 3.67Å; D280-R291 IonicContact OD2-NH2 3.83Å; D280-R291 PolarHBondContact OD2-NH2 3.45Å; D280-R291 VanDerWaalsContact OD2-NH2 3.08Å; M289-R291 HydrophobicContact CB-CB 4.48Å; M289-R291 HydrophobicContact CB-CG 3.91Å; M289-R291 HydrophobicContact CE-CG 4.37Å; M289-R291 PolarHBondContact O-N 3.28Å; R291-H293 WeakPolarHBondContact CB-NE2 3.22Å; R291-H293 PolarHBondContact O-CD2 3.4Å; R291-L317 PolarHBondContact N-O 3.22Å; R291-L317 PolarHBondContact O-N 2.96Å
292	I	98.8	Very high	98.4	Very high	78 Å²	78	38.6 Å²	38.6	40%	0.4	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	128.9	179.5	-60.8	165.5	0	0	0	109.7	W210 P314 C315 V316 V326	W210-I292 HydrophobicContact CH2-CB 4.34Å; W210-I292 HydrophobicContact CH2-CG2 3.7Å; W210-I292 HydrophobicContact CZ3-CG2 4.11Å; I292-P314 HydrophobicContact CG2-CB 3.57Å; I292-C315 CarbonylContact C-O 3.57Å; I292-C315 VanDerWaalsContact CA-O 3.28Å; I292-C315 WeakPolarHBondContact CA-O 3.36Å; I292-V316 HydrophobicContact CG1-CG2 3.95Å; I292-V326 HydrophobicContact CD1-CG2 4.03Å; I292-V326 HydrophobicContact CG1-CG2 4.29Å; I292-V326 HydrophobicContact CG2-CG2 4.02Å
293	H	98.9	Very high	98.3	Very high	3 Å²	3	40.7 Å²	40.7	1%	0.014	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	139.5	179.3	-60.4	-93.3	0	0	0	110.8	D280 L281 S284 R291 V295 P314 C315 L317	D280-H293 IonicContact OD2-CE1 2.93Å; D280-H293 PolarHBondContact OD2-CE1 2.86Å; D280-H293 VanDerWaalsContact OD2-CE1 3.23Å; D280-H293 IonicContact OD2-ND1 2.75Å; L281-H293 HydrophobicContact CD2-CB 3.73Å; S284-H293 WeakPolarHBondContact CB-NE2 3.36Å; S284-H293 PolarHBondContact OG-CE1 3.43Å; S284-H293 PolarHBondContact OG-NE2 2.72Å; R291-H293 WeakPolarHBondContact CB-NE2 3.22Å; R291-H293 PolarHBondContact O-CD2 3.4Å; H293-V295 HydrophobicContact CB-CG1 3.91Å; H293-V295 PolarHBondContact O-N 3.41Å; H293-V295 VanDerWaalsContact O-N 3.15Å; H293-P314 CarbonylContact O-C 3.58Å; H293-P314 WeakPolarHBondContact O-CA 3.49Å; H293-C315 PolarHBondContact N-O 3.37Å; H293-C315 PolarHBondContact O-N 3.3Å; H293-L317 HydrophobicContact CB-CD1 4.07Å; H293-L317 HydrophobicContact CB-CG 4.48Å
294	P	98.7	Very high	98.2	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.026	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	95.6	172.5	30.2	-20.2	0	0	0	108.7	T185 N186 S189 W210 L212 L313	T185-P294 CarbonylContact C-O 3.58Å; N186-P294 WeakPolarHBondContact CA-O 3.39Å; N186-P294 PolarHBondContact N-O 3.23Å; N186-P294 WeakPolarHBondContact OD1-CD 3.4Å; S189-P294 WeakPolarHBondContact OG-CG 3.44Å; W210-P294 HydrophobicContact CE3-CB 4.04Å; W210-P294 HydrophobicContact CE3-CG 3.84Å; W210-P294 HydrophobicContact CZ3-CB 4.38Å; W210-P294 HydrophobicContact CZ3-CG 4.02Å; L212-P294 HydrophobicContact CD2-CB 4Å; P294-L313 WeakPolarHBondContact CA-O 3.29Å
295	V	98.9	Very high	98.1	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	154.1	-176	-69.9	0	0	0	0	110.4	I181 G182 N186 L281 H293 T297 S312 L313 C315 L317	I181-V295 HydrophobicContact CG2-CB 3.74Å; I181-V295 HydrophobicContact CG2-CG1 4.26Å; I181-V295 HydrophobicContact CG2-CG2 3.75Å; G182-V295 WeakPolarHBondContact O-CB 3.44Å; N186-V295 HydrophobicContact CB-CG1 4.4Å; L281-V295 HydrophobicContact CD1-CG1 3.98Å; L281-V295 HydrophobicContact CD2-CG1 3.53Å; L281-V295 HydrophobicContact CG-CG1 4.42Å; H293-V295 HydrophobicContact CB-CG1 3.91Å; H293-V295 PolarHBondContact O-N 3.41Å; H293-V295 VanDerWaalsContact O-N 3.15Å; V295-T297 PolarHBondContact O-N 3.46Å; V295-S312 WeakPolarHBondContact O-CA 3.5Å; V295-L313 PolarHBondContact N-O 2.69Å; V295-L313 PolarHBondContact O-N 3.15Å; V295-C315 HydrophobicContact CG2-CB 3.69Å; V295-L317 HydrophobicContact CG1-CD1 4.31Å; V295-L317 HydrophobicContact CG2-CD1 4.31Å; V295-L317 HydrophobicContact CG2-CD2 4.17Å
296	S	98.8	Very high	98	Very high	0 Å²	0	47 Å²	47	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	121.6	179.1	-163.4	0	0	0	0	110.4	D163 G182 L311	D163-S296 WeakPolarHBondContact OD1-CB 3.3Å; D163-S296 PolarHBondContact OD1-OG 3.19Å; G182-S296 PolarHBondContact N-O 3.17Å; G182-S296 PolarHBondContact O-N 2.87Å; S296-L311 WeakPolarHBondContact CA-O 3.49Å
297	T	98.7	Very high	97.9	Very high	7 Å²	7	48.5 Å²	48.5	4%	0.043	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	163.4	-177.5	-168.3	0	0	0	0	110.4	V295 V299 Y310 L311 L313 C315 V325	V295-T297 PolarHBondContact O-N 3.46Å; T297-V299 HydrophobicContact CG2-CG1 4.13Å; T297-V299 WeakPolarHBondContact O-CG1 3.44Å; T297-V299 PolarHBondContact O-N 2.97Å; T297-Y310 VanDerWaalsContact O-CA 3.26Å; T297-Y310 WeakPolarHBondContact O-CA 3.27Å; T297-L311 PolarHBondContact N-O 3.01Å; T297-L311 PolarHBondContact O-N 3.16Å; T297-L311 VanDerWaalsContact O-N 3.13Å; T297-L313 HydrophobicContact CG2-CB 4.28Å; T297-C315 VanDerWaalsContact CG2-SG 3.57Å; T297-V325 HydrophobicContact CG2-CG2 4.14Å
298	M	98.2	Very high	97.8	Very high	8 Å²	8	45.2 Å²	45.2	4%	0.039	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	117.1	173.8	176.6	63	81.3	0	0	110.4	W170 K177 Q300 E308 Y310	W170-M298 HydrophobicContact CD2-CE 4.31Å; W170-M298 HydrophobicContact CE3-CE 3.68Å; W170-M298 HydrophobicContact CH2-CE 3.48Å; W170-M298 VanDerWaalsContact CH2-CE 3.48Å; W170-M298 HydrophobicContact CZ2-CE 4.16Å; W170-M298 HydrophobicContact CZ3-CE 3.19Å; K177-M298 HydrophobicContact CB-CB 4.27Å; K177-M298 HydrophobicContact CD-CB 4.04Å; K177-M298 HydrophobicContact CD-CG 4.01Å; M298-Q300 HydrophobicContact CG-CB 4.3Å; M298-Q300 HydrophobicContact SD-CB 3.96Å; M298-E308 HydrophobicContact CE-CB 3.92Å; M298-E308 HydrophobicContact CE-CG 4.33Å; M298-E308 HydrophobicContact SD-CB 4.2Å; M298-Y310 HydrophobicContact CB-CD2 4.43Å; M298-Y310 HydrophobicContact CB-CE1 4.37Å; M298-Y310 HydrophobicContact CB-CE2 3.92Å; M298-Y310 HydrophobicContact CE-CD2 4.1Å; M298-Y310 HydrophobicContact CE-CE2 3.55Å; M298-Y310 HydrophobicContact SD-CD2 4.43Å; M298-Y310 HydrophobicContact SD-CE2 4.28Å
299	V	97.6	Very high	97.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.244	C	C	.	.			trans	-105.4	4.6	-175	-57.1	0	0	0	0	114.8	T297 G301 M302 I305 V309 L311 L313	T297-V299 HydrophobicContact CG2-CG1 4.13Å; T297-V299 WeakPolarHBondContact O-CG1 3.44Å; T297-V299 PolarHBondContact O-N 2.97Å; V299-G301 PolarHBondContact O-N 3.35Å; V299-M302 VanDerWaalsContact O-CB 3.28Å; V299-M302 WeakPolarHBondContact O-CB 3.4Å; V299-M302 WeakPolarHBondContact O-CG 3.39Å; V299-M302 PolarHBondContact O-N 2.96Å; V299-I305 HydrophobicContact CG2-CB 4.5Å; V299-I305 HydrophobicContact CG2-CD1 3.87Å; V299-I305 HydrophobicContact CG2-CG2 4.08Å; V299-V309 WeakPolarHBondContact CG2-O 3.39Å; V299-V309 PolarHBondContact N-O 2.81Å; V299-L311 HydrophobicContact CB-CD1 4.32Å; V299-L311 HydrophobicContact CB-CG 4.32Å; V299-L311 HydrophobicContact CG1-CD1 3.52Å; V299-L311 HydrophobicContact CG1-CG 3.76Å; V299-L311 HydrophobicContact CG2-CD1 4.16Å; V299-L311 HydrophobicContact CG2-CD2 3.99Å; V299-L311 HydrophobicContact CG2-CG 3.68Å; V299-L313 HydrophobicContact CB-CD1 4.12Å; V299-L313 HydrophobicContact CG1-CD1 3.43Å; V299-L313 VanDerWaalsContact CG1-CD1 3.43Å; V299-L313 HydrophobicContact CG1-CG 3.85Å
300	Q	97.4	Very high	97.7	Very high	86 Å²	86	37.9 Å²	37.9	40%	0.402	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	127.7	177.6	-175.1	177.7	51.2	0	0	111.8	M298 S306 D307	M298-Q300 HydrophobicContact CG-CB 4.3Å; M298-Q300 HydrophobicContact SD-CB 3.96Å; Q300-S306 WeakPolarHBondContact CG-O 3.26Å; Q300-S306 PolarHBondContact NE2-O 2.85Å; Q300-D307 WeakPolarHBondContact CB-O 3.49Å
301	G	96.8	Very high	97.7	Very high	71 Å²	71	33.7 Å²	33.7	73%	0.732	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.5	2	-177.9	0	0	0	0	0	114.7	V299 I305	V299-G301 PolarHBondContact O-N 3.35Å; G301-I305 WeakPolarHBondContact CA-O 3.43Å; G301-I305 PolarHBondContact N-O 3.34Å
302	M	97.3	Very high	97.7	Very high	50 Å²	50	29.3 Å²	29.3	25%	0.246	19%	0.187	C	C	.	.	S	Bend	trans	-107.9	141.7	-180	-52.7	-178.1	-171.7	0	0	110.8	V299 G304 I305 L313 V325	V299-M302 VanDerWaalsContact O-CB 3.28Å; V299-M302 WeakPolarHBondContact O-CB 3.4Å; V299-M302 WeakPolarHBondContact O-CG 3.39Å; V299-M302 PolarHBondContact O-N 2.96Å; M302-G304 PolarHBondContact O-N 2.9Å; M302-I305 WeakPolarHBondContact O-CB 3.4Å; M302-I305 WeakPolarHBondContact O-CG1 3.23Å; M302-I305 PolarHBondContact O-N 2.73Å; M302-L313 HydrophobicContact SD-CD1 3.69Å; M302-V325 HydrophobicContact CE-CB 4.13Å; M302-V325 HydrophobicContact CE-CG2 3.93Å; M302-V325 HydrophobicContact SD-CB 4.19Å; M302-V325 HydrophobicContact SD-CG1 3.95Å; M302-V325 HydrophobicContact SD-CG2 4.33Å
303	Y	96.9	Very high	97.7	Very high	45 Å²	45	25.6 Å²	25.6	18%	0.176	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	32.9	176.1	-51.6	-79.6	0	0	0	114.6	I305 L313 V326 M328 L330 V335 L338 Q339	Y303-I305 VanDerWaalsContact C-N 3.32Å; Y303-I305 PolarHBondContact O-N 2.67Å; Y303-L313 HydrophobicContact CD2-CD1 4.33Å; Y303-L313 HydrophobicContact CD2-CD2 4.37Å; Y303-L313 HydrophobicContact CE2-CD1 3.89Å; Y303-L313 HydrophobicContact CE2-CD2 3.83Å; Y303-V326 PolarHBondContact OH-O 3.38Å; Y303-M328 PolarHBondContact OH-N 2.81Å; Y303-L330 HydrophobicContact CD1-CD1 4Å; Y303-L330 HydrophobicContact CE1-CD1 3.74Å; Y303-L330 HydrophobicContact CE1-CG 4.11Å; Y303-V335 HydrophobicContact CD1-CG2 4.28Å; Y303-L338 HydrophobicContact CD2-CD2 3.63Å; Y303-L338 HydrophobicContact CE2-CD2 4.26Å; Y303-L338 HydrophobicContact CG-CD2 3.8Å; Y303-Q339 PolarHBondContact O-NE2 3.23Å
304	G	96	Very high	97.7	Very high	68 Å²	68	25.6 Å²	25.6	70%	0.701	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.9	7	-179.2	0	0	0	0	0	115.4	M302	M302-G304 PolarHBondContact O-N 2.9Å
305	I	97.2	Very high	97.7	Very high	9 Å²	9	25.4 Å²	25.4	5%	0.046	17%	0.166	C	C	.	.			trans	-84.6	116.3	179	-58.4	164.2	0	0	0	109.3	V299 G301 M302 Y303 L311 L338 Q339 A342	V299-I305 HydrophobicContact CG2-CB 4.5Å; V299-I305 HydrophobicContact CG2-CD1 3.87Å; V299-I305 HydrophobicContact CG2-CG2 4.08Å; G301-I305 WeakPolarHBondContact CA-O 3.43Å; G301-I305 PolarHBondContact N-O 3.34Å; M302-I305 WeakPolarHBondContact O-CB 3.4Å; M302-I305 WeakPolarHBondContact O-CG1 3.23Å; M302-I305 PolarHBondContact O-N 2.73Å; Y303-I305 VanDerWaalsContact C-N 3.32Å; Y303-I305 PolarHBondContact O-N 2.67Å; I305-L311 HydrophobicContact CD1-CD2 4.21Å; I305-L338 HydrophobicContact CD1-CG 4.35Å; I305-Q339 HydrophobicContact CG1-CG 4.31Å; I305-A342 HydrophobicContact CD1-CB 3.77Å; I305-A342 HydrophobicContact CG1-CB 3.97Å; I305-A342 HydrophobicContact CG2-CB 3.98Å
306	S	96.3	Very high	97.7	Very high	83 Å²	83	26.5 Å²	26.5	58%	0.58	17%	0.173	S	C	*	.			trans	-92.8	-22.6	-179.1	45.1	0	0	0	0	114.5	Q300	Q300-S306 WeakPolarHBondContact CG-O 3.26Å; Q300-S306 PolarHBondContact NE2-O 2.85Å
307	D	96.4	Very high	97.7	Very high	42 Å²	42	26.5 Å²	26.5	23%	0.225	17%	0.173	C	C	.	.	S	Bend	trans	-84.5	156.6	-171.5	-57	-79.9	0	0	0	112.1	Q300 V309 W346	Q300-D307 WeakPolarHBondContact CB-O 3.49Å; D307-V309 HydrophobicContact CB-CG2 4Å; D307-V309 PolarHBondContact O-N 3.36Å; D307-W346 HydrophobicContact CB-CD2 3.73Å; D307-W346 HydrophobicContact CB-CE3 3.76Å; D307-W346 HydrophobicContact CB-CG 4.17Å; D307-W346 HydrophobicContact CB-CH2 4.4Å; D307-W346 HydrophobicContact CB-CZ2 4.38Å; D307-W346 HydrophobicContact CB-CZ3 4.11Å; D307-W346 WeakPolarHBondContact OD1-CZ2 3.31Å
308	E	96	Very high	97.7	Very high	62 Å²	62	27.6 Å²	27.6	29%	0.29	18%	0.179	S	C	.	.			trans	-76.9	68.5	177.6	-69.1	-168	141.7	0	0	111.2	Y167 W170 K171 M298 Q349	Y167-E308 WeakPolarHBondContact CD2-O 3.28Å; Y167-E308 HydrophobicContact CE2-CB 4.37Å; Y167-E308 WeakPolarHBondContact CE2-O 3.24Å; W170-E308 HydrophobicContact CZ3-CB 4.5Å; K171-E308 IonicContact NZ-OE1 3.08Å; K171-E308 IonicContact NZ-OE2 3.98Å; K171-E308 PolarHBondContact NZ-OE2 3.01Å; M298-E308 HydrophobicContact CE-CB 3.92Å; M298-E308 HydrophobicContact CE-CG 4.33Å; M298-E308 HydrophobicContact SD-CB 4.2Å; E308-Q349 PolarHBondContact O-OE1 2.92Å
309	V	96.9	Very high	97.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	20%	0.195	C	C	.	.			trans	-106.5	142.7	-178.2	176.6	0	0	0	0	110.6	V299 D307 L345 W346	V299-V309 WeakPolarHBondContact CG2-O 3.39Å; V299-V309 PolarHBondContact N-O 2.81Å; D307-V309 HydrophobicContact CB-CG2 4Å; D307-V309 PolarHBondContact O-N 3.36Å; V309-L345 HydrophobicContact CG1-CB 3.79Å; V309-L345 HydrophobicContact CG1-CD1 4Å; V309-W346 HydrophobicContact CG2-CB 3.88Å; V309-W346 HydrophobicContact CG2-CD2 4.48Å; V309-W346 HydrophobicContact CG2-CE3 3.93Å
310	Y	98.4	Very high	97.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	131.2	165.1	-85.8	-107.6	0	0	0	109.7	D163 T166 Y167 W170 K177 T297 M298 L345	D163-Y310 WeakPolarHBondContact CB-O 3.25Å; D163-Y310 WeakPolarHBondContact O-CB 3.18Å; T166-Y310 HydrophobicContact CG2-CD1 3.31Å; T166-Y310 HydrophobicContact CG2-CE1 3.57Å; T166-Y310 HydrophobicContact CG2-CG 4.09Å; Y167-Y310 HydrophobicContact CD2-CD2 4.33Å; W170-Y310 HydrophobicContact CB-CE2 4.09Å; W170-Y310 HydrophobicContact CD2-CE2 4.08Å; W170-Y310 AromaticContact CE3-CE2 3.84Å; W170-Y310 HydrophobicContact CE3-CE2 3.84Å; W170-Y310 HydrophobicContact CG-CE2 4.19Å; K177-Y310 PolarHBondContact O-OH 3.44Å; T297-Y310 VanDerWaalsContact O-CA 3.26Å; T297-Y310 WeakPolarHBondContact O-CA 3.27Å; M298-Y310 HydrophobicContact CB-CD2 4.43Å; M298-Y310 HydrophobicContact CB-CE1 4.37Å; M298-Y310 HydrophobicContact CB-CE2 3.92Å; M298-Y310 HydrophobicContact CE-CD2 4.1Å; M298-Y310 HydrophobicContact CE-CE2 3.55Å; M298-Y310 HydrophobicContact SD-CD2 4.43Å; M298-Y310 HydrophobicContact SD-CE2 4.28Å; Y310-L345 WeakPolarHBondContact O-CD1 3.08Å
311	L	98.1	Very high	97.7	Very high	0 Å²	0	27 Å²	27	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	172.5	168.2	61.6	74.8	0	0	0	109.7	S296 T297 V299 I305 L313 L338 A342 L345	S296-L311 WeakPolarHBondContact CA-O 3.49Å; T297-L311 PolarHBondContact N-O 3.01Å; T297-L311 PolarHBondContact O-N 3.16Å; T297-L311 VanDerWaalsContact O-N 3.13Å; V299-L311 HydrophobicContact CB-CD1 4.32Å; V299-L311 HydrophobicContact CB-CG 4.32Å; V299-L311 HydrophobicContact CG1-CD1 3.52Å; V299-L311 HydrophobicContact CG1-CG 3.76Å; V299-L311 HydrophobicContact CG2-CD1 4.16Å; V299-L311 HydrophobicContact CG2-CD2 3.99Å; V299-L311 HydrophobicContact CG2-CG 3.68Å; I305-L311 HydrophobicContact CD1-CD2 4.21Å; L311-L313 HydrophobicContact CD1-CD2 4.27Å; L311-L313 HydrophobicContact CD1-CG 4.02Å; L311-L338 HydrophobicContact CD1-CD1 3.69Å; L311-L338 HydrophobicContact CD1-CG 4.47Å; L311-L338 HydrophobicContact CD2-CD1 4.23Å; L311-A342 HydrophobicContact CD2-CB 3.77Å; L311-L345 HydrophobicContact CB-CD1 3.95Å
312	S	98.8	Very high	97.8	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	122.2	-172	-56.8	0	0	0	0	113.4	G184 T185 L212 G213 V295	G184-S312 WeakPolarHBondContact CA-OG 3.35Å; T185-S312 PolarHBondContact N-OG 2.9Å; T185-S312 WeakPolarHBondContact OG1-CB 3.32Å; T185-S312 PolarHBondContact OG1-OG 3.15Å; L212-S312 WeakPolarHBondContact CB-O 3.23Å; G213-S312 PolarHBondContact N-O 3.45Å; G213-S312 VanDerWaalsContact O-CB 3.3Å; G213-S312 WeakPolarHBondContact O-CB 3.43Å; G213-S312 PolarHBondContact O-N 3.44Å; G213-S312 PolarHBondContact O-OG 2.9Å; V295-S312 WeakPolarHBondContact O-CA 3.5Å
313	L	98.8	Very high	97.9	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	157.4	169	-69.7	179.9	0	0	0	109.6	L212 P294 V295 T297 V299 M302 Y303 L311 C315 V325 L338	L212-L313 HydrophobicContact CD1-CD2 4.27Å; P294-L313 WeakPolarHBondContact CA-O 3.29Å; V295-L313 PolarHBondContact N-O 2.69Å; V295-L313 PolarHBondContact O-N 3.15Å; T297-L313 HydrophobicContact CG2-CB 4.28Å; V299-L313 HydrophobicContact CB-CD1 4.12Å; V299-L313 HydrophobicContact CG1-CD1 3.43Å; V299-L313 VanDerWaalsContact CG1-CD1 3.43Å; V299-L313 HydrophobicContact CG1-CG 3.85Å; M302-L313 HydrophobicContact SD-CD1 3.69Å; Y303-L313 HydrophobicContact CD2-CD1 4.33Å; Y303-L313 HydrophobicContact CD2-CD2 4.37Å; Y303-L313 HydrophobicContact CE2-CD1 3.89Å; Y303-L313 HydrophobicContact CE2-CD2 3.83Å; L311-L313 HydrophobicContact CD1-CD2 4.27Å; L311-L313 HydrophobicContact CD1-CG 4.02Å; L313-C315 PolarHBondContact O-N 3.44Å; L313-C315 VanDerWaalsContact O-N 3.11Å; L313-C315 PolarHBondContact O-SG 3.15Å; L313-V325 HydrophobicContact CB-CG1 3.69Å; L313-V325 HydrophobicContact CD1-CG1 3.73Å; L313-V325 HydrophobicContact CG-CG1 4.37Å; L313-L338 HydrophobicContact CD2-CD1 4.47Å; L313-L338 HydrophobicContact CD2-CD2 4.08Å
314	P	98.6	Very high	98	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.013	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	114.4	175.6	-3.1	16.9	0	0	0	109.7	W210 L212 I292 H293 V326 M328	W210-P314 HydrophobicContact CE3-CB 4.31Å; W210-P314 HydrophobicContact CE3-CG 4.47Å; W210-P314 HydrophobicContact CZ3-CB 4.14Å; L212-P314 HydrophobicContact CD2-CG 4.01Å; I292-P314 HydrophobicContact CG2-CB 3.57Å; H293-P314 CarbonylContact O-C 3.58Å; H293-P314 WeakPolarHBondContact O-CA 3.49Å; P314-V326 HydrophobicContact CB-CB 4.02Å; P314-V326 HydrophobicContact CB-CG2 4.13Å; P314-V326 HydrophobicContact CG-CB 4.33Å; P314-V326 WeakPolarHBondContact O-CG2 3.48Å; P314-V326 PolarHBondContact O-N 3.29Å; P314-M328 HydrophobicContact CG-CG 3.85Å; P314-M328 HydrophobicContact CG-SD 3.37Å; P314-M328 WeakPolarHBondContact CG-SD 3.25Å
315	C	98.9	Very high	98.1	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	136.4	-176.6	-64.8	0	0	0	0	110.5	I292 H293 V295 T297 L313 L317 V322 S324	I292-C315 CarbonylContact C-O 3.57Å; I292-C315 VanDerWaalsContact CA-O 3.28Å; I292-C315 WeakPolarHBondContact CA-O 3.36Å; H293-C315 PolarHBondContact N-O 3.37Å; H293-C315 PolarHBondContact O-N 3.3Å; V295-C315 HydrophobicContact CG2-CB 3.69Å; T297-C315 VanDerWaalsContact CG2-SG 3.57Å; L313-C315 PolarHBondContact O-N 3.44Å; L313-C315 VanDerWaalsContact O-N 3.11Å; L313-C315 PolarHBondContact O-SG 3.15Å; C315-L317 HydrophobicContact CB-CD2 3.96Å; C315-L317 PolarHBondContact O-N 2.64Å; C315-V322 HydrophobicContact CB-CG1 3.97Å; C315-V322 HydrophobicContact CB-CG2 4.33Å; C315-S324 CarbonylContact C-O 3.56Å; C315-S324 WeakPolarHBondContact CA-O 3.47Å
316	V	98.9	Very high	98.1	Very high	23 Å²	23	25.1 Å²	25.1	14%	0.139	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	116	167.2	179.9	0	0	0	0	108	N290 I292 A323 S324	N290-V316 HydrophobicContact CB-CG1 3.74Å; I292-V316 HydrophobicContact CG1-CG2 3.95Å; V316-A323 HydrophobicContact CB-CB 4.44Å; V316-A323 HydrophobicContact CG1-CB 4.28Å; V316-A323 WeakPolarHBondContact O-CB 3.28Å; V316-A323 PolarHBondContact O-N 3.2Å; V316-S324 WeakPolarHBondContact CB-OG 3.29Å; V316-S324 VanDerWaalsContact CG2-OG 3.23Å; V316-S324 WeakPolarHBondContact CG2-OG 3.46Å; V316-S324 PolarHBondContact N-O 3.31Å
317	L	98.9	Very high	98.1	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.8	-179.1	-60.8	-168.5	0	0	0	111.6	I181 L281 L285 N290 R291 H293 V295 C315 G321 V322	I181-L317 HydrophobicContact CD1-CD2 4.07Å; L281-L317 HydrophobicContact CD2-CD1 3.84Å; L285-L317 HydrophobicContact CD2-CB 3.93Å; L285-L317 HydrophobicContact CD2-CD1 4.44Å; L285-L317 HydrophobicContact CD2-CD2 4.48Å; N290-L317 WeakPolarHBondContact CA-O 3.4Å; N290-L317 PolarHBondContact N-O 2.93Å; R291-L317 PolarHBondContact N-O 3.22Å; R291-L317 PolarHBondContact O-N 2.96Å; H293-L317 HydrophobicContact CB-CD1 4.07Å; H293-L317 HydrophobicContact CB-CG 4.48Å; V295-L317 HydrophobicContact CG1-CD1 4.31Å; V295-L317 HydrophobicContact CG2-CD1 4.31Å; V295-L317 HydrophobicContact CG2-CD2 4.17Å; C315-L317 HydrophobicContact CB-CD2 3.96Å; C315-L317 PolarHBondContact O-N 2.64Å; L317-G321 WeakPolarHBondContact CA-O 3.21Å; L317-V322 HydrophobicContact CD2-CB 4.41Å; L317-V322 HydrophobicContact CD2-CG2 3.8Å
318	N	98.5	Very high	98	Very high	30 Å²	30	27.5 Å²	27.5	16%	0.16	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	-169.2	179.6	80.7	13.2	0	0	0	111.3	L285 N288 N290 G320 G321 A323	L285-N318 WeakPolarHBondContact CD2-O 3.41Å; N288-N318 VanDerWaalsContact OD1-CB 3.23Å; N288-N318 WeakPolarHBondContact OD1-CB 3.37Å; N290-N318 WeakPolarHBondContact OD1-CB 3.25Å; N290-N318 PolarHBondContact OD1-ND2 3.12Å; N318-G320 PolarHBondContact O-N 2.89Å; N318-G320 PolarHBondContact OD1-N 3.04Å; N318-G321 PolarHBondContact N-O 2.89Å; N318-G321 VanDerWaalsContact N-O 3.11Å; N318-G321 PolarHBondContact O-N 3.46Å; N318-A323 VanDerWaalsContact ND2-CB 3.31Å; N318-A323 WeakPolarHBondContact ND2-CB 3.42Å
319	S	98.1	Very high	98	Very high	53 Å²	53	31 Å²	31	37%	0.371	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-13.4	-174.5	59.9	0	0	0	0	115.3	I154 L285 N288	I154-S319 WeakPolarHBondContact CD1-O 3.5Å; L285-S319 VanDerWaalsContact O-CA 3.23Å; L285-S319 WeakPolarHBondContact O-CA 3.25Å; L285-S319 PolarHBondContact O-N 3.49Å; N288-S319 PolarHBondContact OD1-N 2.98Å; N288-S319 PolarHBondContact OD1-OG 3.46Å; N288-S319 VanDerWaalsContact OD1-OG 3.11Å
320	G	98.1	Very high	97.9	Very high	29 Å²	29	32.2 Å²	32.2	30%	0.299	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-5.6	172.9	0	0	0	0	0	114.9	H178 N318	H178-G320 PolarHBondContact CD2-O 3.38Å; N318-G320 PolarHBondContact O-N 2.89Å; N318-G320 PolarHBondContact OD1-N 3.04Å
321	G	98.7	Very high	97.9	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	102.1	-132.5	-172	0	0	0	0	0	111.5	I154 H178 L317 N318 A323	I154-G321 VanDerWaalsContact CD1-N 3.35Å; H178-G321 CarbonylContact O-C 3.57Å; H178-G321 WeakPolarHBondContact O-CA 3.41Å; L317-G321 WeakPolarHBondContact CA-O 3.21Å; N318-G321 PolarHBondContact N-O 2.89Å; N318-G321 VanDerWaalsContact N-O 3.11Å; N318-G321 PolarHBondContact O-N 3.46Å; G321-A323 PolarHBondContact O-N 3.13Å
322	V	98.8	Very high	97.9	Very high	12 Å²	12	41.8 Å²	41.8	7%	0.073	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	101	173	178	0	0	0	0	109.4	H178 I181 C315 L317 V325	H178-V322 HydrophobicContact CB-CB 4.35Å; H178-V322 WeakPolarHBondContact CB-O 3.31Å; H178-V322 PolarHBondContact O-N 3.41Å; I181-V322 HydrophobicContact CD1-CG2 3.93Å; I181-V322 HydrophobicContact CG1-CG2 3.9Å; C315-V322 HydrophobicContact CB-CG1 3.97Å; C315-V322 HydrophobicContact CB-CG2 4.33Å; L317-V322 HydrophobicContact CD2-CB 4.41Å; L317-V322 HydrophobicContact CD2-CG2 3.8Å; V322-V325 HydrophobicContact CG1-CG2 4.26Å
323	A	98.6	Very high	97.7	Very high	55 Å²	55	48 Å²	48	46%	0.455	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	-41.6	179.5	0	0	0	0	0	112.1	V316 N318 G321	V316-A323 HydrophobicContact CB-CB 4.44Å; V316-A323 HydrophobicContact CG1-CB 4.28Å; V316-A323 WeakPolarHBondContact O-CB 3.28Å; V316-A323 PolarHBondContact O-N 3.2Å; N318-A323 VanDerWaalsContact ND2-CB 3.31Å; N318-A323 WeakPolarHBondContact ND2-CB 3.42Å; G321-A323 PolarHBondContact O-N 3.13Å
324	S	98.4	Very high	97.7	Very high	60 Å²	60	48.5 Å²	48.5	42%	0.42	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.3	158.9	178.8	58	0	0	0	0	110.8	C315 V316	C315-S324 CarbonylContact C-O 3.56Å; C315-S324 WeakPolarHBondContact CA-O 3.47Å; V316-S324 WeakPolarHBondContact CB-OG 3.29Å; V316-S324 VanDerWaalsContact CG2-OG 3.23Å; V316-S324 WeakPolarHBondContact CG2-OG 3.46Å; V316-S324 PolarHBondContact N-O 3.31Å
325	V	98.6	Very high	97.7	Very high	29 Å²	29	49.9 Å²	49.9	18%	0.176	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.8	171.9	-176.4	0	0	0	0	108.5	T297 M302 L313 V322	T297-V325 HydrophobicContact CG2-CG2 4.14Å; M302-V325 HydrophobicContact CE-CB 4.13Å; M302-V325 HydrophobicContact CE-CG2 3.93Å; M302-V325 HydrophobicContact SD-CB 4.19Å; M302-V325 HydrophobicContact SD-CG1 3.95Å; M302-V325 HydrophobicContact SD-CG2 4.33Å; L313-V325 HydrophobicContact CB-CG1 3.69Å; L313-V325 HydrophobicContact CD1-CG1 3.73Å; L313-V325 HydrophobicContact CG-CG1 4.37Å; V322-V325 HydrophobicContact CG1-CG2 4.26Å
326	V	98.2	Very high	97.6	Very high	47 Å²	47	52.3 Å²	52.3	29%	0.285	32%	0.317	S	S	.	.			trans	-77.2	123.8	176.8	179.8	0	0	0	0	108.9	I292 Y303 P314 M328	I292-V326 HydrophobicContact CD1-CG2 4.03Å; I292-V326 HydrophobicContact CG1-CG2 4.29Å; I292-V326 HydrophobicContact CG2-CG2 4.02Å; Y303-V326 PolarHBondContact OH-O 3.38Å; P314-V326 HydrophobicContact CB-CB 4.02Å; P314-V326 HydrophobicContact CB-CG2 4.13Å; P314-V326 HydrophobicContact CG-CB 4.33Å; P314-V326 WeakPolarHBondContact O-CG2 3.48Å; P314-V326 PolarHBondContact O-N 3.29Å; V326-M328 HydrophobicContact CG1-CG 4.24Å; V326-M328 PolarHBondContact O-N 3.27Å; V326-M328 VanDerWaalsContact O-N 3.1Å
327	N	94.7	Very high	97.5	Very high	139 Å²	139	54.5 Å²	54.5	74%	0.743	33%	0.326	S	S	*	.			trans	-78	91.7	171.8	-64	-26	0	0	0	108.7
328	M	95.5	Very high	97.5	Very high	35 Å²	35	54.5 Å²	54.5	17%	0.172	33%	0.326	C	S	.	.			trans	-72.9	141.4	176.4	-68.8	-163.4	68	0	0	110.8	W210 L212 V222 Y303 P314 V326 L330	W210-M328 HydrophobicContact CG-CE 4.45Å; L212-M328 HydrophobicContact CD1-SD 3.71Å; V222-M328 HydrophobicContact CB-CE 4.43Å; V222-M328 HydrophobicContact CG1-CE 3.78Å; Y303-M328 PolarHBondContact OH-N 2.81Å; P314-M328 HydrophobicContact CG-CG 3.85Å; P314-M328 HydrophobicContact CG-SD 3.37Å; P314-M328 WeakPolarHBondContact CG-SD 3.25Å; V326-M328 HydrophobicContact CG1-CG 4.24Å; V326-M328 PolarHBondContact O-N 3.27Å; V326-M328 VanDerWaalsContact O-N 3.1Å; M328-L330 VanDerWaalsContact C-N 3.33Å; M328-L330 HydrophobicContact CB-CD2 3.85Å; M328-L330 HydrophobicContact CB-CG 3.98Å; M328-L330 HydrophobicContact CE-CD2 4.31Å; M328-L330 PolarHBondContact O-N 2.95Å; M328-L330 VanDerWaalsContact O-N 3.14Å; M328-L330 HydrophobicContact SD-CD2 4.42Å
329	T	94.8	Very high	97.4	Very high	135 Å²	135	56.4 Å²	56.4	83%	0.828	33%	0.333	S	S	*	.			trans	-82.9	81.7	168.6	51.2	0	0	0	0	108.8
330	L	96.9	Very high	97.4	Very high	27 Å²	27	56.3 Å²	56.3	14%	0.141	34%	0.336	C	S	.	.			trans	-81.5	152.1	177.8	-60.6	-179	0	0	0	111	L212 V222 Y303 M328 E334 V335 L338	L212-L330 HydrophobicContact CD1-CD2 4.41Å; V222-L330 HydrophobicContact CB-CD2 4.42Å; V222-L330 HydrophobicContact CG1-CD2 3.58Å; V222-L330 HydrophobicContact CG2-CD2 3.87Å; Y303-L330 HydrophobicContact CD1-CD1 4Å; Y303-L330 HydrophobicContact CE1-CD1 3.74Å; Y303-L330 HydrophobicContact CE1-CG 4.11Å; M328-L330 VanDerWaalsContact C-N 3.33Å; M328-L330 HydrophobicContact CB-CD2 3.85Å; M328-L330 HydrophobicContact CB-CG 3.98Å; M328-L330 HydrophobicContact CE-CD2 4.31Å; M328-L330 PolarHBondContact O-N 2.95Å; M328-L330 VanDerWaalsContact O-N 3.14Å; M328-L330 HydrophobicContact SD-CD2 4.42Å; L330-E334 WeakPolarHBondContact CA-OE2 3.45Å; L330-E334 HydrophobicContact CB-CB 4.01Å; L330-E334 HydrophobicContact CD2-CB 4.41Å; L330-V335 HydrophobicContact CB-CG2 3.73Å; L330-V335 HydrophobicContact CD1-CG2 4.35Å; L330-L338 HydrophobicContact CD1-CD2 4.15Å
331	T	97.3	Very high	97.2	Very high	52 Å²	52	55 Å²	55	32%	0.319	32%	0.322	S	S	.	.			trans	-71.6	161.4	168.8	69.8	0	0	0	0	110.9	E333 E334 V335	T331-E333 PolarHBondContact O-N 2.99Å; T331-E334 PolarHBondContact N-OE2 3.33Å; T331-E334 PolarHBondContact O-N 3.46Å; T331-E334 VanDerWaalsContact O-N 3.15Å; T331-E334 VanDerWaalsContact OG1-CG 3.3Å; T331-E334 WeakPolarHBondContact OG1-CG 3.42Å; T331-E334 PolarHBondContact OG1-N 2.84Å; T331-E334 VanDerWaalsContact OG1-N 3.17Å; T331-E334 PolarHBondContact OG1-OE2 3.14Å; T331-V335 WeakPolarHBondContact O-CG2 3.45Å; T331-V335 PolarHBondContact O-N 3.37Å
332	D	97.4	Very high	97.1	Very high	149 Å²	149	55.1 Å²	55.1	80%	0.797	32%	0.323	S	S	*	.	H	α-helix	trans	-58.1	-34.2	177.1	-66.8	-25.6	0	0	0	112.2	A336	D332-A336 WeakPolarHBondContact O-CB 3.19Å; D332-A336 PolarHBondContact O-N 3.28Å
333	E	96.1	Very high	96.9	Very high	131 Å²	131	58.8 Å²	58.8	61%	0.612	34%	0.342	S	S	*	.	H	α-helix	trans	-68.9	-45.9	175.7	-174	177.5	-178.8	0	0	111.9	T331 V335 A336 Q337	T331-E333 PolarHBondContact O-N 2.99Å; E333-V335 VanDerWaalsContact C-N 3.3Å; E333-V335 PolarHBondContact O-N 3.43Å; E333-A336 PolarHBondContact O-N 3.12Å; E333-Q337 WeakPolarHBondContact O-CG 3.29Å; E333-Q337 PolarHBondContact O-N 3.27Å
334	E	97.6	Very high	96.6	Very high	10 Å²	10	58.7 Å²	58.7	5%	0.047	34%	0.336	C	S	.	.	H	α-helix	trans	-62.2	-38.4	176.2	-71.9	166.6	163.5	0	0	111.2	V220 V222 W223 S224 L330 T331 L338	V220-E334 HydrophobicContact CG1-CB 4.46Å; V222-E334 WeakPolarHBondContact CA-OE1 3.27Å; W223-E334 PolarHBondContact N-OE1 2.83Å; W223-E334 VanDerWaalsContact N-OE1 3.12Å; S224-E334 WeakPolarHBondContact CB-OE1 3.42Å; S224-E334 PolarHBondContact N-OE1 3.26Å; S224-E334 VanDerWaalsContact N-OE1 3.09Å; S224-E334 VanDerWaalsContact OG-CD 3.25Å; S224-E334 PolarHBondContact OG-OE1 3Å; S224-E334 PolarHBondContact OG-OE2 3.2Å; L330-E334 WeakPolarHBondContact CA-OE2 3.45Å; L330-E334 HydrophobicContact CB-CB 4.01Å; L330-E334 HydrophobicContact CD2-CB 4.41Å; T331-E334 PolarHBondContact N-OE2 3.33Å; T331-E334 PolarHBondContact O-N 3.46Å; T331-E334 VanDerWaalsContact O-N 3.15Å; T331-E334 VanDerWaalsContact OG1-CG 3.3Å; T331-E334 WeakPolarHBondContact OG1-CG 3.42Å; T331-E334 PolarHBondContact OG1-N 2.84Å; T331-E334 VanDerWaalsContact OG1-N 3.17Å; T331-E334 PolarHBondContact OG1-OE2 3.14Å; E334-L338 WeakPolarHBondContact O-CB 3.46Å; E334-L338 PolarHBondContact O-N 2.9Å
335	V	98.1	Very high	96.4	Very high	30 Å²	30	55.9 Å²	55.9	18%	0.182	32%	0.316	C	S	.	.	H	α-helix	trans	-64.1	-45.1	172.9	172.4	0	0	0	0	111.2	Y303 L330 T331 E333 Q337 L338 Q339	Y303-V335 HydrophobicContact CD1-CG2 4.28Å; L330-V335 HydrophobicContact CB-CG2 3.73Å; L330-V335 HydrophobicContact CD1-CG2 4.35Å; T331-V335 WeakPolarHBondContact O-CG2 3.45Å; T331-V335 PolarHBondContact O-N 3.37Å; E333-V335 VanDerWaalsContact C-N 3.3Å; E333-V335 PolarHBondContact O-N 3.43Å; V335-Q337 VanDerWaalsContact C-N 3.35Å; V335-Q337 PolarHBondContact O-N 3.37Å; V335-L338 WeakPolarHBondContact O-CB 3.45Å; V335-L338 PolarHBondContact O-N 3.29Å; V335-Q339 HydrophobicContact CG1-CG 4.44Å; V335-Q339 WeakPolarHBondContact O-CG 3.27Å; V335-Q339 PolarHBondContact O-N 2.87Å
336	A	98.1	Very high	96.2	Very high	52 Å²	52	57.6 Å²	57.6	43%	0.43	32%	0.319	S	S	.	.	H	α-helix	trans	-62.8	-40.8	178.7	0	0	0	0	0	112	D332 E333 Q339 A340	D332-A336 WeakPolarHBondContact O-CB 3.19Å; D332-A336 PolarHBondContact O-N 3.28Å; E333-A336 PolarHBondContact O-N 3.12Å; A336-Q339 PolarHBondContact O-N 2.87Å; A336-A340 PolarHBondContact O-N 3.39Å
337	Q	97.2	Very high	95.9	Very high	69 Å²	69	59.1 Å²	59.1	32%	0.322	33%	0.326	S	S	.	.	H	α-helix	trans	-63.2	-43.7	174.4	-68.8	176.9	11.3	0	0	111.3	V220 E333 V335 Q339 A340 S341	V220-Q337 HydrophobicContact CG1-CB 4.08Å; V220-Q337 HydrophobicContact CG2-CB 3.8Å; E333-Q337 WeakPolarHBondContact O-CG 3.29Å; E333-Q337 PolarHBondContact O-N 3.27Å; V335-Q337 VanDerWaalsContact C-N 3.35Å; V335-Q337 PolarHBondContact O-N 3.37Å; Q337-Q339 VanDerWaalsContact C-N 3.33Å; Q337-Q339 PolarHBondContact O-N 2.88Å; Q337-A340 WeakPolarHBondContact O-CB 3.34Å; Q337-A340 PolarHBondContact O-N 3.2Å; Q337-A340 VanDerWaalsContact O-N 3.13Å; Q337-S341 PolarHBondContact O-N 2.91Å; Q337-S341 PolarHBondContact O-OG 3.36Å; Q337-S341 VanDerWaalsContact O-OG 3.08Å
338	L	97.4	Very high	95.6	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-61.2	-41.9	177.4	-170.9	67.7	0	0	0	112.2	Y303 I305 L311 L313 L330 E334 V335 A340 S341 A342	Y303-L338 HydrophobicContact CD2-CD2 3.63Å; Y303-L338 HydrophobicContact CE2-CD2 4.26Å; Y303-L338 HydrophobicContact CG-CD2 3.8Å; I305-L338 HydrophobicContact CD1-CG 4.35Å; L311-L338 HydrophobicContact CD1-CD1 3.69Å; L311-L338 HydrophobicContact CD1-CG 4.47Å; L311-L338 HydrophobicContact CD2-CD1 4.23Å; L313-L338 HydrophobicContact CD2-CD1 4.47Å; L313-L338 HydrophobicContact CD2-CD2 4.08Å; L330-L338 HydrophobicContact CD1-CD2 4.15Å; E334-L338 WeakPolarHBondContact O-CB 3.46Å; E334-L338 PolarHBondContact O-N 2.9Å; V335-L338 WeakPolarHBondContact O-CB 3.45Å; V335-L338 PolarHBondContact O-N 3.29Å; L338-A340 VanDerWaalsContact C-N 3.35Å; L338-S341 PolarHBondContact O-N 3.46Å; L338-A342 PolarHBondContact O-N 2.91Å
339	Q	97.9	Very high	95.4	Very high	70 Å²	70	52.1 Å²	52.1	33%	0.327	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-39	174.2	-71.4	171.7	-7	0	0	111.7	Y303 I305 V335 A336 Q337 A342 N343	Y303-Q339 PolarHBondContact O-NE2 3.23Å; I305-Q339 HydrophobicContact CG1-CG 4.31Å; V335-Q339 HydrophobicContact CG1-CG 4.44Å; V335-Q339 WeakPolarHBondContact O-CG 3.27Å; V335-Q339 PolarHBondContact O-N 2.87Å; A336-Q339 PolarHBondContact O-N 2.87Å; Q337-Q339 VanDerWaalsContact C-N 3.33Å; Q337-Q339 PolarHBondContact O-N 2.88Å; Q339-A342 WeakPolarHBondContact O-CB 3.34Å; Q339-A342 PolarHBondContact O-N 2.9Å; Q339-N343 VanDerWaalsContact O-CG 3.25Å; Q339-N343 PolarHBondContact O-N 3.05Å; Q339-N343 PolarHBondContact O-ND2 3.4Å
340	A	96.7	Very high	95.2	Very high	50 Å²	50	52.5 Å²	52.5	41%	0.413	28%	0.275	S	S	.	.	H	α-helix	trans	-64.3	-41.1	175.7	0	0	0	0	0	112.4	A336 Q337 L338 A342 N343 T344	A336-A340 PolarHBondContact O-N 3.39Å; Q337-A340 WeakPolarHBondContact O-CB 3.34Å; Q337-A340 PolarHBondContact O-N 3.2Å; Q337-A340 VanDerWaalsContact O-N 3.13Å; L338-A340 VanDerWaalsContact C-N 3.35Å; A340-A342 VanDerWaalsContact C-N 3.34Å; A340-N343 PolarHBondContact O-N 3.16Å; A340-T344 PolarHBondContact O-N 2.91Å; A340-T344 PolarHBondContact O-OG1 3.49Å
341	S	95.3	Very high	94.8	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-60.6	-44.5	172	-44.6	0	0	0	0	110.9	T218 Q337 L338 N343 T344 L345	T218-S341 PolarHBondContact O-OG 2.89Å; Q337-S341 PolarHBondContact O-N 2.91Å; Q337-S341 PolarHBondContact O-OG 3.36Å; Q337-S341 VanDerWaalsContact O-OG 3.08Å; L338-S341 PolarHBondContact O-N 3.46Å; S341-N343 PolarHBondContact O-N 2.93Å; S341-T344 PolarHBondContact O-N 3.46Å; S341-L345 WeakPolarHBondContact O-CG 3.37Å; S341-L345 PolarHBondContact O-N 2.9Å
342	A	96.5	Very high	94.4	Very high	2 Å²	2	53.8 Å²	53.8	2%	0.017	28%	0.28	C	S	.	.	H	α-helix	trans	-60.8	-43.9	178.4	0	0	0	0	0	112.3	I305 L311 L338 Q339 A340 L345 W346	I305-A342 HydrophobicContact CD1-CB 3.77Å; I305-A342 HydrophobicContact CG1-CB 3.97Å; I305-A342 HydrophobicContact CG2-CB 3.98Å; L311-A342 HydrophobicContact CD2-CB 3.77Å; L338-A342 PolarHBondContact O-N 2.91Å; Q339-A342 WeakPolarHBondContact O-CB 3.34Å; Q339-A342 PolarHBondContact O-N 2.9Å; A340-A342 VanDerWaalsContact C-N 3.34Å; A342-L345 PolarHBondContact O-N 2.92Å; A342-W346 WeakPolarHBondContact O-CB 3.33Å; A342-W346 PolarHBondContact O-N 2.83Å
343	N	94.9	Very high	93.7	Very high	89 Å²	89	55.4 Å²	55.4	48%	0.476	28%	0.275	S	S	.	.	H	α-helix	trans	-62.8	-43.8	177	-70.3	-26.1	0	0	0	111.8	Q339 A340 S341 L345 W346 D347	Q339-N343 VanDerWaalsContact O-CG 3.25Å; Q339-N343 PolarHBondContact O-N 3.05Å; Q339-N343 PolarHBondContact O-ND2 3.4Å; A340-N343 PolarHBondContact O-N 3.16Å; S341-N343 PolarHBondContact O-N 2.93Å; N343-L345 VanDerWaalsContact C-N 3.32Å; N343-L345 PolarHBondContact O-N 3.48Å; N343-W346 PolarHBondContact O-N 3.41Å; N343-D347 PolarHBondContact O-N 3.38Å
344	T	91.6	Very high	92.8	Very high	53 Å²	53	55.3 Å²	55.3	33%	0.325	28%	0.279	S	S	.	.	H	α-helix	trans	-58.9	-45.3	177.1	-58.7	0	0	0	0	111.3	A340 S341 I348	A340-T344 PolarHBondContact O-N 2.91Å; A340-T344 PolarHBondContact O-OG1 3.49Å; S341-T344 PolarHBondContact O-N 3.46Å; T344-I348 WeakPolarHBondContact O-CG1 3.43Å; T344-I348 PolarHBondContact O-N 2.87Å
345	L	93.9	Very high	91.8	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-68	-37.3	177.3	-70.9	170.9	0	0	0	112.1	D163 V164 E214 V309 Y310 L311 S341 A342 N343 I348 Q349	D163-L345 HydrophobicContact CB-CD1 3.91Å; D163-L345 HydrophobicContact CB-CD2 3.92Å; V164-L345 HydrophobicContact CG2-CD2 3.63Å; E214-L345 HydrophobicContact CB-CD1 3.92Å; E214-L345 HydrophobicContact CB-CG 4.29Å; E214-L345 HydrophobicContact CG-CD1 4.24Å; E214-L345 HydrophobicContact CG-CD2 4.03Å; E214-L345 HydrophobicContact CG-CG 4.22Å; V309-L345 HydrophobicContact CG1-CB 3.79Å; V309-L345 HydrophobicContact CG1-CD1 4Å; Y310-L345 WeakPolarHBondContact O-CD1 3.08Å; L311-L345 HydrophobicContact CB-CD1 3.95Å; S341-L345 WeakPolarHBondContact O-CG 3.37Å; S341-L345 PolarHBondContact O-N 2.9Å; A342-L345 PolarHBondContact O-N 2.92Å; N343-L345 VanDerWaalsContact C-N 3.32Å; N343-L345 PolarHBondContact O-N 3.48Å; L345-I348 PolarHBondContact O-N 3.36Å; L345-Q349 VanDerWaalsContact C-NE2 3.3Å; L345-Q349 WeakPolarHBondContact O-CB 3.35Å; L345-Q349 VanDerWaalsContact O-CG 3.28Å; L345-Q349 WeakPolarHBondContact O-CG 3.44Å; L345-Q349 PolarHBondContact O-N 2.88Å; L345-Q349 PolarHBondContact O-NE2 3.49Å
346	W	94.1	Very high	91.4	Very high	65 Å²	65	59.9 Å²	59.9	25%	0.246	30%	0.301	C	S	.	.	H	α-helix	trans	-65.3	-43.5	178.4	179	-120.1	0	0	0	112.3	D307 V309 A342 N343 I348 Q349 R350	D307-W346 HydrophobicContact CB-CD2 3.73Å; D307-W346 HydrophobicContact CB-CE3 3.76Å; D307-W346 HydrophobicContact CB-CG 4.17Å; D307-W346 HydrophobicContact CB-CH2 4.4Å; D307-W346 HydrophobicContact CB-CZ2 4.38Å; D307-W346 HydrophobicContact CB-CZ3 4.11Å; D307-W346 WeakPolarHBondContact OD1-CZ2 3.31Å; V309-W346 HydrophobicContact CG2-CB 3.88Å; V309-W346 HydrophobicContact CG2-CD2 4.48Å; V309-W346 HydrophobicContact CG2-CE3 3.93Å; A342-W346 WeakPolarHBondContact O-CB 3.33Å; A342-W346 PolarHBondContact O-N 2.83Å; N343-W346 PolarHBondContact O-N 3.41Å; W346-I348 PolarHBondContact O-N 3.47Å; W346-Q349 HydrophobicContact CE3-CB 4.37Å; W346-Q349 PolarHBondContact O-N 3.34Å; W346-R350 PolarHBondContact O-N 3.19Å
347	D	91.3	Very high	91.1	Very high	80 Å²	80	60.3 Å²	60.3	43%	0.428	29%	0.294	S	S	.	.	H	α-helix	trans	-59.4	-38.6	178	-80.4	-32.4	0	0	0	111.6	N343 R350	N343-D347 PolarHBondContact O-N 3.38Å; D347-R350 IonicContact OD1-CZ 3.62Å; D347-R350 IonicContact OD1-NH1 3.71Å; D347-R350 IonicContact OD1-NH2 2.88Å; D347-R350 PolarHBondContact OD1-NH2 3.4Å
348	I	89.4	Confident	90.8	Very high	20 Å²	20	59.8 Å²	59.8	10%	0.103	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-45.9	173.6	-61.2	167.4	0	0	0	110.7	R128 L129 V132 V164 T344 L345 W346 D351 L352	R128-I348 HydrophobicContact CG-CD1 4.2Å; L129-I348 HydrophobicContact CD1-CG2 4.38Å; V132-I348 HydrophobicContact CG2-CG2 4.17Å; V164-I348 HydrophobicContact CG1-CG2 4.34Å; V164-I348 HydrophobicContact CG2-CG2 4.29Å; T344-I348 WeakPolarHBondContact O-CG1 3.43Å; T344-I348 PolarHBondContact O-N 2.87Å; L345-I348 PolarHBondContact O-N 3.36Å; W346-I348 PolarHBondContact O-N 3.47Å; I348-D351 PolarHBondContact O-N 3.49Å; I348-L352 WeakPolarHBondContact O-CG 3.39Å
349	Q	91.1	Very high	90.4	Very high	7 Å²	7	63.2 Å²	63.2	3%	0.033	31%	0.309	C	S	.	.	H	α-helix	trans	-63.9	-40	-176	-79.2	168.1	79.9	0	0	113.2	V164 Y167 E308 L345 W346 D351 L352	V164-Q349 HydrophobicContact CG1-CG 4.14Å; Y167-Q349 HydrophobicContact CD1-CG 4.01Å; Y167-Q349 HydrophobicContact CE1-CG 4.33Å; Y167-Q349 HydrophobicContact CG-CG 4.34Å; E308-Q349 PolarHBondContact O-OE1 2.92Å; L345-Q349 VanDerWaalsContact C-NE2 3.3Å; L345-Q349 WeakPolarHBondContact O-CB 3.35Å; L345-Q349 VanDerWaalsContact O-CG 3.28Å; L345-Q349 WeakPolarHBondContact O-CG 3.44Å; L345-Q349 PolarHBondContact O-N 2.88Å; L345-Q349 PolarHBondContact O-NE2 3.49Å; W346-Q349 HydrophobicContact CE3-CB 4.37Å; W346-Q349 PolarHBondContact O-N 3.34Å; Q349-D351 PolarHBondContact O-N 3.11Å; Q349-L352 HydrophobicContact CG-CD1 4.45Å; Q349-L352 WeakPolarHBondContact O-CB 3.36Å; Q349-L352 PolarHBondContact O-N 3.36Å
350	R	90	Very high	89.9	Confident	143 Å²	143	62.8 Å²	62.8	54%	0.54	31%	0.308	S	S	.	.	H	α-helix	trans	-63.2	-29.3	-179.8	-174.9	179.3	63.4	-139.7	-15.7	112.5	W346 D347 L352	W346-R350 PolarHBondContact O-N 3.19Å; D347-R350 IonicContact OD1-CZ 3.62Å; D347-R350 IonicContact OD1-NH1 3.71Å; D347-R350 IonicContact OD1-NH2 2.88Å; D347-R350 PolarHBondContact OD1-NH2 3.4Å; R350-L352 VanDerWaalsContact C-N 3.35Å
351	D	89.1	Confident	89.4	Confident	85 Å²	85	63.7 Å²	63.7	46%	0.455	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	-4.2	-178.4	-68.7	-11	0	0	0	113	L129 I348 Q349	L129-D351 HydrophobicContact CD1-CB 3.97Å; L129-D351 HydrophobicContact CD2-CB 4.21Å; I348-D351 PolarHBondContact O-N 3.49Å; Q349-D351 PolarHBondContact O-N 3.11Å
352	L	88.4	Confident	89	Confident	21 Å²	21	68 Å²	68	11%	0.11	32%	0.321	C	S	.	.			trans	-71	137.8	176.8	-60	177.8	0	0	0	111.3	L129 V132 V136 V164 V168 I348 Q349 R350 I355	L129-L352 HydrophobicContact CD1-CD2 4.09Å; V132-L352 HydrophobicContact CB-CD2 4.19Å; V132-L352 HydrophobicContact CG1-CD1 4.11Å; V132-L352 HydrophobicContact CG1-CD2 3.43Å; V132-L352 VanDerWaalsContact CG1-CD2 3.43Å; V132-L352 HydrophobicContact CG1-CG 4.42Å; V136-L352 HydrophobicContact CG2-CD2 4.46Å; V164-L352 HydrophobicContact CG1-CD1 3.72Å; V168-L352 HydrophobicContact CG2-CD1 4.01Å; I348-L352 WeakPolarHBondContact O-CG 3.39Å; Q349-L352 HydrophobicContact CG-CD1 4.45Å; Q349-L352 WeakPolarHBondContact O-CB 3.36Å; Q349-L352 PolarHBondContact O-N 3.36Å; R350-L352 VanDerWaalsContact C-N 3.35Å; L352-I355 HydrophobicContact CB-CD1 3.31Å; L352-I355 HydrophobicContact CB-CG1 4.29Å; L352-I355 HydrophobicContact CD1-CD1 3.39Å; L352-I355 HydrophobicContact CG-CD1 3.92Å
353	R	82.1	Confident	88.4	Confident	183 Å²	183	73.1 Å²	73.1	69%	0.691	35%	0.345	S	S	*	.			trans	-107.8	147.2	-179.6	-60.3	-178.4	-173.5	178.5	1.3	111.3	Q133	Q133-R353 PolarHBondContact NE2-O 3.47Å
354	D	77.9	Confident	87.9	Confident	128 Å²	128	71.8 Å²	71.8	68%	0.684	33%	0.334	S	S	*	.			trans	59.5	47	169.3	-54	-40.6	0	0	0	113.1	K140	K140-D354 WeakPolarHBondContact CE-O 3.48Å; K140-D354 PolarHBondContact NZ-O 2.92Å
355	I	75.9	Confident	87.6	Confident	76 Å²	76	73.5 Å²	73.5	39%	0.39	33%	0.334	S	S	.	.			trans	-99.9	0	177.3	-69.5	175.4	0	0	0	111.4	V136 Y167 V168 K171 L172 L352	V136-I355 HydrophobicContact CG1-CG1 3.96Å; V136-I355 HydrophobicContact CG2-CD1 4.31Å; Y167-I355 HydrophobicContact CE1-CD1 4.44Å; V168-I355 HydrophobicContact CG2-CD1 3.78Å; K171-I355 HydrophobicContact CB-CG2 3.31Å; K171-I355 HydrophobicContact CG-CG2 3.74Å; L172-I355 WeakPolarHBondContact CD2-OXT 3.28Å; L352-I355 HydrophobicContact CB-CD1 3.31Å; L352-I355 HydrophobicContact CB-CG1 4.29Å; L352-I355 HydrophobicContact CD1-CD1 3.39Å; L352-I355 HydrophobicContact CG-CD1 3.92Å

Retrieved 355 of 355 residues in 2629.7 ms (Link to these results)

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