A0A096M8W5_POEFO Loading...

D-ribitol-5-phosphate cytidylyltransferase

Cytidylyltransferase required for protein O-linked mannosylation. Catalyzes the formation of CDP-ribitol nucleotide sugar from D-ribitol 5-phosphate. CDP-ribitol is a substrate of FKTN during the biosynthesis of the phosphorylated O-mannosyl trisaccharide (N-acetylgalactosamine-beta-3-N-acetylglucosamine-beta-4-(phosphate-6-)mannose), a carbohydrate structure present in alpha-dystroglycan (DAG1), which is required for binding laminin G-like domain-containing extracellular proteins with high affinity. Shows activity toward other pentose phosphate sugars and mediates formation of CDP-ribulose or CDP-ribose using CTP and ribulose-5-phosphate or ribose-5-phosphate, respectively. Not involved in dolichol production.

AlphaFold DB , UniProt , Accession A0A096M8W5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 332 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	34	Very low	31	Very low	225 Å²	225	148.8 Å²	148.8	100%	1.108	79%	0.79	S	S	*	*				0	141.1	0	-73.1	147.1	166.5	0	0	107.3
2	E	27.6	Very low	30.7	Very low	177 Å²	177	149 Å²	149	83%	0.827	79%	0.792	S	S	*	*			trans	34.6	130.7	135.8	-66.8	171.9	145.3	0	0	118.9
3	V	30.1	Very low	30.5	Very low	133 Å²	133	145.4 Å²	145.4	81%	0.806	79%	0.786	S	S	*	*			cis	-154.1	155.4	9.2	-177.2	0	0	0	0	107.9
4	S	30.2	Very low	30.5	Very low	101 Å²	101	146.3 Å²	146.3	71%	0.706	78%	0.782	S	S	*	*			cis	-163.4	154.3	-40.5	-83.1	0	0	0	0	107.9
5	P	47.9	Very low	30.5	Very low	118 Å²	118	147.2 Å²	147.2	77%	0.766	78%	0.78	S	S	*	*			trans	-95.9	156.4	-173.5	37.2	-35.5	0	0	0	114.7
6	V	30.9	Very low	30.4	Very low	149 Å²	149	147.4 Å²	147.4	90%	0.903	78%	0.782	S	S	*	*			trans	-140.3	156.2	166.1	-176.2	0	0	0	0	110
7	Y	27.4	Very low	30.5	Very low	217 Å²	217	152.7 Å²	152.7	85%	0.851	79%	0.788	S	S	*	*			trans	-125.1	-175.3	-162.6	-124.6	-99.2	0	0	0	112.9
8	M	27.9	Very low	30.8	Very low	156 Å²	156	150.4 Å²	150.4	77%	0.768	79%	0.785	S	S	*	*			trans	93.6	143.5	164.2	-56.8	179.5	150.8	0	0	117.8
9	Q	29.2	Very low	30.7	Very low	143 Å²	143	147.5 Å²	147.5	67%	0.668	79%	0.785	S	S	*	*			cis	-154.8	147.8	-21.3	-107.3	176	-73.8	0	0	106
10	S	27.2	Very low	30.5	Very low	75 Å²	75	149.6 Å²	149.6	52%	0.524	78%	0.783	S	S	.	*				58	127.3	76.5	122.9	0	0	0	0	112.2
11	D	28.2	Very low	30.6	Very low	143 Å²	143	148.7 Å²	148.7	77%	0.765	79%	0.786	S	S	*	*			cis	-143.1	-174.4	-4.8	-62.5	-66.7	0	0	0	107.4
12	D	27.9	Very low	30.3	Very low	151 Å²	151	146.2 Å²	146.2	81%	0.807	76%	0.764	S	S	*	*			cis	-150	-155.6	11.3	-162.5	26.3	0	0	0	107.2
13	S	28.4	Very low	30.3	Very low	102 Å²	102	144.3 Å²	144.3	71%	0.713	76%	0.764	S	S	*	*			cis	-160.3	-168.1	8.5	54.8	0	0	0	0	110.6
14	E	30.2	Very low	30.1	Very low	158 Å²	158	145.9 Å²	145.9	74%	0.738	76%	0.761	S	S	*	*			trans	-103.6	160.7	-169.2	-98.3	-157.6	101.1	0	0	117.9
15	Q	29.8	Very low	30	Very low	160 Å²	160	146.7 Å²	146.7	75%	0.748	76%	0.763	S	S	*	*			trans	58.1	113.1	150.7	-67.8	166.5	36.6	0	0	121.1
16	D	29.5	Very low	29.4	Very low	151 Å²	151	148.1 Å²	148.1	81%	0.807	77%	0.77	S	S	*	*				-153.5	158.6	111.9	-156.3	-1.7	0	0	0	112.2
17	R	32	Very low	29.2	Very low	237 Å²	237	144.5 Å²	144.5	89%	0.894	76%	0.763	S	S	*	*			trans	-143.1	128.9	166	-84.7	-170.9	-179.6	-179.9	3.4	109.4
18	P	35.5	Very low	29.3	Very low	112 Å²	112	143 Å²	143	73%	0.727	76%	0.764	S	S	*	*				-140	152.8	128.6	30.2	-14.1	0	0	0	116.7
19	A	28.6	Very low	29.3	Very low	95 Å²	95	140.2 Å²	140.2	79%	0.785	77%	0.766	S	S	*	*			trans	40.6	115.1	146.3	0	0	0	0	0	122
20	Y	27.1	Very low	29.2	Very low	189 Å²	189	144.5 Å²	144.5	74%	0.741	78%	0.776	S	S	*	*			trans	-46.7	151.5	144.9	-89.3	-74.6	0	0	0	112.8	R22	Y20-R22 HydrophobicContact CD1-CG 3.73Å; Y20-R22 HydrophobicContact CE1-CG 3.79Å
21	P	33.3	Very low	29.4	Very low	130 Å²	130	149.8 Å²	149.8	84%	0.844	79%	0.789	S	S	*	*				-132.8	166.5	67.3	34.9	-18.3	0	0	0	117.4
22	R	27.6	Very low	29.5	Very low	173 Å²	173	146.7 Å²	146.7	65%	0.653	78%	0.779	S	S	*	*			trans	-82.5	146.7	-168.2	-54.9	171	-179.7	178.5	-3.7	112.6	Y20 F24	Y20-R22 HydrophobicContact CD1-CG 3.73Å; Y20-R22 HydrophobicContact CE1-CG 3.79Å; R22-F24 HydrophobicContact CB-CE2 4.48Å
23	V	27.3	Very low	29.7	Very low	138 Å²	138	146 Å²	146	84%	0.836	78%	0.775	S	S	*	*			trans	-125.1	127	150.4	179.5	0	0	0	0	107.4
24	F	26	Very low	30	Very low	165 Å²	165	148.6 Å²	148.6	72%	0.724	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-101	119.3	173	-77.3	-75.3	0	0	0	109.5	R22	R22-F24 HydrophobicContact CB-CE2 4.48Å
25	P	27.9	Very low	30.4	Very low	118 Å²	118	148.4 Å²	148.4	77%	0.766	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-65.7	144.7	163.9	-19.2	33.1	0	0	0	110.9	G27	P25-G27 PolarHBondContact O-N 2.93Å
26	T	35.1	Very low	31.1	Very low	149 Å²	149	147.8 Å²	147.8	91%	0.914	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-59.7	124	177.9	46.3	0	0	0	0	112.5
27	G	26	Very low	32	Very low	72 Å²	72	145.1 Å²	145.1	74%	0.742	77%	0.772	S	S	*	*			trans	-109.1	135.7	164.7	0	0	0	0	0	110.5	P25 A29	P25-G27 PolarHBondContact O-N 2.93Å; G27-A29 PolarHBondContact O-N 2.95Å
28	E	29.9	Very low	33.3	Very low	186 Å²	186	137 Å²	137	87%	0.869	76%	0.763	S	S	*	*			trans	-65.9	119.7	-175.5	-62.2	178.9	131.8	0	0	112	R30	E28-R30 VanDerWaalsContact C-N 3.34Å; E28-R30 PolarHBondContact O-N 3.1Å
29	A	28.7	Very low	35.4	Very low	98 Å²	98	134.8 Å²	134.8	81%	0.81	74%	0.744	S	S	*	*			trans	-72	89.3	171.9	0	0	0	0	0	110	G27 K31	G27-A29 PolarHBondContact O-N 2.95Å; A29-K31 VanDerWaalsContact C-N 3.35Å; A29-K31 PolarHBondContact O-N 3.21Å
30	R	27.7	Very low	38.1	Very low	233 Å²	233	134 Å²	134	88%	0.879	73%	0.733	S	S	*	*			trans	-57.4	97.4	164.5	-71.7	-176.2	178.5	-178	-0.4	108.9	E28 S32	E28-R30 VanDerWaalsContact C-N 3.34Å; E28-R30 PolarHBondContact O-N 3.1Å; R30-S32 PolarHBondContact O-N 3.09Å
31	K	30.8	Very low	41.3	Very low	185 Å²	185	125.7 Å²	125.7	80%	0.804	70%	0.702	S	S	*	*			trans	-63.5	104.9	160.7	-75.4	-172.9	173.3	-173.2	0	107.1	A29 D33	A29-K31 VanDerWaalsContact C-N 3.35Å; A29-K31 PolarHBondContact O-N 3.21Å; K31-D33 PolarHBondContact O-N 3.08Å; K31-D33 VanDerWaalsContact O-N 3.14Å
32	S	29.7	Very low	44.1	Very low	79 Å²	79	126 Å²	126	55%	0.552	70%	0.696	S	S	*	*			trans	-75.3	97.6	165.3	46.9	0	0	0	0	107.8	R30 H34	R30-S32 PolarHBondContact O-N 3.09Å; S32-H34 WeakPolarHBondContact CB-NE2 3.43Å; S32-H34 PolarHBondContact O-CD2 3.44Å; S32-H34 PolarHBondContact O-N 3.16Å; S32-H34 PolarHBondContact OG-CD2 2.99Å; S32-H34 PolarHBondContact OG-NE2 2.82Å
33	D	33.5	Very low	47.3	Very low	137 Å²	137	118.6 Å²	118.6	73%	0.733	67%	0.669	S	S	*	*			trans	-65.9	79.8	166.8	-71.8	-30.7	0	0	0	108.6	K31 L35	K31-D33 PolarHBondContact O-N 3.08Å; K31-D33 VanDerWaalsContact O-N 3.14Å; D33-L35 HydrophobicContact CB-CD1 4.41Å; D33-L35 PolarHBondContact O-N 2.8Å
34	H	34.5	Very low	50.5	Low	156 Å²	156	113.6 Å²	113.6	72%	0.722	64%	0.639	S	S	*	*			trans	-71.1	74.4	170.8	-71.6	-69.2	0	0	0	109.1	S32 K36	S32-H34 WeakPolarHBondContact CB-NE2 3.43Å; S32-H34 PolarHBondContact O-CD2 3.44Å; S32-H34 PolarHBondContact O-N 3.16Å; S32-H34 PolarHBondContact OG-CD2 2.99Å; S32-H34 PolarHBondContact OG-NE2 2.82Å; H34-K36 PolarHBondContact O-N 3.38Å
35	L	37.8	Very low	53.9	Low	154 Å²	154	105.8 Å²	105.8	81%	0.806	61%	0.605	S	S	*	*			trans	-51	109.9	148.9	-86.7	72.6	0	0	0	106.1	D33 A37	D33-L35 HydrophobicContact CB-CD1 4.41Å; D33-L35 PolarHBondContact O-N 2.8Å; L35-A37 PolarHBondContact O-N 3.3Å
36	K	43.9	Very low	57.2	Low	147 Å²	147	100.2 Å²	100.2	64%	0.639	57%	0.568	S	S	*	*			trans	-55.1	109.6	165.8	-88.6	-168.7	162.5	-166	0	106.3	H34 G38 D162	H34-K36 PolarHBondContact O-N 3.38Å; K36-G38 PolarHBondContact O-N 3.2Å; K36-D162 IonicContact NZ-OD1 2.75Å; K36-D162 PolarHBondContact NZ-OD1 2.9Å; K36-D162 IonicContact NZ-OD2 3.8Å; K36-D162 PolarHBondContact NZ-OD2 3.33Å
37	A	49.8	Very low	60.2	Low	94 Å²	94	93.1 Å²	93.1	78%	0.777	53%	0.525	S	S	*	.			trans	-55.4	118.2	166.8	0	0	0	0	0	106.7	L35 L39	L35-A37 PolarHBondContact O-N 3.3Å; A37-L39 PolarHBondContact O-N 3.12Å
38	G	59.8	Low	63.7	Low	68 Å²	68	89.7 Å²	89.7	70%	0.701	49%	0.49	S	S	*	.			trans	-56.3	114.6	-165.9	0	0	0	0	0	111	K36 C40	K36-G38 PolarHBondContact O-N 3.2Å; G38-C40 WeakPolarHBondContact O-CB 3.36Å; G38-C40 PolarHBondContact O-N 3.42Å
39	L	78.2	Confident	67	Low	64 Å²	64	80.8 Å²	80.8	34%	0.335	45%	0.448	S	S	.	.			trans	-61.4	111.1	176.1	-80.7	164	0	0	0	107.6	A37 W87 D162	A37-L39 PolarHBondContact O-N 3.12Å; L39-W87 PolarHBondContact O-NE1 2.87Å; L39-D162 HydrophobicContact CD1-CB 4.24Å; L39-D162 WeakPolarHBondContact CD1-OD1 3.28Å
40	C	86.6	Confident	70.2	Confident	79 Å²	79	77 Å²	77	53%	0.534	42%	0.415	S	S	.	.			trans	-145.6	141.5	-168.3	-170.2	0	0	0	0	110	G38	G38-C40 WeakPolarHBondContact O-CB 3.36Å; G38-C40 PolarHBondContact O-N 3.42Å
41	V	92.9	Very high	73.5	Confident	15 Å²	15	66.1 Å²	66.1	9%	0.091	38%	0.375	C	S	.	.			trans	-106.3	138.4	-178.4	-72	0	0	0	0	111.3	F43 V45 W87 A168	V41-F43 HydrophobicContact CB-CD1 3.7Å; V41-F43 HydrophobicContact CB-CE1 3.41Å; V41-F43 VanDerWaalsContact CB-CE1 3.41Å; V41-F43 HydrophobicContact CB-CE2 4.31Å; V41-F43 HydrophobicContact CB-CG 4.31Å; V41-F43 HydrophobicContact CB-CZ 3.75Å; V41-F43 HydrophobicContact CG1-CD1 4.37Å; V41-F43 HydrophobicContact CG1-CE1 3.57Å; V41-F43 HydrophobicContact CG1-CE2 4.46Å; V41-F43 HydrophobicContact CG1-CZ 3.63Å; V41-F43 HydrophobicContact CG2-CD1 4.5Å; V41-F43 HydrophobicContact CG2-CE1 4.38Å; V41-F43 HydrophobicContact CG2-CE2 4.48Å; V41-F43 HydrophobicContact CG2-CZ 4.37Å; V41-F43 PolarHBondContact O-N 3.16Å; V41-V45 HydrophobicContact CG2-CG2 3.82Å; V41-W87 HydrophobicContact CG2-CB 3.76Å; V41-W87 HydrophobicContact CG2-CD2 3.59Å; V41-W87 HydrophobicContact CG2-CE3 3.38Å; V41-W87 HydrophobicContact CG2-CG 3.77Å; V41-W87 HydrophobicContact CG2-CZ3 4.17Å; V41-A168 HydrophobicContact CG1-CB 4.47Å
42	D	93.1	Very high	76.2	Confident	136 Å²	136	58.3 Å²	58.3	73%	0.727	35%	0.347	S	S	*	.	S	Bend	trans	-76.4	17.7	179.7	65.9	-52.7	0	0	0	113.7	K172	D42-K172 IonicContact OD1-NZ 3.44Å; D42-K172 PolarHBondContact OD1-NZ 3.09Å; D42-K172 IonicContact OD2-NZ 3.46Å; D42-K172 PolarHBondContact OD2-NZ 3.42Å
43	F	94.1	Very high	78.8	Confident	18 Å²	18	56.9 Å²	56.9	8%	0.079	35%	0.345	C	S	.	.	S	Bend	trans	-145	148.1	-171.8	56.2	-84.2	0	0	0	112.6	V41 V45 K147 V148 A168 K172	V41-F43 HydrophobicContact CB-CD1 3.7Å; V41-F43 HydrophobicContact CB-CE1 3.41Å; V41-F43 VanDerWaalsContact CB-CE1 3.41Å; V41-F43 HydrophobicContact CB-CE2 4.31Å; V41-F43 HydrophobicContact CB-CG 4.31Å; V41-F43 HydrophobicContact CB-CZ 3.75Å; V41-F43 HydrophobicContact CG1-CD1 4.37Å; V41-F43 HydrophobicContact CG1-CE1 3.57Å; V41-F43 HydrophobicContact CG1-CE2 4.46Å; V41-F43 HydrophobicContact CG1-CZ 3.63Å; V41-F43 HydrophobicContact CG2-CD1 4.5Å; V41-F43 HydrophobicContact CG2-CE1 4.38Å; V41-F43 HydrophobicContact CG2-CE2 4.48Å; V41-F43 HydrophobicContact CG2-CZ 4.37Å; V41-F43 PolarHBondContact O-N 3.16Å; F43-V45 HydrophobicContact CD2-CG2 3.68Å; F43-V45 HydrophobicContact CE2-CG2 3.57Å; F43-V45 PolarHBondContact O-N 3.29Å; F43-K147 HydrophobicContact CB-CB 4.05Å; F43-K147 HydrophobicContact CB-CG 4.35Å; F43-K147 HydrophobicContact CD2-CB 4.2Å; F43-K147 HydrophobicContact CD2-CG 4.45Å; F43-V148 HydrophobicContact CD2-CB 4.27Å; F43-V148 HydrophobicContact CD2-CG2 4.04Å; F43-V148 HydrophobicContact CE2-CB 3.88Å; F43-V148 HydrophobicContact CE2-CG2 3.58Å; F43-A168 HydrophobicContact CE2-CB 4.35Å; F43-A168 HydrophobicContact CZ-CB 4.24Å; F43-A168 WeakPolarHBondContact CZ-O 3.44Å; F43-K172 HydrophobicContact CD1-CD 3.29Å; F43-K172 HydrophobicContact CD2-CD 4.31Å; F43-K172 HydrophobicContact CE1-CB 4.18Å; F43-K172 HydrophobicContact CE1-CD 3.23Å; F43-K172 HydrophobicContact CE1-CG 4.31Å; F43-K172 HydrophobicContact CE2-CB 4.08Å; F43-K172 HydrophobicContact CE2-CD 4.28Å; F43-K172 HydrophobicContact CG-CD 3.84Å; F43-K172 HydrophobicContact CZ-CB 3.8Å; F43-K172 HydrophobicContact CZ-CD 3.76Å; F43-K172 HydrophobicContact CZ-CG 4.42Å
44	P	94.3	Very high	80.9	Confident	33 Å²	33	54.2 Å²	54.2	21%	0.214	33%	0.334	C	S	.	.			trans	-68	125.7	-179.3	25.8	-32.7	0	0	0	111.3	P146 K147 V148	P44-P146 CarbonylContact O-C 3.55Å; P44-P146 WeakPolarHBondContact O-CA 3.42Å; P44-K147 HydrophobicContact CG-CB 4.31Å; P44-K147 PolarHBondContact O-N 3.16Å; P44-V148 PolarHBondContact O-N 3.17Å
45	V	97.2	Very high	82.8	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	139.5	176	-174.6	0	0	0	0	110.6	V41 F43 W87 I88 Q89 V148 I150 A168	V41-V45 HydrophobicContact CG2-CG2 3.82Å; F43-V45 HydrophobicContact CD2-CG2 3.68Å; F43-V45 HydrophobicContact CE2-CG2 3.57Å; F43-V45 PolarHBondContact O-N 3.29Å; V45-W87 HydrophobicContact CB-CE3 4.06Å; V45-W87 HydrophobicContact CB-CZ3 4.16Å; V45-W87 HydrophobicContact CG1-CE3 4.47Å; V45-W87 HydrophobicContact CG1-CZ3 4.08Å; V45-W87 HydrophobicContact CG2-CE3 3.99Å; V45-W87 HydrophobicContact CG2-CZ3 4.08Å; V45-I88 HydrophobicContact CG1-CG1 4.42Å; V45-Q89 PolarHBondContact O-N 2.81Å; V45-V148 WeakPolarHBondContact CA-O 3.47Å; V45-V148 HydrophobicContact CG1-CG1 4.48Å; V45-V148 HydrophobicContact CG2-CB 4.37Å; V45-I150 HydrophobicContact CG1-CD1 3.92Å; V45-I150 HydrophobicContact CG1-CG1 4.03Å; V45-A168 HydrophobicContact CG2-CB 4.49Å
46	S	97.9	Very high	84.7	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.007	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	158.7	170.9	-66.8	0	0	0	0	111.1	T90 V148 V149 I150	S46-T90 CarbonylContact C-O 3.56Å; S46-T90 WeakPolarHBondContact CA-O 3.27Å; S46-V148 PolarHBondContact N-O 3.35Å; S46-V148 VanDerWaalsContact N-O 3.16Å; S46-V149 CarbonylContact O-C 3.57Å; S46-V149 WeakPolarHBondContact O-CA 3.26Å; S46-I150 PolarHBondContact O-N 2.83Å
47	V	98.6	Very high	86.3	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.5	-179.1	179.8	0	0	0	0	109.6	L49 F82 I88 T90 V91 V92 I150	V47-L49 HydrophobicContact CG1-CD2 3.57Å; V47-L49 HydrophobicContact CG1-CG 3.91Å; V47-F82 HydrophobicContact CB-CD1 4.36Å; V47-F82 HydrophobicContact CB-CG 4.5Å; V47-F82 HydrophobicContact CG1-CD1 4.03Å; V47-F82 HydrophobicContact CG1-CD2 4.15Å; V47-F82 HydrophobicContact CG1-CE1 3.98Å; V47-F82 HydrophobicContact CG1-CE2 4.18Å; V47-F82 HydrophobicContact CG1-CG 4.11Å; V47-F82 HydrophobicContact CG1-CZ 4.1Å; V47-F82 HydrophobicContact CG2-CB 4.32Å; V47-F82 HydrophobicContact CG2-CD1 3.48Å; V47-F82 VanDerWaalsContact CG2-CD1 3.48Å; V47-F82 HydrophobicContact CG2-CE1 3.94Å; V47-F82 HydrophobicContact CG2-CG 3.97Å; V47-I88 HydrophobicContact CG2-CD1 3.87Å; V47-I88 HydrophobicContact CG2-CG1 4.5Å; V47-I88 HydrophobicContact CG2-CG2 3.74Å; V47-T90 PolarHBondContact N-O 2.77Å; V47-V91 HydrophobicContact CB-CG1 4.37Å; V47-V91 HydrophobicContact CB-CG2 4.46Å; V47-V91 HydrophobicContact CG1-CG1 4.43Å; V47-V92 PolarHBondContact O-N 3.07Å; V47-I150 CarbonylContact C-O 3.48Å; V47-I150 VanDerWaalsContact CA-O 3.24Å; V47-I150 WeakPolarHBondContact CA-O 3.37Å; V47-I150 HydrophobicContact CG2-CB 4.19Å
48	V	98.8	Very high	87.3	Confident	0 Å²	0	45 Å²	45	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	118.6	170.6	177.3	0	0	0	0	109.2	P50 V92 V94 I128 V132 L135 V149 I150 I151 H152	V48-P50 VanDerWaalsContact O-CD 3.31Å; V48-P50 WeakPolarHBondContact O-CD 3.45Å; V48-V92 WeakPolarHBondContact CA-O 3.39Å; V48-V92 HydrophobicContact CG2-CB 4.28Å; V48-V94 HydrophobicContact CG1-CG2 4.1Å; V48-I128 HydrophobicContact CG1-CG2 4.44Å; V48-V132 HydrophobicContact CG2-CG2 4.16Å; V48-L135 HydrophobicContact CG2-CD1 3.77Å; V48-V149 HydrophobicContact CB-CG1 4.37Å; V48-V149 HydrophobicContact CG2-CG1 3.67Å; V48-I150 PolarHBondContact N-O 3.24Å; V48-I151 HydrophobicContact CB-CG1 4.44Å; V48-H152 PolarHBondContact O-N 2.89Å; V48-H152 VanDerWaalsContact O-N 3.08Å
49	L	98.5	Very high	88	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	91.8	-178.7	-59.7	-172.8	0	0	0	111	V47 A51 T78 V79 F82 V91 V92 V93 V94 H152 A154	V47-L49 HydrophobicContact CG1-CD2 3.57Å; V47-L49 HydrophobicContact CG1-CG 3.91Å; L49-A51 PolarHBondContact O-N 2.88Å; L49-A51 VanDerWaalsContact O-N 3.14Å; L49-T78 HydrophobicContact CD1-CG2 4.31Å; L49-V79 HydrophobicContact CD1-CG2 3.98Å; L49-F82 HydrophobicContact CD1-CD2 4.21Å; L49-F82 HydrophobicContact CD1-CE2 4.36Å; L49-F82 HydrophobicContact CD2-CD2 4.25Å; L49-F82 HydrophobicContact CD2-CE2 3.73Å; L49-F82 HydrophobicContact CD2-CZ 4.33Å; L49-V91 HydrophobicContact CD1-CG1 3.65Å; L49-V91 HydrophobicContact CG-CG1 4.03Å; L49-V92 PolarHBondContact N-O 3.36Å; L49-V93 HydrophobicContact CD1-CG2 4.29Å; L49-V94 PolarHBondContact O-N 2.9Å; L49-H152 WeakPolarHBondContact CA-O 3.28Å; L49-H152 HydrophobicContact CD2-CB 3.76Å; L49-H152 VanDerWaalsContact CD2-O 3.23Å; L49-H152 WeakPolarHBondContact CD2-O 3.31Å; L49-A154 HydrophobicContact CB-CB 4.38Å
50	P	97.8	Very high	88.1	Confident	17 Å²	17	45.3 Å²	45.3	11%	0.11	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	114.5	166.3	24.2	-36	0	0	0	111.4	V48 I128 H152	V48-P50 VanDerWaalsContact O-CD 3.31Å; V48-P50 WeakPolarHBondContact O-CD 3.45Å; P50-I128 HydrophobicContact CB-CG1 3.96Å; P50-I128 HydrophobicContact CG-CD1 4.13Å; P50-I128 HydrophobicContact CG-CG1 3.75Å; P50-H152 WeakPolarHBondContact CD-O 3.19Å
51	A	96.1	Very high	87.8	Confident	5 Å²	5	50.8 Å²	50.8	4%	0.041	29%	0.289	C	S	.	.			trans	-133.3	13.1	-174.7	0	0	0	0	0	112.9	L49 Q65 I75 V93 V94 V95 A154	L49-A51 PolarHBondContact O-N 2.88Å; L49-A51 VanDerWaalsContact O-N 3.14Å; A51-Q65 PolarHBondContact O-NE2 3.1Å; A51-I75 HydrophobicContact CB-CD1 3.54Å; A51-V93 HydrophobicContact CB-CG1 4.18Å; A51-V94 CarbonylContact C-O 3.45Å; A51-V94 VanDerWaalsContact C-O 3.23Å; A51-V94 VanDerWaalsContact CA-O 3.26Å; A51-V94 WeakPolarHBondContact CA-O 3.3Å; A51-V94 WeakPolarHBondContact CB-O 3.25Å; A51-V94 PolarHBondContact N-O 2.89Å; A51-V95 HydrophobicContact CB-CG1 4.01Å; A51-A154 HydrophobicContact CB-CB 3.7Å
52	G	86.6	Confident	87.3	Confident	22 Å²	22	53.3 Å²	53.3	23%	0.227	31%	0.305	C	S	.	.			trans	-82.7	-7.8	-179.5	0	0	0	0	0	116	V94	G52-V94 PolarHBondContact N-O 3.47Å
53	G	84.1	Confident	87.1	Confident	48 Å²	48	48 Å²	48	50%	0.495	28%	0.278	S	S	.	.			trans	-71.7	139.1	-177	0	0	0	0	0	113.7	G55 Q65	G53-G55 PolarHBondContact O-N 3.3Å; G53-Q65 PolarHBondContact O-NE2 2.86Å; G53-Q65 PolarHBondContact O-OE1 3.4Å
54	T	78.3	Confident	86.9	Confident	82 Å²	82	48.2 Å²	48.2	50%	0.503	28%	0.279	S	S	.	.			trans	-57	-40.1	176.1	52	0	0	0	0	113.9	E56 P63	T54-E56 WeakPolarHBondContact CB-OE1 3.37Å; T54-E56 VanDerWaalsContact OG1-CD 3.23Å; T54-E56 PolarHBondContact OG1-OE1 3.01Å; T54-P63 WeakPolarHBondContact O-CA 3.47Å; T54-P63 WeakPolarHBondContact O-CB 3.47Å
55	G	74.5	Confident	86.8	Confident	13 Å²	13	46.9 Å²	46.9	13%	0.134	27%	0.27	C	S	.	.			trans	84.7	18.5	-178.4	0	0	0	0	0	115.6	G53 R57 T58	G53-G55 PolarHBondContact O-N 3.3Å; G55-R57 PolarHBondContact O-N 2.86Å; G55-T58 PolarHBondContact O-N 3.4Å; G55-T58 PolarHBondContact O-OG1 3.25Å
56	E	77.9	Confident	86.7	Confident	148 Å²	148	47.4 Å²	47.4	69%	0.692	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-33	-43.9	-177.2	-72.6	140	-144.4	0	0	116.4	T54 T58 G59	T54-E56 WeakPolarHBondContact CB-OE1 3.37Å; T54-E56 VanDerWaalsContact OG1-CD 3.23Å; T54-E56 PolarHBondContact OG1-OE1 3.01Å; E56-T58 PolarHBondContact O-N 3.48Å; E56-G59 PolarHBondContact O-N 2.79Å
57	R	77	Confident	86.4	Confident	184 Å²	184	48 Å²	48	69%	0.694	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-61.1	-6.5	-179.5	-58.7	-177.8	-167.6	163.1	4.3	114.9	G55 Y263	G55-R57 PolarHBondContact O-N 2.86Å; R57-Y263 HydrophobicContact CB-CD1 4.27Å; R57-Y263 HydrophobicContact CB-CE1 4.13Å
58	T	70.6	Confident	86	Confident	13 Å²	13	52.4 Å²	52.4	8%	0.08	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-92.4	-18.4	171.8	58.8	0	0	0	0	114	G55 E56 L60 K64 T262	G55-T58 PolarHBondContact O-N 3.4Å; G55-T58 PolarHBondContact O-OG1 3.25Å; E56-T58 PolarHBondContact O-N 3.48Å; T58-L60 PolarHBondContact O-N 3.14Å; T58-K64 HydrophobicContact CG2-CB 4.01Å; T58-K64 HydrophobicContact CG2-CD 3.84Å; T58-T262 WeakPolarHBondContact CG2-O 3.38Å
59	G	75.8	Confident	85.6	Confident	70 Å²	70	52.8 Å²	52.8	72%	0.722	31%	0.306	S	S	*	.			trans	67.4	16.5	-174.3	0	0	0	0	0	114.7	E56	E56-G59 PolarHBondContact O-N 2.79Å
60	L	79.4	Confident	85.1	Confident	67 Å²	67	57.4 Å²	57.4	35%	0.351	33%	0.331	S	S	.	.			trans	-95.6	145.9	-178.3	-60.1	-180	0	0	0	111.6	T58 C67 L267	T58-L60 PolarHBondContact O-N 3.14Å; L60-C67 VanDerWaalsContact CD1-SG 3.58Å; L60-L267 HydrophobicContact CD1-CD1 3.79Å
61	Q	80.6	Confident	84.7	Confident	194 Å²	194	58.6 Å²	58.6	91%	0.907	35%	0.346	S	S	*	.	S	Bend	trans	-71.1	-35.5	173.5	-65	-66.1	-32.7	0	0	111.9
62	T	82.6	Confident	84.7	Confident	69 Å²	69	60 Å²	60	42%	0.423	35%	0.35	S	S	.	.	S	Bend	trans	-83.3	128.2	173.7	-51.7	0	0	0	0	109.7	K64 F66	T62-K64 PolarHBondContact O-N 2.9Å; T62-F66 HydrophobicContact CG2-CB 4Å
63	P	88.9	Confident	85.1	Confident	24 Å²	24	59.6 Å²	59.6	16%	0.156	34%	0.343	C	S	.	.			trans	-56.4	131.7	174	-24.6	33.5	0	0	0	111.3	T54 Q65 F66	T54-P63 WeakPolarHBondContact O-CA 3.47Å; T54-P63 WeakPolarHBondContact O-CB 3.47Å; P63-Q65 PolarHBondContact O-N 3.49Å; P63-F66 HydrophobicContact CB-CD2 3.93Å; P63-F66 HydrophobicContact CB-CE2 4.34Å; P63-F66 HydrophobicContact CG-CD2 4.22Å; P63-F66 WeakPolarHBondContact O-CA 3.39Å; P63-F66 PolarHBondContact O-N 2.88Å
64	K	89.3	Confident	85.6	Confident	23 Å²	23	57.3 Å²	57.3	10%	0.1	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-56.1	-28.3	-165.3	61.6	177.8	178.1	173.9	0	115.7	T58 T62 F66 C67 V155 V261	T58-K64 HydrophobicContact CG2-CB 4.01Å; T58-K64 HydrophobicContact CG2-CD 3.84Å; T62-K64 PolarHBondContact O-N 2.9Å; K64-F66 PolarHBondContact O-N 3.09Å; K64-C67 WeakPolarHBondContact O-CB 3.34Å; K64-C67 PolarHBondContact O-N 3.3Å; K64-V155 HydrophobicContact CG-CG1 4.26Å; K64-V261 WeakPolarHBondContact CE-O 3.37Å; K64-V261 PolarHBondContact NZ-O 3.27Å
65	Q	92.8	Very high	86.5	Confident	5 Å²	5	53.4 Å²	53.4	2%	0.023	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-65	-25.5	174.1	61.5	-83.7	18.9	0	0	113	A51 G53 P63 L74 I75 V155	A51-Q65 PolarHBondContact O-NE2 3.1Å; G53-Q65 PolarHBondContact O-NE2 2.86Å; G53-Q65 PolarHBondContact O-OE1 3.4Å; P63-Q65 PolarHBondContact O-N 3.49Å; Q65-L74 PolarHBondContact O-N 3.05Å; Q65-I75 HydrophobicContact CB-CB 4.28Å; Q65-I75 HydrophobicContact CB-CD1 4.46Å; Q65-I75 WeakPolarHBondContact O-CB 3.14Å; Q65-I75 WeakPolarHBondContact O-CG2 3.37Å; Q65-I75 PolarHBondContact O-N 2.93Å; Q65-V155 HydrophobicContact CB-CG1 3.71Å
66	F	94.6	Very high	87.6	Confident	11 Å²	11	52.8 Å²	52.8	5%	0.048	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-97.5	-1	176	-52.9	-56.5	0	0	0	113.5	T62 P63 K64 I75 V95 N99 L102 M103 I106	T62-F66 HydrophobicContact CG2-CB 4Å; P63-F66 HydrophobicContact CB-CD2 3.93Å; P63-F66 HydrophobicContact CB-CE2 4.34Å; P63-F66 HydrophobicContact CG-CD2 4.22Å; P63-F66 WeakPolarHBondContact O-CA 3.39Å; P63-F66 PolarHBondContact O-N 2.88Å; K64-F66 PolarHBondContact O-N 3.09Å; F66-I75 HydrophobicContact CD1-CG2 3.99Å; F66-I75 HydrophobicContact CE1-CD1 4.45Å; F66-I75 HydrophobicContact CE1-CG2 4.17Å; F66-V95 HydrophobicContact CZ-CG1 4Å; F66-N99 HydrophobicContact CE2-CB 3.82Å; F66-N99 HydrophobicContact CZ-CB 3.98Å; F66-L102 HydrophobicContact CB-CD2 4.07Å; F66-L102 HydrophobicContact CD1-CD2 4.07Å; F66-L102 HydrophobicContact CD1-CG 4.39Å; F66-L102 HydrophobicContact CD2-CD2 3.81Å; F66-L102 HydrophobicContact CE1-CD2 4.49Å; F66-L102 HydrophobicContact CE2-CD2 4.27Å; F66-L102 HydrophobicContact CG-CD2 3.71Å; F66-M103 HydrophobicContact CE1-SD 4.05Å; F66-I106 HydrophobicContact CD1-CD1 3.72Å; F66-I106 HydrophobicContact CE1-CD1 4.21Å
67	C	92	Very high	88.6	Confident	13 Å²	13	47 Å²	47	9%	0.088	26%	0.262	C	S	.	.			trans	-63.6	134.7	176.4	-74.6	0	0	0	0	111	L60 K64 F69 P73 L74	L60-C67 VanDerWaalsContact CD1-SG 3.58Å; K64-C67 WeakPolarHBondContact O-CB 3.34Å; K64-C67 PolarHBondContact O-N 3.3Å; C67-F69 HydrophobicContact CB-CE2 4.22Å; C67-F69 VanDerWaalsContact O-CD2 3.3Å; C67-F69 WeakPolarHBondContact O-CD2 3.48Å; C67-F69 WeakPolarHBondContact O-CE2 3.43Å; C67-P73 WeakPolarHBondContact O-CA 3.44Å; C67-L74 PolarHBondContact O-N 2.79Å
68	P	90.9	Very high	89.5	Confident	93 Å²	93	38.3 Å²	38.3	60%	0.604	23%	0.229	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	134.8	-176.5	32.1	-34.5	0	0	0	112.4
69	F	89.1	Confident	90.9	Very high	8 Å²	8	37.7 Å²	37.7	4%	0.035	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.7	170.2	-67.4	-90.4	0	0	0	106.8	C67 G71 R72 L74 Y77 L267 A270 E271 I274	C67-F69 HydrophobicContact CB-CE2 4.22Å; C67-F69 VanDerWaalsContact O-CD2 3.3Å; C67-F69 WeakPolarHBondContact O-CD2 3.48Å; C67-F69 WeakPolarHBondContact O-CE2 3.43Å; F69-G71 PolarHBondContact O-N 3.24Å; F69-R72 PolarHBondContact N-O 3.28Å; F69-R72 PolarHBondContact O-N 2.97Å; F69-R72 VanDerWaalsContact O-O 3.07Å; F69-L74 HydrophobicContact CD2-CB 3.94Å; F69-L74 HydrophobicContact CD2-CD1 4.21Å; F69-L74 HydrophobicContact CE2-CB 3.77Å; F69-L74 HydrophobicContact CE2-CD1 4.02Å; F69-L74 HydrophobicContact CE2-CD2 4.36Å; F69-L74 HydrophobicContact CE2-CG 4.27Å; F69-Y77 HydrophobicContact CB-CE2 3.95Å; F69-Y77 PolarHBondContact O-OH 2.93Å; F69-L267 HydrophobicContact CE1-CB 4.23Å; F69-L267 VanDerWaalsContact CE1-O 3.31Å; F69-L267 WeakPolarHBondContact CE1-O 3.38Å; F69-L267 HydrophobicContact CE2-CD2 4.46Å; F69-L267 HydrophobicContact CZ-CB 3.97Å; F69-L267 HydrophobicContact CZ-CD2 3.77Å; F69-L267 HydrophobicContact CZ-CG 4.46Å; F69-A270 HydrophobicContact CE1-CB 4.3Å; F69-E271 HydrophobicContact CD1-CB 3.69Å; F69-E271 HydrophobicContact CD1-CG 3.98Å; F69-E271 HydrophobicContact CE1-CB 3.94Å; F69-I274 HydrophobicContact CB-CD1 4Å; F69-I274 HydrophobicContact CD1-CD1 4.32Å; F69-I274 HydrophobicContact CG-CD1 4.12Å
70	L	87.8	Confident	91.9	Very high	97 Å²	97	36.3 Å²	36.3	51%	0.508	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	33.1	-174.3	-55.2	178.4	0	0	0	114.1	I274 K275 L278	L70-I274 HydrophobicContact CD1-CG2 4.08Å; L70-K275 HydrophobicContact CD1-CG 3.97Å; L70-K275 HydrophobicContact CD2-CG 4.2Å; L70-K275 HydrophobicContact CG-CG 4.45Å; L70-L278 HydrophobicContact CD1-CD1 3.68Å
71	G	90.4	Very high	92.7	Very high	42 Å²	42	34.6 Å²	34.6	43%	0.433	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	-0	-177.8	0	0	0	0	0	116	F69 R109	F69-G71 PolarHBondContact O-N 3.24Å; G71-R109 PolarHBondContact O-NH2 3.29Å
72	R	94.8	Very high	93.5	Very high	33 Å²	33	25.4 Å²	25.4	13%	0.125	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.8	178.1	-179.7	176	-165.2	176.5	10.4	111.7	F69 S76 Y77 E80 F110	F69-R72 PolarHBondContact N-O 3.28Å; F69-R72 PolarHBondContact O-N 2.97Å; F69-R72 VanDerWaalsContact O-O 3.07Å; R72-S76 PolarHBondContact NE-OG 2.75Å; R72-S76 PolarHBondContact NH2-O 2.91Å; R72-S76 PolarHBondContact NH2-OG 2.83Å; R72-Y77 HydrophobicContact CB-CE2 3.63Å; R72-Y77 HydrophobicContact CG-CD2 3.98Å; R72-Y77 HydrophobicContact CG-CE2 3.57Å; R72-E80 IonicContact CZ-OE1 3.25Å; R72-E80 VanDerWaalsContact NH1-CD 3.34Å; R72-E80 IonicContact NH1-OE1 2.69Å; R72-E80 PolarHBondContact NH1-OE1 2.91Å; R72-E80 IonicContact NH1-OE2 2.74Å; R72-E80 IonicContact NH2-OE1 2.72Å; R72-E80 PolarHBondContact NH2-OE1 2.94Å; R72-F110 HydrophobicContact CB-CE1 3.81Å; R72-F110 HydrophobicContact CB-CZ 3.95Å; R72-F110 HydrophobicContact CG-CD1 3.99Å; R72-F110 HydrophobicContact CG-CE1 3.65Å; R72-F110 HydrophobicContact CG-CE2 4.43Å; R72-F110 HydrophobicContact CG-CZ 3.9Å
73	P	95.8	Very high	94.1	Very high	14 Å²	14	23.6 Å²	23.6	9%	0.091	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	143.9	178.4	-26.8	38.4	0	0	0	113.5	C67 I75 S76 I106 F110	C67-P73 WeakPolarHBondContact O-CA 3.44Å; P73-I75 VanDerWaalsContact C-N 3.26Å; P73-I75 HydrophobicContact CB-CG2 4.25Å; P73-I75 PolarHBondContact O-N 3.05Å; P73-I75 VanDerWaalsContact O-N 3.16Å; P73-S76 VanDerWaalsContact O-CB 3.31Å; P73-S76 WeakPolarHBondContact O-CB 3.39Å; P73-S76 PolarHBondContact O-N 2.87Å; P73-I106 HydrophobicContact CB-CD1 4.05Å; P73-I106 HydrophobicContact CG-CD1 3.83Å; P73-I106 HydrophobicContact CG-CG1 4.03Å; P73-F110 VanDerWaalsContact CD-CE2 3.44Å; P73-F110 HydrophobicContact CG-CE2 4.39Å
74	L	95.3	Very high	94.4	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-49.2	-43.9	-179.6	-175.3	61.6	0	0	0	113.4	Q65 C67 F69 S76 Y77 T78 V155 P157 V261	Q65-L74 PolarHBondContact O-N 3.05Å; C67-L74 PolarHBondContact O-N 2.79Å; F69-L74 HydrophobicContact CD2-CB 3.94Å; F69-L74 HydrophobicContact CD2-CD1 4.21Å; F69-L74 HydrophobicContact CE2-CB 3.77Å; F69-L74 HydrophobicContact CE2-CD1 4.02Å; F69-L74 HydrophobicContact CE2-CD2 4.36Å; F69-L74 HydrophobicContact CE2-CG 4.27Å; L74-S76 PolarHBondContact O-N 3Å; L74-Y77 WeakPolarHBondContact O-CB 3.12Å; L74-Y77 PolarHBondContact O-N 2.83Å; L74-T78 PolarHBondContact O-N 3.18Å; L74-T78 PolarHBondContact O-OG1 3.19Å; L74-V155 HydrophobicContact CD2-CB 4.09Å; L74-V155 HydrophobicContact CD2-CG1 4.11Å; L74-P157 HydrophobicContact CD1-CG 3.85Å; L74-V261 HydrophobicContact CD2-CB 4.06Å; L74-V261 HydrophobicContact CD2-CG1 3.96Å; L74-V261 HydrophobicContact CD2-CG2 4.08Å
75	I	97.3	Very high	94.7	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.5	-29.5	179.1	-167	160.4	0	0	0	113.3	A51 Q65 F66 P73 T78 V79 V93 M103 I106 A154	A51-I75 HydrophobicContact CB-CD1 3.54Å; Q65-I75 HydrophobicContact CB-CB 4.28Å; Q65-I75 HydrophobicContact CB-CD1 4.46Å; Q65-I75 WeakPolarHBondContact O-CB 3.14Å; Q65-I75 WeakPolarHBondContact O-CG2 3.37Å; Q65-I75 PolarHBondContact O-N 2.93Å; F66-I75 HydrophobicContact CD1-CG2 3.99Å; F66-I75 HydrophobicContact CE1-CD1 4.45Å; F66-I75 HydrophobicContact CE1-CG2 4.17Å; P73-I75 VanDerWaalsContact C-N 3.26Å; P73-I75 HydrophobicContact CB-CG2 4.25Å; P73-I75 PolarHBondContact O-N 3.05Å; P73-I75 VanDerWaalsContact O-N 3.16Å; I75-T78 PolarHBondContact O-N 2.7Å; I75-V79 HydrophobicContact CG1-CG2 4.33Å; I75-V79 WeakPolarHBondContact O-CB 3.39Å; I75-V79 VanDerWaalsContact O-CG2 3.3Å; I75-V79 WeakPolarHBondContact O-CG2 3.26Å; I75-V79 PolarHBondContact O-N 3.03Å; I75-V93 HydrophobicContact CD1-CG1 3.65Å; I75-V93 HydrophobicContact CG1-CG1 4.5Å; I75-M103 HydrophobicContact CD1-SD 3.97Å; I75-M103 HydrophobicContact CG2-CE 4.49Å; I75-M103 HydrophobicContact CG2-SD 4.26Å; I75-I106 HydrophobicContact CG2-CD1 4.36Å; I75-A154 HydrophobicContact CD1-CB 3.84Å; I75-A154 HydrophobicContact CG1-CB 4.09Å
76	S	97.8	Very high	94.9	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-71.6	-31.2	178.8	-178.2	0	0	0	0	111.8	R72 P73 L74 E80 F110 H112	R72-S76 PolarHBondContact NE-OG 2.75Å; R72-S76 PolarHBondContact NH2-O 2.91Å; R72-S76 PolarHBondContact NH2-OG 2.83Å; P73-S76 VanDerWaalsContact O-CB 3.31Å; P73-S76 WeakPolarHBondContact O-CB 3.39Å; P73-S76 PolarHBondContact O-N 2.87Å; L74-S76 PolarHBondContact O-N 3Å; S76-E80 WeakPolarHBondContact O-CB 3.43Å; S76-E80 PolarHBondContact O-N 3.14Å; S76-F110 WeakPolarHBondContact OG-CB 3.3Å; S76-F110 WeakPolarHBondContact OG-CG 3.47Å; S76-H112 PolarHBondContact O-CE1 3.41Å; S76-H112 PolarHBondContact OG-NE2 3.12Å
77	Y	97	Very high	94.9	Very high	28 Å²	28	32.1 Å²	32.1	11%	0.11	18%	0.179	C	C	.	.	H	α-helix	trans	-66.6	-49	167.7	-67.4	-88.6	0	0	0	110.7	F69 R72 L74 V79 E80 S81 I274	F69-Y77 HydrophobicContact CB-CE2 3.95Å; F69-Y77 PolarHBondContact O-OH 2.93Å; R72-Y77 HydrophobicContact CB-CE2 3.63Å; R72-Y77 HydrophobicContact CG-CD2 3.98Å; R72-Y77 HydrophobicContact CG-CE2 3.57Å; L74-Y77 WeakPolarHBondContact O-CB 3.12Å; L74-Y77 PolarHBondContact O-N 2.83Å; Y77-V79 VanDerWaalsContact C-N 3.34Å; Y77-V79 PolarHBondContact O-N 2.96Å; Y77-E80 PolarHBondContact O-N 3.33Å; Y77-E80 VanDerWaalsContact O-N 3.14Å; Y77-S81 PolarHBondContact O-N 2.91Å; Y77-S81 PolarHBondContact O-OG 2.89Å; Y77-I274 HydrophobicContact CD1-CD1 4.34Å; Y77-I274 HydrophobicContact CD1-CG1 4.38Å; Y77-I274 HydrophobicContact CD2-CD1 4.1Å; Y77-I274 HydrophobicContact CE1-CD1 4.28Å; Y77-I274 HydrophobicContact CE1-CG1 4.25Å; Y77-I274 HydrophobicContact CE1-CG2 3.63Å; Y77-I274 HydrophobicContact CE2-CD1 4.03Å; Y77-I274 HydrophobicContact CE2-CG2 4.49Å; Y77-I274 HydrophobicContact CG-CD1 4.25Å; Y77-I274 WeakPolarHBondContact OH-CG2 3.43Å
78	T	97.7	Very high	95.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58	-44.5	178.8	-48.7	0	0	0	0	112	L49 L74 I75 S81 F82 A154	L49-T78 HydrophobicContact CD1-CG2 4.31Å; L74-T78 PolarHBondContact O-N 3.18Å; L74-T78 PolarHBondContact O-OG1 3.19Å; I75-T78 PolarHBondContact O-N 2.7Å; T78-S81 PolarHBondContact O-N 3.04Å; T78-F82 HydrophobicContact CG2-CE2 4Å; T78-F82 WeakPolarHBondContact O-CD2 3.49Å; T78-A154 WeakPolarHBondContact CB-O 3.41Å; T78-A154 PolarHBondContact OG1-O 3.06Å
79	V	98.3	Very high	95.2	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-61.9	-45.6	175.4	168.9	0	0	0	0	111.1	L49 I75 Y77 S81 F82 E83 V91 V93 H112 V115	L49-V79 HydrophobicContact CD1-CG2 3.98Å; I75-V79 HydrophobicContact CG1-CG2 4.33Å; I75-V79 WeakPolarHBondContact O-CB 3.39Å; I75-V79 VanDerWaalsContact O-CG2 3.3Å; I75-V79 WeakPolarHBondContact O-CG2 3.26Å; I75-V79 PolarHBondContact O-N 3.03Å; Y77-V79 VanDerWaalsContact C-N 3.34Å; Y77-V79 PolarHBondContact O-N 2.96Å; V79-S81 VanDerWaalsContact C-N 3.31Å; V79-S81 PolarHBondContact O-N 2.91Å; V79-F82 PolarHBondContact O-N 2.99Å; V79-E83 HydrophobicContact CG1-CG 4Å; V79-E83 WeakPolarHBondContact O-CG 3.38Å; V79-E83 PolarHBondContact O-N 3.25Å; V79-V91 HydrophobicContact CG2-CG1 4.45Å; V79-V93 HydrophobicContact CG2-CG2 3.83Å; V79-H112 HydrophobicContact CG1-CB 4.35Å; V79-H112 WeakPolarHBondContact CG1-ND1 3.42Å; V79-V115 HydrophobicContact CG1-CG2 3.48Å; V79-V115 VanDerWaalsContact CG1-CG2 3.48Å
80	E	96.9	Very high	95.5	Very high	42 Å²	42	31.7 Å²	31.7	20%	0.196	17%	0.169	C	C	.	.	H	α-helix	trans	-59.9	-39.7	179.8	-176.1	178.2	-75.2	0	0	112.7	R72 S76 Y77 F82 E83 R84	R72-E80 IonicContact CZ-OE1 3.25Å; R72-E80 VanDerWaalsContact NH1-CD 3.34Å; R72-E80 IonicContact NH1-OE1 2.69Å; R72-E80 PolarHBondContact NH1-OE1 2.91Å; R72-E80 IonicContact NH1-OE2 2.74Å; R72-E80 IonicContact NH2-OE1 2.72Å; R72-E80 PolarHBondContact NH2-OE1 2.94Å; S76-E80 WeakPolarHBondContact O-CB 3.43Å; S76-E80 PolarHBondContact O-N 3.14Å; Y77-E80 PolarHBondContact O-N 3.33Å; Y77-E80 VanDerWaalsContact O-N 3.14Å; E80-F82 PolarHBondContact O-N 3.32Å; E80-E83 PolarHBondContact O-N 2.94Å; E80-R84 VanDerWaalsContact CD-NH2 3.32Å; E80-R84 HydrophobicContact CG-CG 4.03Å; E80-R84 WeakPolarHBondContact O-CG 3.26Å; E80-R84 PolarHBondContact O-N 2.91Å; E80-R84 IonicContact OE1-NH2 3.83Å; E80-R84 IonicContact OE2-CZ 3.23Å; E80-R84 VanDerWaalsContact OE2-CZ 3.23Å; E80-R84 IonicContact OE2-NE 2.77Å; E80-R84 PolarHBondContact OE2-NE 2.98Å; E80-R84 IonicContact OE2-NH2 2.7Å; E80-R84 PolarHBondContact OE2-NH2 3.15Å
81	S	96.1	Very high	96	Very high	31 Å²	31	27 Å²	27	22%	0.217	14%	0.144	C	C	.	.	H	α-helix	trans	-56.7	-32	175.2	-57.1	0	0	0	0	112.5	Y77 T78 V79 V85 P157	Y77-S81 PolarHBondContact O-N 2.91Å; Y77-S81 PolarHBondContact O-OG 2.89Å; T78-S81 PolarHBondContact O-N 3.04Å; V79-S81 VanDerWaalsContact C-N 3.31Å; V79-S81 PolarHBondContact O-N 2.91Å; S81-V85 WeakPolarHBondContact O-CG2 3.5Å; S81-P157 PolarHBondContact OG-O 2.98Å
82	F	97.8	Very high	96.4	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-86.6	-29.2	173.2	-66.1	-71.5	0	0	0	113.9	V47 L49 T78 V79 E80 I88 V91 I150 H152 V159 L164	V47-F82 HydrophobicContact CB-CD1 4.36Å; V47-F82 HydrophobicContact CB-CG 4.5Å; V47-F82 HydrophobicContact CG1-CD1 4.03Å; V47-F82 HydrophobicContact CG1-CD2 4.15Å; V47-F82 HydrophobicContact CG1-CE1 3.98Å; V47-F82 HydrophobicContact CG1-CE2 4.18Å; V47-F82 HydrophobicContact CG1-CG 4.11Å; V47-F82 HydrophobicContact CG1-CZ 4.1Å; V47-F82 HydrophobicContact CG2-CB 4.32Å; V47-F82 HydrophobicContact CG2-CD1 3.48Å; V47-F82 VanDerWaalsContact CG2-CD1 3.48Å; V47-F82 HydrophobicContact CG2-CE1 3.94Å; V47-F82 HydrophobicContact CG2-CG 3.97Å; L49-F82 HydrophobicContact CD1-CD2 4.21Å; L49-F82 HydrophobicContact CD1-CE2 4.36Å; L49-F82 HydrophobicContact CD2-CD2 4.25Å; L49-F82 HydrophobicContact CD2-CE2 3.73Å; L49-F82 HydrophobicContact CD2-CZ 4.33Å; T78-F82 HydrophobicContact CG2-CE2 4Å; T78-F82 WeakPolarHBondContact O-CD2 3.49Å; V79-F82 PolarHBondContact O-N 2.99Å; E80-F82 PolarHBondContact O-N 3.32Å; F82-I88 HydrophobicContact CB-CD1 4.49Å; F82-I88 HydrophobicContact CD1-CD1 3.82Å; F82-V91 HydrophobicContact CB-CG2 3.73Å; F82-I150 HydrophobicContact CE1-CG2 4.47Å; F82-H152 HydrophobicContact CE2-CB 4.31Å; F82-H152 AromaticContact CE2-CD2 3.73Å; F82-H152 HydrophobicContact CZ-CB 3.73Å; F82-H152 AromaticContact CZ-CD2 3.62Å; F82-H152 AromaticContact CZ-CG 3.56Å; F82-V159 HydrophobicContact CE1-CG1 4.43Å; F82-V159 HydrophobicContact CE2-CG1 4.38Å; F82-V159 HydrophobicContact CZ-CG1 3.98Å; F82-L164 HydrophobicContact CD1-CD1 3.99Å; F82-L164 HydrophobicContact CD1-CD2 4.31Å; F82-L164 HydrophobicContact CE1-CD1 3.96Å; F82-L164 HydrophobicContact CE1-CD2 3.57Å; F82-L164 HydrophobicContact CE1-CG 4.44Å; F82-L164 HydrophobicContact CZ-CD2 4.43Å
83	E	95.9	Very high	96.6	Very high	32 Å²	32	23.5 Å²	23.5	15%	0.15	12%	0.118	C	C	.	.	H	α-helix	trans	-73.8	-36.3	179.4	-71.5	-163.1	130.1	0	0	113.2	V79 E80 V85 V91 H112 K113 K114	V79-E83 HydrophobicContact CG1-CG 4Å; V79-E83 WeakPolarHBondContact O-CG 3.38Å; V79-E83 PolarHBondContact O-N 3.25Å; E80-E83 PolarHBondContact O-N 2.94Å; E83-V85 PolarHBondContact O-N 2.72Å; E83-V91 HydrophobicContact CG-CG2 4.42Å; E83-H112 WeakPolarHBondContact OE2-CA 3.35Å; E83-H112 IonicContact OE2-CE1 3.45Å; E83-H112 IonicContact OE2-CG 3.5Å; E83-H112 IonicContact OE2-ND1 2.72Å; E83-H112 PolarHBondContact OE2-ND1 3.45Å; E83-K113 PolarHBondContact OE1-N 3.36Å; E83-K114 HydrophobicContact CB-CD 4.49Å; E83-K114 HydrophobicContact CG-CB 4.19Å; E83-K114 HydrophobicContact CG-CD 4.34Å; E83-K114 HydrophobicContact CG-CG 4.3Å; E83-K114 WeakPolarHBondContact O-CE 3.47Å; E83-K114 PolarHBondContact O-NZ 2.99Å; E83-K114 PolarHBondContact OE1-N 3.46Å
84	R	94.8	Very high	96.7	Very high	137 Å²	137	22.8 Å²	22.8	52%	0.517	11%	0.113	S	C	.	.	S	Bend	trans	-59.3	-31.5	174.7	-72.6	177.5	-177.7	-82.8	0.2	112.3	E80 S86	E80-R84 VanDerWaalsContact CD-NH2 3.32Å; E80-R84 HydrophobicContact CG-CG 4.03Å; E80-R84 WeakPolarHBondContact O-CG 3.26Å; E80-R84 PolarHBondContact O-N 2.91Å; E80-R84 IonicContact OE1-NH2 3.83Å; E80-R84 IonicContact OE2-CZ 3.23Å; E80-R84 VanDerWaalsContact OE2-CZ 3.23Å; E80-R84 IonicContact OE2-NE 2.77Å; E80-R84 PolarHBondContact OE2-NE 2.98Å; E80-R84 IonicContact OE2-NH2 2.7Å; E80-R84 PolarHBondContact OE2-NH2 3.15Å; R84-S86 PolarHBondContact O-N 3.03Å
85	V	96.6	Very high	96.8	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.018	11%	0.113	C	C	.	.	S	Bend	trans	-67.8	117.3	175.6	176.7	0	0	0	0	110.1	S81 E83 W87 I88 K114 E161 L164	S81-V85 WeakPolarHBondContact O-CG2 3.5Å; E83-V85 PolarHBondContact O-N 2.72Å; V85-W87 HydrophobicContact CG1-CD2 3.57Å; V85-W87 HydrophobicContact CG1-CE3 4.1Å; V85-W87 HydrophobicContact CG1-CG 4.05Å; V85-W87 HydrophobicContact CG1-CH2 4.05Å; V85-W87 HydrophobicContact CG1-CZ2 3.48Å; V85-W87 VanDerWaalsContact CG1-CZ2 3.48Å; V85-W87 HydrophobicContact CG1-CZ3 4.32Å; V85-W87 PolarHBondContact O-N 2.73Å; V85-I88 HydrophobicContact CB-CB 4.37Å; V85-I88 HydrophobicContact CB-CD1 3.9Å; V85-I88 HydrophobicContact CB-CG1 4.14Å; V85-I88 HydrophobicContact CG1-CB 4.19Å; V85-I88 HydrophobicContact CG1-CD1 3.68Å; V85-I88 HydrophobicContact CG1-CG1 3.62Å; V85-I88 HydrophobicContact CG2-CD1 4.35Å; V85-I88 PolarHBondContact O-N 2.76Å; V85-K114 PolarHBondContact O-NZ 3.2Å; V85-E161 HydrophobicContact CG1-CG 4.15Å; V85-E161 HydrophobicContact CG2-CB 4Å; V85-E161 HydrophobicContact CG2-CG 3.99Å; V85-L164 HydrophobicContact CG2-CD1 3.93Å
86	S	95.3	Very high	96.7	Very high	86 Å²	86	23.6 Å²	23.6	60%	0.601	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-44.9	-169.1	59	0	0	0	0	113.5	R84	R84-S86 PolarHBondContact O-N 3.03Å
87	W	95.4	Very high	96.5	Very high	16 Å²	16	31.7 Å²	31.7	6%	0.061	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-7.2	-174	46.8	-91.5	0	0	0	115.2	L39 V41 V45 V85 E161 L164 H165 A168	L39-W87 PolarHBondContact O-NE1 2.87Å; V41-W87 HydrophobicContact CG2-CB 3.76Å; V41-W87 HydrophobicContact CG2-CD2 3.59Å; V41-W87 HydrophobicContact CG2-CE3 3.38Å; V41-W87 HydrophobicContact CG2-CG 3.77Å; V41-W87 HydrophobicContact CG2-CZ3 4.17Å; V45-W87 HydrophobicContact CB-CE3 4.06Å; V45-W87 HydrophobicContact CB-CZ3 4.16Å; V45-W87 HydrophobicContact CG1-CE3 4.47Å; V45-W87 HydrophobicContact CG1-CZ3 4.08Å; V45-W87 HydrophobicContact CG2-CE3 3.99Å; V45-W87 HydrophobicContact CG2-CZ3 4.08Å; V85-W87 HydrophobicContact CG1-CD2 3.57Å; V85-W87 HydrophobicContact CG1-CE3 4.1Å; V85-W87 HydrophobicContact CG1-CG 4.05Å; V85-W87 HydrophobicContact CG1-CH2 4.05Å; V85-W87 HydrophobicContact CG1-CZ2 3.48Å; V85-W87 VanDerWaalsContact CG1-CZ2 3.48Å; V85-W87 HydrophobicContact CG1-CZ3 4.32Å; V85-W87 PolarHBondContact O-N 2.73Å; W87-E161 HydrophobicContact CZ2-CG 4.21Å; W87-E161 PolarHBondContact NE1-OE1 2.84Å; W87-L164 HydrophobicContact CH2-CB 3.86Å; W87-L164 HydrophobicContact CZ2-CB 4.22Å; W87-H165 HydrophobicContact CZ2-CB 4.08Å; W87-A168 HydrophobicContact CH2-CB 4.14Å; W87-A168 HydrophobicContact CZ3-CB 3.99Å
88	I	96.3	Very high	96.3	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	121.8	170.4	-69.2	178.9	0	0	0	108.7	V45 V47 F82 V85 V91 K114 L164	V45-I88 HydrophobicContact CG1-CG1 4.42Å; V47-I88 HydrophobicContact CG2-CD1 3.87Å; V47-I88 HydrophobicContact CG2-CG1 4.5Å; V47-I88 HydrophobicContact CG2-CG2 3.74Å; F82-I88 HydrophobicContact CB-CD1 4.49Å; F82-I88 HydrophobicContact CD1-CD1 3.82Å; V85-I88 HydrophobicContact CB-CB 4.37Å; V85-I88 HydrophobicContact CB-CD1 3.9Å; V85-I88 HydrophobicContact CB-CG1 4.14Å; V85-I88 HydrophobicContact CG1-CB 4.19Å; V85-I88 HydrophobicContact CG1-CD1 3.68Å; V85-I88 HydrophobicContact CG1-CG1 3.62Å; V85-I88 HydrophobicContact CG2-CD1 4.35Å; V85-I88 PolarHBondContact O-N 2.76Å; I88-V91 HydrophobicContact CG2-CG2 4.2Å; I88-K114 VanDerWaalsContact O-CD 3.26Å; I88-K114 WeakPolarHBondContact O-CD 3.32Å; I88-K114 WeakPolarHBondContact O-CE 3.42Å; I88-K114 PolarHBondContact O-NZ 3.14Å; I88-L164 HydrophobicContact CD1-CD1 4.43Å
89	Q	93.9	Very high	96.2	Very high	85 Å²	85	38.7 Å²	38.7	40%	0.397	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-30.8	-168.8	-61	-178.9	-16.1	0	0	114.1	V45	V45-Q89 PolarHBondContact O-N 2.81Å
90	T	95.1	Very high	96.1	Very high	18 Å²	18	40.8 Å²	40.8	11%	0.11	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	138.9	179	-65.9	0	0	0	0	109.5	S46 V47 V92 K114 L116 L135 R140	S46-T90 CarbonylContact C-O 3.56Å; S46-T90 WeakPolarHBondContact CA-O 3.27Å; V47-T90 PolarHBondContact N-O 2.77Å; T90-V92 HydrophobicContact CG2-CG2 3.77Å; T90-K114 CarbonylContact C-O 3.59Å; T90-K114 WeakPolarHBondContact CA-O 3.49Å; T90-L116 HydrophobicContact CG2-CB 4.38Å; T90-L135 HydrophobicContact CG2-CD2 3.98Å; T90-R140 PolarHBondContact OG1-NH1 2.89Å
91	V	97.9	Very high	96.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	102.6	169.2	-175.4	0	0	0	0	108.1	V47 L49 V79 F82 E83 I88 V93 K114 V115 L116	V47-V91 HydrophobicContact CB-CG1 4.37Å; V47-V91 HydrophobicContact CB-CG2 4.46Å; V47-V91 HydrophobicContact CG1-CG1 4.43Å; L49-V91 HydrophobicContact CD1-CG1 3.65Å; L49-V91 HydrophobicContact CG-CG1 4.03Å; V79-V91 HydrophobicContact CG2-CG1 4.45Å; F82-V91 HydrophobicContact CB-CG2 3.73Å; E83-V91 HydrophobicContact CG-CG2 4.42Å; I88-V91 HydrophobicContact CG2-CG2 4.2Å; V91-V93 HydrophobicContact CG1-CG2 4.11Å; V91-V93 PolarHBondContact O-N 3.47Å; V91-K114 PolarHBondContact N-O 3.05Å; V91-V115 HydrophobicContact CB-CG2 4.41Å; V91-V115 VanDerWaalsContact O-CA 3.27Å; V91-V115 WeakPolarHBondContact O-CA 3.34Å; V91-L116 PolarHBondContact O-N 3.43Å
92	V	98.3	Very high	96.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	114.2	176.8	-173.7	0	0	0	0	109	V47 V48 L49 T90 V94 L116 V118 L135	V47-V92 PolarHBondContact O-N 3.07Å; V48-V92 WeakPolarHBondContact CA-O 3.39Å; V48-V92 HydrophobicContact CG2-CB 4.28Å; L49-V92 PolarHBondContact N-O 3.36Å; T90-V92 HydrophobicContact CG2-CG2 3.77Å; V92-V94 HydrophobicContact CG1-CG2 4.09Å; V92-L116 CarbonylContact C-O 3.52Å; V92-L116 WeakPolarHBondContact CA-O 3.47Å; V92-V118 HydrophobicContact CG1-CB 4.05Å; V92-V118 HydrophobicContact CG1-CG2 3.48Å; V92-V118 VanDerWaalsContact CG1-CG2 3.48Å; V92-L135 HydrophobicContact CG2-CD1 4.19Å; V92-L135 HydrophobicContact CG2-CD2 3.6Å; V92-L135 HydrophobicContact CG2-CG 3.79Å
93	V	98.5	Very high	96.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	112.4	179.1	-175.1	0	0	0	0	108.9	L49 A51 I75 V79 V91 V95 M103 V115 L116 V117 V118	L49-V93 HydrophobicContact CD1-CG2 4.29Å; A51-V93 HydrophobicContact CB-CG1 4.18Å; I75-V93 HydrophobicContact CD1-CG1 3.65Å; I75-V93 HydrophobicContact CG1-CG1 4.5Å; V79-V93 HydrophobicContact CG2-CG2 3.83Å; V91-V93 HydrophobicContact CG1-CG2 4.11Å; V91-V93 PolarHBondContact O-N 3.47Å; V93-V95 HydrophobicContact CG1-CG1 4.03Å; V93-M103 HydrophobicContact CB-CE 4.49Å; V93-M103 HydrophobicContact CG1-CE 4.04Å; V93-M103 HydrophobicContact CG1-CG 4.15Å; V93-M103 HydrophobicContact CG1-SD 3.82Å; V93-M103 HydrophobicContact CG2-CE 4.39Å; V93-V115 HydrophobicContact CB-CG1 4.19Å; V93-V115 HydrophobicContact CG2-CG1 3.68Å; V93-L116 PolarHBondContact N-O 3.05Å; V93-V117 WeakPolarHBondContact O-CA 3.21Å; V93-V118 PolarHBondContact O-N 3.36Å
94	V	98.3	Very high	96.2	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	102.6	-172.7	-170.5	0	0	0	0	110.3	V48 L49 A51 G52 V92 V118 S127	V48-V94 HydrophobicContact CG1-CG2 4.1Å; L49-V94 PolarHBondContact O-N 2.9Å; A51-V94 CarbonylContact C-O 3.45Å; A51-V94 VanDerWaalsContact C-O 3.23Å; A51-V94 VanDerWaalsContact CA-O 3.26Å; A51-V94 WeakPolarHBondContact CA-O 3.3Å; A51-V94 WeakPolarHBondContact CB-O 3.25Å; A51-V94 PolarHBondContact N-O 2.89Å; G52-V94 PolarHBondContact N-O 3.47Å; V92-V94 HydrophobicContact CG1-CG2 4.09Å; V94-V118 CarbonylContact C-O 3.6Å; V94-V118 VanDerWaalsContact CA-O 3.28Å; V94-V118 WeakPolarHBondContact CA-O 3.26Å; V94-V118 HydrophobicContact CG1-CG1 4.39Å; V94-V118 HydrophobicContact CG2-CB 4.29Å; V94-S127 WeakPolarHBondContact CG1-O 3.44Å
95	V	97.4	Very high	96.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	157.8	-175.4	-62.7	0	0	0	0	111.9	A51 F66 V93 N99 M103 V117 V118 P119 G120	A51-V95 HydrophobicContact CB-CG1 4.01Å; F66-V95 HydrophobicContact CZ-CG1 4Å; V93-V95 HydrophobicContact CG1-CG1 4.03Å; V95-N99 HydrophobicContact CB-CB 4.3Å; V95-M103 HydrophobicContact CG1-CB 4.09Å; V95-M103 HydrophobicContact CG1-CG 4.01Å; V95-M103 HydrophobicContact CG1-SD 4.28Å; V95-M103 HydrophobicContact CG2-CB 4.29Å; V95-V117 HydrophobicContact CG2-CG1 3.67Å; V95-V118 PolarHBondContact N-O 3.37Å; V95-P119 CarbonylContact O-C 3.58Å; V95-P119 WeakPolarHBondContact O-CA 3.36Å; V95-G120 PolarHBondContact O-N 2.94Å
96	A	95	Very high	96.4	Very high	16 Å²	16	44 Å²	44	13%	0.132	24%	0.238	C	C	.	.			trans	-61.2	146.6	169.1	0	0	0	0	0	109.6	E98 N99 T100	A96-E98 VanDerWaalsContact C-N 3.27Å; A96-E98 VanDerWaalsContact CB-OE1 3.23Å; A96-E98 WeakPolarHBondContact CB-OE1 3.04Å; A96-E98 WeakPolarHBondContact CB-OE2 3.41Å; A96-E98 PolarHBondContact O-N 2.86Å; A96-N99 WeakPolarHBondContact O-CA 3.2Å; A96-N99 WeakPolarHBondContact O-CB 3.5Å; A96-N99 PolarHBondContact O-N 2.92Å; A96-T100 PolarHBondContact O-N 2.75Å
97	K	93.3	Very high	96.5	Very high	170 Å²	170	41.2 Å²	41.2	74%	0.739	22%	0.215	S	C	*	.	G	3₁₀ helix	trans	-56.4	-40.6	-164.8	-175.1	179.7	178.3	-178.1	0	112.7	N99 T100	K97-N99 VanDerWaalsContact C-N 3.3Å; K97-N99 PolarHBondContact O-N 3.35Å; K97-T100 WeakPolarHBondContact O-CB 3.26Å; K97-T100 PolarHBondContact O-N 2.69Å; K97-T100 PolarHBondContact O-OG1 3.25Å
98	E	93.6	Very high	96.6	Very high	148 Å²	148	47.9 Å²	47.9	69%	0.692	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-64.2	-28.6	175.9	65.8	-79.1	-170.9	0	0	113.6	A96 T100	A96-E98 VanDerWaalsContact C-N 3.27Å; A96-E98 VanDerWaalsContact CB-OE1 3.23Å; A96-E98 WeakPolarHBondContact CB-OE1 3.04Å; A96-E98 WeakPolarHBondContact CB-OE2 3.41Å; A96-E98 PolarHBondContact O-N 2.86Å; E98-T100 VanDerWaalsContact C-N 3.34Å
99	N	95.4	Very high	96.7	Very high	28 Å²	28	56.2 Å²	56.2	15%	0.15	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-88.4	2.4	178.2	-70.2	-70.2	0	0	0	113.2	F66 V95 A96 K97 G101 L102 M103	F66-N99 HydrophobicContact CE2-CB 3.82Å; F66-N99 HydrophobicContact CZ-CB 3.98Å; V95-N99 HydrophobicContact CB-CB 4.3Å; A96-N99 WeakPolarHBondContact O-CA 3.2Å; A96-N99 WeakPolarHBondContact O-CB 3.5Å; A96-N99 PolarHBondContact O-N 2.92Å; K97-N99 VanDerWaalsContact C-N 3.3Å; K97-N99 PolarHBondContact O-N 3.35Å; N99-G101 PolarHBondContact O-N 2.99Å; N99-L102 PolarHBondContact O-N 2.74Å; N99-M103 PolarHBondContact O-N 3.01Å
100	T	95.8	Very high	96.8	Very high	44 Å²	44	54.6 Å²	54.6	27%	0.27	27%	0.27	S	S	.	.	H	α-helix	trans	-59.7	-43.8	179.4	-51.8	0	0	0	0	112	A96 K97 E98 M103 M104 V117	A96-T100 PolarHBondContact O-N 2.75Å; K97-T100 WeakPolarHBondContact O-CB 3.26Å; K97-T100 PolarHBondContact O-N 2.69Å; K97-T100 PolarHBondContact O-OG1 3.25Å; E98-T100 VanDerWaalsContact C-N 3.34Å; T100-M103 PolarHBondContact O-N 3Å; T100-M104 WeakPolarHBondContact O-CG 3.38Å; T100-M104 PolarHBondContact O-N 3.03Å; T100-M104 VanDerWaalsContact O-N 3.13Å; T100-V117 HydrophobicContact CG2-CG1 4Å
101	G	96.9	Very high	96.9	Very high	42 Å²	42	60.6 Å²	60.6	43%	0.433	30%	0.297	S	S	.	.	H	α-helix	trans	-62.1	-52.1	177.7	0	0	0	0	0	112.1	N99 M103 M104 D105	N99-G101 PolarHBondContact O-N 2.99Å; G101-M103 PolarHBondContact O-N 3.42Å; G101-M104 WeakPolarHBondContact O-CA 3.37Å; G101-M104 WeakPolarHBondContact O-CB 3.29Å; G101-M104 PolarHBondContact O-N 3.15Å; G101-D105 PolarHBondContact O-N 3.22Å
102	L	96.5	Very high	96.9	Very high	69 Å²	69	61.3 Å²	61.3	36%	0.361	30%	0.3	S	S	.	.	H	α-helix	trans	-53.7	-38.8	176	176.6	61	0	0	0	112.6	F66 N99 D105 I106	F66-L102 HydrophobicContact CB-CD2 4.07Å; F66-L102 HydrophobicContact CD1-CD2 4.07Å; F66-L102 HydrophobicContact CD1-CG 4.39Å; F66-L102 HydrophobicContact CD2-CD2 3.81Å; F66-L102 HydrophobicContact CE1-CD2 4.49Å; F66-L102 HydrophobicContact CE2-CD2 4.27Å; F66-L102 HydrophobicContact CG-CD2 3.71Å; N99-L102 PolarHBondContact O-N 2.74Å; L102-D105 PolarHBondContact O-N 2.62Å; L102-I106 HydrophobicContact CD1-CD1 4.2Å; L102-I106 HydrophobicContact CG-CD1 4.13Å; L102-I106 WeakPolarHBondContact O-CD1 3.31Å; L102-I106 WeakPolarHBondContact O-CG1 3.33Å; L102-I106 PolarHBondContact O-N 3.45Å
103	M	97.8	Very high	96.8	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-69	-37	176.8	-166.4	64.2	-139.9	0	0	112.6	F66 I75 V93 V95 N99 T100 G101 I106 I107 V117	F66-M103 HydrophobicContact CE1-SD 4.05Å; I75-M103 HydrophobicContact CD1-SD 3.97Å; I75-M103 HydrophobicContact CG2-CE 4.49Å; I75-M103 HydrophobicContact CG2-SD 4.26Å; V93-M103 HydrophobicContact CB-CE 4.49Å; V93-M103 HydrophobicContact CG1-CE 4.04Å; V93-M103 HydrophobicContact CG1-CG 4.15Å; V93-M103 HydrophobicContact CG1-SD 3.82Å; V93-M103 HydrophobicContact CG2-CE 4.39Å; V95-M103 HydrophobicContact CG1-CB 4.09Å; V95-M103 HydrophobicContact CG1-CG 4.01Å; V95-M103 HydrophobicContact CG1-SD 4.28Å; V95-M103 HydrophobicContact CG2-CB 4.29Å; N99-M103 PolarHBondContact O-N 3.01Å; T100-M103 PolarHBondContact O-N 3Å; G101-M103 PolarHBondContact O-N 3.42Å; M103-I106 HydrophobicContact CE-CG2 4.12Å; M103-I106 PolarHBondContact O-N 2.74Å; M103-I107 HydrophobicContact CE-CD1 4.24Å; M103-I107 HydrophobicContact CE-CG1 3.99Å; M103-I107 HydrophobicContact CG-CD1 4.24Å; M103-I107 WeakPolarHBondContact O-CD1 3.46Å; M103-I107 VanDerWaalsContact O-CG1 3.26Å; M103-I107 WeakPolarHBondContact O-CG1 3.4Å; M103-I107 PolarHBondContact O-N 2.72Å; M103-V117 HydrophobicContact CB-CG1 4.22Å; M103-V117 HydrophobicContact CB-CG2 4.31Å; M103-V117 HydrophobicContact CG-CG1 4.2Å; M103-V117 HydrophobicContact CG-CG2 3.81Å
104	M	97.9	Very high	96.6	Very high	94 Å²	94	72.4 Å²	72.4	46%	0.463	35%	0.349	S	S	.	.	H	α-helix	trans	-65.9	-41.8	173.4	-65.7	-62	-169	0	0	111.8	T100 G101 I106 I107 Q108 V117	T100-M104 WeakPolarHBondContact O-CG 3.38Å; T100-M104 PolarHBondContact O-N 3.03Å; T100-M104 VanDerWaalsContact O-N 3.13Å; G101-M104 WeakPolarHBondContact O-CA 3.37Å; G101-M104 WeakPolarHBondContact O-CB 3.29Å; G101-M104 PolarHBondContact O-N 3.15Å; M104-I106 VanDerWaalsContact C-N 3.27Å; M104-I106 PolarHBondContact O-N 2.77Å; M104-I107 WeakPolarHBondContact O-CB 3.48Å; M104-I107 PolarHBondContact O-N 2.92Å; M104-I107 VanDerWaalsContact O-N 3.15Å; M104-I107 HydrophobicContact SD-CD1 4.19Å; M104-Q108 PolarHBondContact O-N 2.71Å; M104-V117 HydrophobicContact CE-CB 3.81Å; M104-V117 HydrophobicContact CE-CG2 3.86Å; M104-V117 HydrophobicContact SD-CB 4.34Å; M104-V117 HydrophobicContact SD-CG2 3.73Å
105	D	97.9	Very high	96.6	Very high	100 Å²	100	73.8 Å²	73.8	54%	0.535	36%	0.357	S	S	.	.	H	α-helix	trans	-59.4	-40.2	175	-62.6	-30.3	0	0	0	111.3	G101 L102 R109	G101-D105 PolarHBondContact O-N 3.22Å; L102-D105 PolarHBondContact O-N 2.62Å; D105-R109 WeakPolarHBondContact O-CB 3.21Å; D105-R109 PolarHBondContact O-N 3.38Å
106	I	97.9	Very high	96.5	Very high	8 Å²	8	76.8 Å²	76.8	4%	0.041	37%	0.373	C	S	.	.	H	α-helix	trans	-65.2	-44.1	174.9	-70	168.4	0	0	0	111.1	F66 P73 I75 L102 M103 M104 R109 F110	F66-I106 HydrophobicContact CD1-CD1 3.72Å; F66-I106 HydrophobicContact CE1-CD1 4.21Å; P73-I106 HydrophobicContact CB-CD1 4.05Å; P73-I106 HydrophobicContact CG-CD1 3.83Å; P73-I106 HydrophobicContact CG-CG1 4.03Å; I75-I106 HydrophobicContact CG2-CD1 4.36Å; L102-I106 HydrophobicContact CD1-CD1 4.2Å; L102-I106 HydrophobicContact CG-CD1 4.13Å; L102-I106 WeakPolarHBondContact O-CD1 3.31Å; L102-I106 WeakPolarHBondContact O-CG1 3.33Å; L102-I106 PolarHBondContact O-N 3.45Å; M103-I106 HydrophobicContact CE-CG2 4.12Å; M103-I106 PolarHBondContact O-N 2.74Å; M104-I106 VanDerWaalsContact C-N 3.27Å; M104-I106 PolarHBondContact O-N 2.77Å; I106-R109 PolarHBondContact O-N 2.74Å; I106-F110 HydrophobicContact CG2-CD2 4.06Å; I106-F110 WeakPolarHBondContact O-CD2 3.43Å; I106-F110 PolarHBondContact O-N 3.33Å
107	I	97.8	Very high	96.6	Very high	26 Å²	26	76.9 Å²	76.9	13%	0.133	37%	0.372	C	S	.	.	H	α-helix	trans	-60	-47.3	177.1	-72.4	159.4	0	0	0	111	M103 M104 Q111 H112 V115 V117	M103-I107 HydrophobicContact CE-CD1 4.24Å; M103-I107 HydrophobicContact CE-CG1 3.99Å; M103-I107 HydrophobicContact CG-CD1 4.24Å; M103-I107 WeakPolarHBondContact O-CD1 3.46Å; M103-I107 VanDerWaalsContact O-CG1 3.26Å; M103-I107 WeakPolarHBondContact O-CG1 3.4Å; M103-I107 PolarHBondContact O-N 2.72Å; M104-I107 WeakPolarHBondContact O-CB 3.48Å; M104-I107 PolarHBondContact O-N 2.92Å; M104-I107 VanDerWaalsContact O-N 3.15Å; M104-I107 HydrophobicContact SD-CD1 4.19Å; I107-Q111 WeakPolarHBondContact O-CA 3.33Å; I107-Q111 PolarHBondContact O-N 3.03Å; I107-H112 HydrophobicContact CB-CB 4.44Å; I107-H112 HydrophobicContact CG1-CB 4.32Å; I107-H112 HydrophobicContact CG2-CB 4.2Å; I107-H112 PolarHBondContact O-N 3.25Å; I107-V115 HydrophobicContact CD1-CB 4Å; I107-V115 HydrophobicContact CD1-CG1 3.42Å; I107-V115 VanDerWaalsContact CD1-CG1 3.42Å; I107-V115 HydrophobicContact CG1-CB 4.19Å; I107-V115 HydrophobicContact CG1-CG1 3.98Å; I107-V117 HydrophobicContact CD1-CG2 3.26Å
108	Q	97.9	Very high	96.8	Very high	156 Å²	156	69.4 Å²	69.4	73%	0.729	34%	0.34	S	S	*	.	H	α-helix	trans	-65.9	-47	178.4	-174.2	176.8	-1	0	0	111.7	M104 F110 Q111	M104-Q108 PolarHBondContact O-N 2.71Å; Q108-F110 PolarHBondContact O-N 3.19Å; Q108-Q111 PolarHBondContact O-N 2.85Å
109	R	97.5	Very high	96.9	Very high	177 Å²	177	65.8 Å²	65.8	67%	0.668	33%	0.33	S	S	*	.	H	α-helix	trans	-65.7	-37.6	-176.6	179.2	174.3	171.4	-174.6	-6	113.5	G71 D105 I106	G71-R109 PolarHBondContact O-NH2 3.29Å; D105-R109 WeakPolarHBondContact O-CB 3.21Å; D105-R109 PolarHBondContact O-N 3.38Å; I106-R109 PolarHBondContact O-N 2.74Å
110	F	96.9	Very high	96.9	Very high	50 Å²	50	65.5 Å²	65.5	22%	0.219	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	11.8	-179.4	-61.7	-77.4	0	0	0	113.2	R72 P73 S76 I106 Q108 H112	R72-F110 HydrophobicContact CB-CE1 3.81Å; R72-F110 HydrophobicContact CB-CZ 3.95Å; R72-F110 HydrophobicContact CG-CD1 3.99Å; R72-F110 HydrophobicContact CG-CE1 3.65Å; R72-F110 HydrophobicContact CG-CE2 4.43Å; R72-F110 HydrophobicContact CG-CZ 3.9Å; P73-F110 VanDerWaalsContact CD-CE2 3.44Å; P73-F110 HydrophobicContact CG-CE2 4.39Å; S76-F110 WeakPolarHBondContact OG-CB 3.3Å; S76-F110 WeakPolarHBondContact OG-CG 3.47Å; I106-F110 HydrophobicContact CG2-CD2 4.06Å; I106-F110 WeakPolarHBondContact O-CD2 3.43Å; I106-F110 PolarHBondContact O-N 3.33Å; Q108-F110 PolarHBondContact O-N 3.19Å; F110-H112 VanDerWaalsContact C-N 3.28Å; F110-H112 PolarHBondContact O-N 3.07Å
111	Q	97.2	Very high	96.9	Very high	145 Å²	145	64.8 Å²	64.8	68%	0.678	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	37.3	174.2	-56.8	-171.3	-6.6	0	0	115	I107 Q108 K113	I107-Q111 WeakPolarHBondContact O-CA 3.33Å; I107-Q111 PolarHBondContact O-N 3.03Å; Q108-Q111 PolarHBondContact O-N 2.85Å; Q111-K113 VanDerWaalsContact O-CG 3.25Å; Q111-K113 WeakPolarHBondContact O-CG 3.24Å
112	H	97.7	Very high	96.7	Very high	14 Å²	14	67.5 Å²	67.5	7%	0.065	35%	0.347	C	S	.	.			trans	-66.4	137.3	174.6	-66.6	-58.7	0	0	0	110.5	S76 V79 E83 I107 F110 V115	S76-H112 PolarHBondContact O-CE1 3.41Å; S76-H112 PolarHBondContact OG-NE2 3.12Å; V79-H112 HydrophobicContact CG1-CB 4.35Å; V79-H112 WeakPolarHBondContact CG1-ND1 3.42Å; E83-H112 WeakPolarHBondContact OE2-CA 3.35Å; E83-H112 IonicContact OE2-CE1 3.45Å; E83-H112 IonicContact OE2-CG 3.5Å; E83-H112 IonicContact OE2-ND1 2.72Å; E83-H112 PolarHBondContact OE2-ND1 3.45Å; I107-H112 HydrophobicContact CB-CB 4.44Å; I107-H112 HydrophobicContact CG1-CB 4.32Å; I107-H112 HydrophobicContact CG2-CB 4.2Å; I107-H112 PolarHBondContact O-N 3.25Å; F110-H112 VanDerWaalsContact C-N 3.28Å; F110-H112 PolarHBondContact O-N 3.07Å; H112-V115 HydrophobicContact CB-CG2 3.83Å
113	K	95.4	Very high	96.6	Very high	178 Å²	178	65.2 Å²	65.2	77%	0.774	34%	0.336	S	S	*	.			trans	-122.4	-23.8	-166.4	-54.5	-173	-177.1	173	0	114.8	E83 Q111	E83-K113 PolarHBondContact OE1-N 3.36Å; Q111-K113 VanDerWaalsContact O-CG 3.25Å; Q111-K113 WeakPolarHBondContact O-CG 3.24Å
114	K	95.2	Very high	96.5	Very high	55 Å²	55	67.9 Å²	67.9	24%	0.239	35%	0.346	C	S	.	.	S	Bend	trans	-100	4.1	-178.8	-53.6	-174.2	-179.2	177.6	0	112.7	E83 V85 I88 T90 V91	E83-K114 HydrophobicContact CB-CD 4.49Å; E83-K114 HydrophobicContact CG-CB 4.19Å; E83-K114 HydrophobicContact CG-CD 4.34Å; E83-K114 HydrophobicContact CG-CG 4.3Å; E83-K114 WeakPolarHBondContact O-CE 3.47Å; E83-K114 PolarHBondContact O-NZ 2.99Å; E83-K114 PolarHBondContact OE1-N 3.46Å; V85-K114 PolarHBondContact O-NZ 3.2Å; I88-K114 VanDerWaalsContact O-CD 3.26Å; I88-K114 WeakPolarHBondContact O-CD 3.32Å; I88-K114 WeakPolarHBondContact O-CE 3.42Å; I88-K114 PolarHBondContact O-NZ 3.14Å; T90-K114 CarbonylContact C-O 3.59Å; T90-K114 WeakPolarHBondContact CA-O 3.49Å; V91-K114 PolarHBondContact N-O 3.05Å
115	V	97.1	Very high	96.5	Very high	30 Å²	30	63.5 Å²	63.5	18%	0.182	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	132.7	-169.7	-180	0	0	0	0	112.6	V79 V91 V93 I107 H112 V117	V79-V115 HydrophobicContact CG1-CG2 3.48Å; V79-V115 VanDerWaalsContact CG1-CG2 3.48Å; V91-V115 HydrophobicContact CB-CG2 4.41Å; V91-V115 VanDerWaalsContact O-CA 3.27Å; V91-V115 WeakPolarHBondContact O-CA 3.34Å; V93-V115 HydrophobicContact CB-CG1 4.19Å; V93-V115 HydrophobicContact CG2-CG1 3.68Å; I107-V115 HydrophobicContact CD1-CB 4Å; I107-V115 HydrophobicContact CD1-CG1 3.42Å; I107-V115 VanDerWaalsContact CD1-CG1 3.42Å; I107-V115 HydrophobicContact CG1-CB 4.19Å; I107-V115 HydrophobicContact CG1-CG1 3.98Å; H112-V115 HydrophobicContact CB-CG2 3.83Å; V115-V117 HydrophobicContact CG1-CG2 4.3Å
116	L	95.9	Very high	96.5	Very high	63 Å²	63	61 Å²	61	33%	0.33	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	127.9	160	175.3	64.4	0	0	0	108.8	T90 V91 V92 V93 V118 A134 R140	T90-L116 HydrophobicContact CG2-CB 4.38Å; V91-L116 PolarHBondContact O-N 3.43Å; V92-L116 CarbonylContact C-O 3.52Å; V92-L116 WeakPolarHBondContact CA-O 3.47Å; V93-L116 PolarHBondContact N-O 3.05Å; L116-V118 HydrophobicContact CD2-CG2 4.04Å; L116-V118 HydrophobicContact CG-CG2 4.03Å; L116-A134 HydrophobicContact CD2-CB 4.15Å; L116-R140 VanDerWaalsContact CD2-NH2 3.28Å
117	V	97.5	Very high	96.5	Very high	18 Å²	18	60.9 Å²	60.9	11%	0.109	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	134	172.3	-172.1	0	0	0	0	109.9	V93 V95 T100 M103 M104 I107 V115	V93-V117 WeakPolarHBondContact O-CA 3.21Å; V95-V117 HydrophobicContact CG2-CG1 3.67Å; T100-V117 HydrophobicContact CG2-CG1 4Å; M103-V117 HydrophobicContact CB-CG1 4.22Å; M103-V117 HydrophobicContact CB-CG2 4.31Å; M103-V117 HydrophobicContact CG-CG1 4.2Å; M103-V117 HydrophobicContact CG-CG2 3.81Å; M104-V117 HydrophobicContact CE-CB 3.81Å; M104-V117 HydrophobicContact CE-CG2 3.86Å; M104-V117 HydrophobicContact SD-CB 4.34Å; M104-V117 HydrophobicContact SD-CG2 3.73Å; I107-V117 HydrophobicContact CD1-CG2 3.26Å; V115-V117 HydrophobicContact CG1-CG2 4.3Å
118	V	96.9	Very high	96.5	Very high	13 Å²	13	59.6 Å²	59.6	8%	0.079	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	140	-179.8	172.2	0	0	0	0	109.6	V92 V93 V94 V95 L116 N130 A134	V92-V118 HydrophobicContact CG1-CB 4.05Å; V92-V118 HydrophobicContact CG1-CG2 3.48Å; V92-V118 VanDerWaalsContact CG1-CG2 3.48Å; V93-V118 PolarHBondContact O-N 3.36Å; V94-V118 CarbonylContact C-O 3.6Å; V94-V118 VanDerWaalsContact CA-O 3.28Å; V94-V118 WeakPolarHBondContact CA-O 3.26Å; V94-V118 HydrophobicContact CG1-CG1 4.39Å; V94-V118 HydrophobicContact CG2-CB 4.29Å; V95-V118 PolarHBondContact N-O 3.37Å; L116-V118 HydrophobicContact CD2-CG2 4.04Å; L116-V118 HydrophobicContact CG-CG2 4.03Å; V118-N130 HydrophobicContact CG1-CB 3.99Å; V118-A134 HydrophobicContact CG1-CB 4.48Å; V118-A134 HydrophobicContact CG2-CB 3.62Å
119	P	96.4	Very high	96.5	Very high	72 Å²	72	53.7 Å²	53.7	47%	0.468	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	130.6	172.7	28.7	-34.6	0	0	0	111.5	V95 N130	V95-P119 CarbonylContact O-C 3.58Å; V95-P119 WeakPolarHBondContact O-CA 3.36Å; P119-N130 PolarHBondContact O-ND2 3.39Å
120	G	95.4	Very high	96.5	Very high	21 Å²	21	48.2 Å²	48.2	22%	0.216	26%	0.26	C	S	.	.			trans	-78	174.2	175.8	0	0	0	0	0	114.4	V95	V95-G120 PolarHBondContact O-N 2.94Å
121	G	94.3	Very high	96.6	Very high	30 Å²	30	45.8 Å²	45.8	31%	0.309	25%	0.249	S	C	.	.			trans	-103.8	-177.9	168.2	0	0	0	0	0	111.5	T123 S127	G121-T123 PolarHBondContact O-N 3.37Å; G121-S127 PolarHBondContact N-OG 3.06Å; G121-S127 VanDerWaalsContact N-OG 3.14Å; G121-S127 PolarHBondContact O-OG 2.81Å
122	S	93.2	Very high	96.6	Very high	98 Å²	98	39 Å²	39	69%	0.685	22%	0.218	S	C	*	.	S	Bend	trans	-56.3	-33.2	178	50.8	0	0	0	0	113.6	R126	S122-R126 WeakPolarHBondContact OG-CD 3.47Å; S122-R126 PolarHBondContact OG-NE 3.07Å
123	T	95.4	Very high	96.5	Very high	22 Å²	22	41 Å²	41	14%	0.135	24%	0.237	C	C	.	.	S	Bend	trans	-119.6	172.5	-172.8	74	0	0	0	0	113.8	G121 R126 S127 F231 E232	G121-T123 PolarHBondContact O-N 3.37Å; T123-R126 WeakPolarHBondContact OG1-CG 3.28Å; T123-R126 PolarHBondContact OG1-N 3.36Å; T123-S127 WeakPolarHBondContact O-CB 3.22Å; T123-S127 PolarHBondContact O-N 2.81Å; T123-S127 PolarHBondContact O-OG 2.69Å; T123-F231 VanDerWaalsContact CB-O 3.29Å; T123-F231 WeakPolarHBondContact CB-O 3.13Å; T123-F231 WeakPolarHBondContact CG2-O 3.5Å; T123-F231 PolarHBondContact OG1-O 3.29Å; T123-E232 WeakPolarHBondContact CG2-OE1 3.41Å; T123-E232 VanDerWaalsContact CG2-OE2 3.31Å; T123-E232 WeakPolarHBondContact CG2-OE2 3.23Å
124	R	95.4	Very high	96.4	Very high	56 Å²	56	32.8 Å²	32.8	21%	0.211	20%	0.202	C	C	.	.	H	α-helix	trans	-59.1	-50.8	175.5	-171.7	-178.1	-169.4	-106.1	-8	111.4	S127 I128 D153 M210 T235	R124-S127 PolarHBondContact O-N 2.93Å; R124-I128 HydrophobicContact CG-CD1 3.81Å; R124-I128 VanDerWaalsContact O-CG1 3.29Å; R124-I128 WeakPolarHBondContact O-CG1 3.4Å; R124-I128 PolarHBondContact O-N 2.85Å; R124-D153 IonicContact CZ-OD1 2.66Å; R124-D153 IonicContact NE-OD1 3.29Å; R124-D153 PolarHBondContact NE-OD1 3.19Å; R124-D153 IonicContact NH2-OD1 3.41Å; R124-D153 PolarHBondContact NH2-OD1 3.3Å; R124-M210 PolarHBondContact NH2-SD 2.93Å; R124-T235 PolarHBondContact NH1-O 3.43Å
125	H	97.7	Very high	96.3	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-68.1	-39.8	-176.9	-79.9	-58	0	0	0	112.8	S127 I128 C129 Y223 D230 F231 G234 T235 E236 L240	H125-S127 VanDerWaalsContact C-N 3.33Å; H125-S127 PolarHBondContact O-N 3.4Å; H125-I128 PolarHBondContact O-N 2.95Å; H125-C129 VanDerWaalsContact O-CB 3.3Å; H125-C129 WeakPolarHBondContact O-CB 3.28Å; H125-C129 PolarHBondContact O-N 2.95Å; H125-Y223 HydrophobicContact CB-CE1 3.96Å; H125-Y223 AromaticContact ND1-CE1 3.63Å; H125-Y223 AromaticContact ND1-CZ 3.71Å; H125-Y223 PolarHBondContact ND1-OH 3.26Å; H125-D230 PolarHBondContact CD2-O 3.19Å; H125-F231 HydrophobicContact CB-CD1 3.91Å; H125-F231 HydrophobicContact CB-CE1 4.47Å; H125-G234 PolarHBondContact CD2-O 3.13Å; H125-G234 PolarHBondContact NE2-O 3.02Å; H125-T235 PolarHBondContact NE2-N 3.47Å; H125-E236 PolarHBondContact NE2-N 3.16Å; H125-L240 WeakPolarHBondContact CE1-CD1 3.41Å; H125-L240 WeakPolarHBondContact ND1-CD1 3.47Å
126	R	97.6	Very high	95.7	Very high	49 Å²	49	30.3 Å²	30.3	19%	0.185	20%	0.198	C	C	.	.	H	α-helix	trans	-61.9	-42.3	174	-63.2	-179.8	-156.5	-91.2	12.1	111.3	S122 T123 C129 N130 E228 F231 E232	S122-R126 WeakPolarHBondContact OG-CD 3.47Å; S122-R126 PolarHBondContact OG-NE 3.07Å; T123-R126 WeakPolarHBondContact OG1-CG 3.28Å; T123-R126 PolarHBondContact OG1-N 3.36Å; R126-C129 PolarHBondContact O-N 2.78Å; R126-N130 PolarHBondContact O-N 3.44Å; R126-N130 PolarHBondContact O-OD1 3.45Å; R126-E228 IonicContact CZ-OE1 3.16Å; R126-E228 IonicContact CZ-OE2 2.83Å; R126-E228 IonicContact NH1-OE1 3.16Å; R126-E228 PolarHBondContact NH1-OE1 2.85Å; R126-E228 IonicContact NH1-OE2 2.71Å; R126-E228 PolarHBondContact NH1-OE2 2.85Å; R126-E228 IonicContact NH2-OE1 3.33Å; R126-E228 PolarHBondContact NH2-OE1 3.16Å; R126-E228 IonicContact NH2-OE2 2.77Å; R126-E228 PolarHBondContact NH2-OE2 3.44Å; R126-F231 HydrophobicContact CB-CD1 4.44Å; R126-F231 HydrophobicContact CG-CB 4Å; R126-F231 HydrophobicContact CG-CD1 3.62Å; R126-F231 HydrophobicContact CG-CE1 4.43Å; R126-F231 HydrophobicContact CG-CG 4.06Å; R126-E232 IonicContact CZ-OE2 3.49Å; R126-E232 IonicContact NE-OE2 3.3Å; R126-E232 PolarHBondContact NE-OE2 3Å; R126-E232 IonicContact NH2-OE2 2.65Å; R126-E232 PolarHBondContact NH2-OE2 3.01Å
127	S	97.8	Very high	94.8	Very high	4 Å²	4	32.5 Å²	32.5	3%	0.028	21%	0.207	C	C	.	.	H	α-helix	trans	-63.5	-43.3	175.3	-62.1	0	0	0	0	112.8	V94 G121 T123 R124 H125 N130 G131	V94-S127 WeakPolarHBondContact CG1-O 3.44Å; G121-S127 PolarHBondContact N-OG 3.06Å; G121-S127 VanDerWaalsContact N-OG 3.14Å; G121-S127 PolarHBondContact O-OG 2.81Å; T123-S127 WeakPolarHBondContact O-CB 3.22Å; T123-S127 PolarHBondContact O-N 2.81Å; T123-S127 PolarHBondContact O-OG 2.69Å; R124-S127 PolarHBondContact O-N 2.93Å; H125-S127 VanDerWaalsContact C-N 3.33Å; H125-S127 PolarHBondContact O-N 3.4Å; S127-N130 PolarHBondContact O-N 3.11Å; S127-G131 PolarHBondContact O-N 3.09Å; S127-G131 VanDerWaalsContact O-N 3.12Å
128	I	98.4	Very high	92.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-43.3	176.2	-65	164.9	0	0	0	110.6	V48 P50 R124 H125 N130 G131 V132 I151 Y223	V48-I128 HydrophobicContact CG1-CG2 4.44Å; P50-I128 HydrophobicContact CB-CG1 3.96Å; P50-I128 HydrophobicContact CG-CD1 4.13Å; P50-I128 HydrophobicContact CG-CG1 3.75Å; R124-I128 HydrophobicContact CG-CD1 3.81Å; R124-I128 VanDerWaalsContact O-CG1 3.29Å; R124-I128 WeakPolarHBondContact O-CG1 3.4Å; R124-I128 PolarHBondContact O-N 2.85Å; H125-I128 PolarHBondContact O-N 2.95Å; I128-N130 PolarHBondContact O-N 3.11Å; I128-G131 PolarHBondContact O-N 3.34Å; I128-G131 VanDerWaalsContact O-N 3.14Å; I128-V132 HydrophobicContact CG2-CG2 4.12Å; I128-V132 WeakPolarHBondContact O-CB 3.23Å; I128-V132 WeakPolarHBondContact O-CG2 3.33Å; I128-V132 PolarHBondContact O-N 2.64Å; I128-I151 HydrophobicContact CD1-CG2 3.9Å; I128-I151 HydrophobicContact CG1-CG2 4.33Å; I128-I151 HydrophobicContact CG2-CD1 3.49Å; I128-I151 VanDerWaalsContact CG2-CD1 3.49Å; I128-I151 HydrophobicContact CG2-CG1 3.88Å; I128-I151 HydrophobicContact CG2-CG2 4.41Å; I128-Y223 HydrophobicContact CB-CE2 4.34Å; I128-Y223 WeakPolarHBondContact CB-OH 3.37Å; I128-Y223 HydrophobicContact CG2-CE2 3.63Å; I128-Y223 VanDerWaalsContact CG2-OH 3.31Å; I128-Y223 WeakPolarHBondContact CG2-OH 3.47Å
129	C	98.1	Very high	90.9	Very high	31 Å²	31	51.3 Å²	51.3	21%	0.209	28%	0.282	C	S	.	.	H	α-helix	trans	-56.4	-48.3	176.5	-176.7	0	0	0	0	111.8	H125 R126 G131 V132 A133 Y223 F231	H125-C129 VanDerWaalsContact O-CB 3.3Å; H125-C129 WeakPolarHBondContact O-CB 3.28Å; H125-C129 PolarHBondContact O-N 2.95Å; R126-C129 PolarHBondContact O-N 2.78Å; C129-G131 VanDerWaalsContact C-N 3.33Å; C129-G131 PolarHBondContact O-N 2.65Å; C129-V132 PolarHBondContact O-N 3.06Å; C129-A133 WeakPolarHBondContact O-CB 3.48Å; C129-A133 PolarHBondContact O-N 3.29Å; C129-Y223 HydrophobicContact CB-CD1 3.88Å; C129-Y223 HydrophobicContact CB-CD2 4.35Å; C129-Y223 HydrophobicContact CB-CE1 4.3Å; C129-Y223 HydrophobicContact CB-CG 3.94Å; C129-F231 HydrophobicContact CB-CE1 3.93Å; C129-F231 HydrophobicContact CB-CZ 4.49Å
130	N	97.6	Very high	89.4	Confident	62 Å²	62	50.5 Å²	50.5	33%	0.332	27%	0.27	S	S	.	.	H	α-helix	trans	-56.8	-45.2	174.5	-68.9	6.8	0	0	0	112	V118 P119 R126 S127 I128 A133 A134	V118-N130 HydrophobicContact CG1-CB 3.99Å; P119-N130 PolarHBondContact O-ND2 3.39Å; R126-N130 PolarHBondContact O-N 3.44Å; R126-N130 PolarHBondContact O-OD1 3.45Å; S127-N130 PolarHBondContact O-N 3.11Å; I128-N130 PolarHBondContact O-N 3.11Å; N130-A133 PolarHBondContact O-N 3.37Å; N130-A134 WeakPolarHBondContact O-CB 3.33Å; N130-A134 PolarHBondContact O-N 2.92Å; N130-A134 VanDerWaalsContact O-N 3.09Å
131	G	97.5	Very high	87.7	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-67.9	-33.8	179.6	0	0	0	0	0	114.1	S127 I128 C129	S127-G131 PolarHBondContact O-N 3.09Å; S127-G131 VanDerWaalsContact O-N 3.12Å; I128-G131 PolarHBondContact O-N 3.34Å; I128-G131 VanDerWaalsContact O-N 3.14Å; C129-G131 VanDerWaalsContact C-N 3.33Å; C129-G131 PolarHBondContact O-N 2.65Å
132	V	97.2	Very high	86.1	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.018	31%	0.308	C	S	.	.	H	α-helix	trans	-70	-45.6	173.2	168.3	0	0	0	0	110.5	V48 I128 C129 A134 L135 V149 Y216 I219 C220	V48-V132 HydrophobicContact CG2-CG2 4.16Å; I128-V132 HydrophobicContact CG2-CG2 4.12Å; I128-V132 WeakPolarHBondContact O-CB 3.23Å; I128-V132 WeakPolarHBondContact O-CG2 3.33Å; I128-V132 PolarHBondContact O-N 2.64Å; C129-V132 PolarHBondContact O-N 3.06Å; V132-A134 VanDerWaalsContact C-N 3.32Å; V132-A134 PolarHBondContact O-N 3.47Å; V132-L135 WeakPolarHBondContact O-CB 3.49Å; V132-L135 PolarHBondContact O-N 3.32Å; V132-L135 VanDerWaalsContact O-N 3.11Å; V132-V149 HydrophobicContact CG2-CG1 4.39Å; V132-Y216 HydrophobicContact CG1-CE2 4.37Å; V132-I219 HydrophobicContact CG1-CG2 4.11Å; V132-I219 HydrophobicContact CG2-CG1 4.37Å; V132-I219 HydrophobicContact CG2-CG2 4.47Å; V132-C220 WeakPolarHBondContact CG1-SG 3.38Å
133	A	95.6	Very high	84.6	Confident	56 Å²	56	55.8 Å²	55.8	46%	0.463	31%	0.308	S	S	.	.	H	α-helix	trans	-60.1	-39.6	178.7	0	0	0	0	0	112.7	C129 N130 L135 G136	C129-A133 WeakPolarHBondContact O-CB 3.48Å; C129-A133 PolarHBondContact O-N 3.29Å; N130-A133 PolarHBondContact O-N 3.37Å; A133-L135 PolarHBondContact O-N 3.06Å; A133-L135 VanDerWaalsContact O-N 3.11Å; A133-G136 PolarHBondContact O-N 3.2Å
134	A	94.5	Very high	83.2	Confident	5 Å²	5	59 Å²	59	4%	0.041	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-12.7	177.2	0	0	0	0	0	114.8	L116 V118 N130 V132 R140	L116-A134 HydrophobicContact CD2-CB 4.15Å; V118-A134 HydrophobicContact CG1-CB 4.48Å; V118-A134 HydrophobicContact CG2-CB 3.62Å; N130-A134 WeakPolarHBondContact O-CB 3.33Å; N130-A134 PolarHBondContact O-N 2.92Å; N130-A134 VanDerWaalsContact O-N 3.09Å; V132-A134 VanDerWaalsContact C-N 3.32Å; V132-A134 PolarHBondContact O-N 3.47Å; A134-R140 PolarHBondContact O-NE 3.1Å
135	L	92.7	Very high	82.7	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.005	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-17.9	172.3	-68.4	165.9	0	0	0	112.9	V48 T90 V92 V132 A133 R140 P146 V149 Y216	V48-L135 HydrophobicContact CG2-CD1 3.77Å; T90-L135 HydrophobicContact CG2-CD2 3.98Å; V92-L135 HydrophobicContact CG2-CD1 4.19Å; V92-L135 HydrophobicContact CG2-CD2 3.6Å; V92-L135 HydrophobicContact CG2-CG 3.79Å; V132-L135 WeakPolarHBondContact O-CB 3.49Å; V132-L135 PolarHBondContact O-N 3.32Å; V132-L135 VanDerWaalsContact O-N 3.11Å; A133-L135 PolarHBondContact O-N 3.06Å; A133-L135 VanDerWaalsContact O-N 3.11Å; L135-R140 WeakPolarHBondContact O-CD 3.09Å; L135-P146 HydrophobicContact CB-CG 4.09Å; L135-P146 HydrophobicContact CD1-CG 4.23Å; L135-V149 HydrophobicContact CD1-CG1 4.12Å; L135-V149 HydrophobicContact CD1-CG2 3.96Å; L135-Y216 HydrophobicContact CB-CD2 4.45Å; L135-Y216 HydrophobicContact CB-CE2 3.9Å
136	G	84.3	Confident	82.4	Confident	32 Å²	32	60.8 Å²	60.8	33%	0.33	33%	0.33	S	S	.	.	S	Bend	trans	-101.8	1.9	179	0	0	0	0	0	115.7	A133 Q138 Y216	A133-G136 PolarHBondContact O-N 3.2Å; G136-Q138 PolarHBondContact O-N 3.42Å; G136-Y216 VanDerWaalsContact CA-OH 3.23Å; G136-Y216 WeakPolarHBondContact CA-OH 3.29Å; G136-Y216 PolarHBondContact N-OH 2.9Å
137	E	76.8	Confident	82.3	Confident	109 Å²	109	62.7 Å²	62.7	51%	0.509	34%	0.34	S	S	.	.			trans	-60.3	132.2	-178.2	-76.1	-173.8	-158.1	0	0	112.6	R139 R140	E137-R139 PolarHBondContact O-N 3.32Å; E137-R140 WeakPolarHBondContact O-CB 3.33Å; E137-R140 PolarHBondContact O-N 2.95Å
138	Q	53.9	Low	82.4	Confident	192 Å²	192	62.5 Å²	62.5	90%	0.897	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-11.9	-179.4	-65.2	-74.6	-28	0	0	115	G136	G136-Q138 PolarHBondContact O-N 3.42Å
139	R	58.6	Low	82.4	Confident	233 Å²	233	62.5 Å²	62.5	88%	0.879	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-16.5	175.1	-65.1	-179.6	176.3	-172.4	-0.8	113.1	E137	E137-R139 PolarHBondContact O-N 3.32Å
140	R	65.3	Low	82.4	Confident	55 Å²	55	61 Å²	61	21%	0.208	33%	0.329	C	S	.	.	S	Bend	trans	-81.5	131	169.9	-67.8	177.6	174.4	-99.8	-6.8	108.9	T90 L116 A134 L135 E137 A142 H144	T90-R140 PolarHBondContact OG1-NH1 2.89Å; L116-R140 VanDerWaalsContact CD2-NH2 3.28Å; A134-R140 PolarHBondContact O-NE 3.1Å; L135-R140 WeakPolarHBondContact O-CD 3.09Å; E137-R140 WeakPolarHBondContact O-CB 3.33Å; E137-R140 PolarHBondContact O-N 2.95Å; R140-A142 PolarHBondContact O-N 3.23Å; R140-H144 HydrophobicContact CB-CB 4.34Å
141	P	60.9	Low	82.5	Confident	84 Å²	84	58.1 Å²	58.1	55%	0.545	31%	0.313	S	S	.	.			trans	-59	139.9	171.3	-19	29.7	0	0	0	110	A143 H144	P141-A143 PolarHBondContact O-N 3.03Å; P141-H144 WeakPolarHBondContact O-CB 3.38Å; P141-H144 PolarHBondContact O-N 3.02Å; P141-H144 PolarHBondContact O-ND1 2.9Å
142	A	60.5	Low	82.5	Confident	94 Å²	94	58.1 Å²	58.1	78%	0.777	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-52.3	-30	-169.1	0	0	0	0	0	115.2	R140 H144 K145	R140-A142 PolarHBondContact O-N 3.23Å; A142-H144 PolarHBondContact O-N 3.45Å; A142-H144 VanDerWaalsContact O-N 3.14Å; A142-K145 WeakPolarHBondContact O-CB 3.49Å; A142-K145 PolarHBondContact O-N 2.86Å; A142-K145 VanDerWaalsContact O-N 3.1Å
143	A	60	Low	82.5	Confident	83 Å²	83	58.3 Å²	58.3	69%	0.686	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-62.2	-12.3	173.3	0	0	0	0	0	115.1	P141	P141-A143 PolarHBondContact O-N 3.03Å
144	H	67.6	Low	82.5	Confident	90 Å²	90	55.7 Å²	55.7	42%	0.417	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-101.1	1.5	176.8	-58.8	79.6	0	0	0	113.2	R140 P141 A142 P146	R140-H144 HydrophobicContact CB-CB 4.34Å; P141-H144 WeakPolarHBondContact O-CB 3.38Å; P141-H144 PolarHBondContact O-N 3.02Å; P141-H144 PolarHBondContact O-ND1 2.9Å; A142-H144 PolarHBondContact O-N 3.45Å; A142-H144 VanDerWaalsContact O-N 3.14Å; H144-P146 WeakPolarHBondContact O-CD 3.27Å
145	K	83.7	Confident	82.5	Confident	91 Å²	91	56 Å²	56	40%	0.396	29%	0.294	S	S	.	.	S	Bend	trans	-68.7	117.3	166.3	-175.6	-170.4	174.5	-168.9	0	106.9	A142 Y216 D217	A142-K145 WeakPolarHBondContact O-CB 3.49Å; A142-K145 PolarHBondContact O-N 2.86Å; A142-K145 VanDerWaalsContact O-N 3.1Å; K145-Y216 HydrophobicContact CD-CD1 4.4Å; K145-Y216 HydrophobicContact CD-CE1 4.49Å; K145-Y216 HydrophobicContact CG-CD1 4.41Å; K145-D217 IonicContact NZ-OD1 2.71Å; K145-D217 PolarHBondContact NZ-OD1 2.81Å
146	P	91.8	Very high	82.6	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.013	30%	0.295	C	S	.	.			trans	-67.9	145.9	-177.4	28.3	-34.1	0	0	0	110.6	P44 L135 H144 V149 Y216	P44-P146 CarbonylContact O-C 3.55Å; P44-P146 WeakPolarHBondContact O-CA 3.42Å; L135-P146 HydrophobicContact CB-CG 4.09Å; L135-P146 HydrophobicContact CD1-CG 4.23Å; H144-P146 WeakPolarHBondContact O-CD 3.27Å; P146-V149 HydrophobicContact CB-CG2 4.48Å; P146-V149 HydrophobicContact CG-CG2 3.89Å; P146-Y216 HydrophobicContact CG-CD2 3.76Å; P146-Y216 HydrophobicContact CG-CE2 4.5Å; P146-Y216 HydrophobicContact CG-CG 4.43Å; P146-Y216 WeakPolarHBondContact O-CB 3.42Å
147	K	96.1	Very high	83.1	Confident	90 Å²	90	55.1 Å²	55.1	39%	0.391	28%	0.281	S	S	.	.	S	Bend	trans	-79	-35.6	169.1	-178.4	57.1	-177.4	172.3	0	110.4	F43 P44 T215 Y216	F43-K147 HydrophobicContact CB-CB 4.05Å; F43-K147 HydrophobicContact CB-CG 4.35Å; F43-K147 HydrophobicContact CD2-CB 4.2Å; F43-K147 HydrophobicContact CD2-CG 4.45Å; P44-K147 HydrophobicContact CG-CB 4.31Å; P44-K147 PolarHBondContact O-N 3.16Å; K147-T215 VanDerWaalsContact O-CA 3.26Å; K147-T215 WeakPolarHBondContact O-CA 3.23Å; K147-Y216 PolarHBondContact O-N 2.79Å
148	V	98.4	Very high	84	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136	176.4	169.5	0	0	0	0	110.8	F43 P44 V45 S46 I150 A171 K172 F214	F43-V148 HydrophobicContact CD2-CB 4.27Å; F43-V148 HydrophobicContact CD2-CG2 4.04Å; F43-V148 HydrophobicContact CE2-CB 3.88Å; F43-V148 HydrophobicContact CE2-CG2 3.58Å; P44-V148 PolarHBondContact O-N 3.17Å; V45-V148 WeakPolarHBondContact CA-O 3.47Å; V45-V148 HydrophobicContact CG1-CG1 4.48Å; V45-V148 HydrophobicContact CG2-CB 4.37Å; S46-V148 PolarHBondContact N-O 3.35Å; S46-V148 VanDerWaalsContact N-O 3.16Å; V148-I150 HydrophobicContact CG1-CG1 4.49Å; V148-A171 HydrophobicContact CG1-CB 3.87Å; V148-A171 HydrophobicContact CG2-CB 4.23Å; V148-K172 HydrophobicContact CG2-CB 4.03Å; V148-F214 CarbonylContact C-O 3.46Å; V148-F214 WeakPolarHBondContact CA-O 3.43Å; V148-F214 WeakPolarHBondContact CG1-O 3.31Å
149	V	98.7	Very high	85.9	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	127.1	170.1	-177.8	0	0	0	0	109	S46 V48 V132 L135 P146 G213 F214 Y216 I219	S46-V149 CarbonylContact O-C 3.57Å; S46-V149 WeakPolarHBondContact O-CA 3.26Å; V48-V149 HydrophobicContact CB-CG1 4.37Å; V48-V149 HydrophobicContact CG2-CG1 3.67Å; V132-V149 HydrophobicContact CG2-CG1 4.39Å; L135-V149 HydrophobicContact CD1-CG1 4.12Å; L135-V149 HydrophobicContact CD1-CG2 3.96Å; P146-V149 HydrophobicContact CB-CG2 4.48Å; P146-V149 HydrophobicContact CG-CG2 3.89Å; V149-G213 WeakPolarHBondContact O-CA 3.48Å; V149-F214 PolarHBondContact N-O 3.27Å; V149-F214 PolarHBondContact O-N 3.4Å; V149-Y216 HydrophobicContact CG2-CD2 3.72Å; V149-Y216 HydrophobicContact CG2-CG 4.42Å; V149-I219 HydrophobicContact CB-CG2 4.46Å
150	I	98.9	Very high	87.5	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	119.8	170.6	-62.5	178	0	0	0	108.6	V45 S46 V47 V48 F82 V148 L164 A168 P211 Q212	V45-I150 HydrophobicContact CG1-CD1 3.92Å; V45-I150 HydrophobicContact CG1-CG1 4.03Å; S46-I150 PolarHBondContact O-N 2.83Å; V47-I150 CarbonylContact C-O 3.48Å; V47-I150 VanDerWaalsContact CA-O 3.24Å; V47-I150 WeakPolarHBondContact CA-O 3.37Å; V47-I150 HydrophobicContact CG2-CB 4.19Å; V48-I150 PolarHBondContact N-O 3.24Å; F82-I150 HydrophobicContact CE1-CG2 4.47Å; V148-I150 HydrophobicContact CG1-CG1 4.49Å; I150-L164 HydrophobicContact CD1-CD2 4.15Å; I150-L164 HydrophobicContact CG2-CD2 4.44Å; I150-A168 HydrophobicContact CD1-CB 4.48Å; I150-P211 HydrophobicContact CG2-CB 3.65Å; I150-Q212 CarbonylContact C-O 3.5Å; I150-Q212 VanDerWaalsContact CA-O 3.29Å; I150-Q212 WeakPolarHBondContact CA-O 3.29Å
151	I	98.8	Very high	89	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	129.9	170.5	-69.3	162.9	0	0	0	108.4	V48 I128 M210 Q212 F214 I219 C237	V48-I151 HydrophobicContact CB-CG1 4.44Å; I128-I151 HydrophobicContact CD1-CG2 3.9Å; I128-I151 HydrophobicContact CG1-CG2 4.33Å; I128-I151 HydrophobicContact CG2-CD1 3.49Å; I128-I151 VanDerWaalsContact CG2-CD1 3.49Å; I128-I151 HydrophobicContact CG2-CG1 3.88Å; I128-I151 HydrophobicContact CG2-CG2 4.41Å; I151-M210 HydrophobicContact CG2-SD 4.43Å; I151-Q212 PolarHBondContact N-O 2.78Å; I151-Q212 PolarHBondContact O-N 3.25Å; I151-F214 HydrophobicContact CB-CE2 4.45Å; I151-F214 HydrophobicContact CD1-CD2 3.87Å; I151-F214 HydrophobicContact CD1-CE2 3.73Å; I151-F214 HydrophobicContact CG1-CD2 4.49Å; I151-F214 HydrophobicContact CG1-CE2 4.45Å; I151-I219 HydrophobicContact CD1-CD1 4.12Å; I151-I219 HydrophobicContact CD1-CG1 3.96Å; I151-C237 HydrophobicContact CD1-CB 4.26Å
152	H	98.6	Very high	90.7	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.198	C	C	.	.			trans	-149.3	141.9	-179.5	-170.4	95.6	0	0	0	112.3	V48 L49 P50 F82 V159 M210 P211	V48-H152 PolarHBondContact O-N 2.89Å; V48-H152 VanDerWaalsContact O-N 3.08Å; L49-H152 WeakPolarHBondContact CA-O 3.28Å; L49-H152 HydrophobicContact CD2-CB 3.76Å; L49-H152 VanDerWaalsContact CD2-O 3.23Å; L49-H152 WeakPolarHBondContact CD2-O 3.31Å; P50-H152 WeakPolarHBondContact CD-O 3.19Å; F82-H152 HydrophobicContact CE2-CB 4.31Å; F82-H152 AromaticContact CE2-CD2 3.73Å; F82-H152 HydrophobicContact CZ-CB 3.73Å; F82-H152 AromaticContact CZ-CD2 3.62Å; F82-H152 AromaticContact CZ-CG 3.56Å; H152-V159 WeakPolarHBondContact NE2-CB 3.42Å; H152-M210 HydrophobicContact CB-CB 4.44Å; H152-M210 WeakPolarHBondContact CE1-CB 3.47Å; H152-M210 PolarHBondContact NE2-O 3.24Å; H152-P211 HydrophobicContact CB-CB 4.48Å; H152-P211 WeakPolarHBondContact CE1-CA 3.5Å; H152-P211 WeakPolarHBondContact CE1-CB 3.47Å; H152-P211 WeakPolarHBondContact CE1-CD 3.46Å; H152-P211 WeakPolarHBondContact CE1-CG 3.43Å; H152-P211 WeakPolarHBondContact ND1-CA 3.45Å; H152-P211 WeakPolarHBondContact ND1-CD 3.47Å; H152-P211 VanDerWaalsContact NE2-CD 3.35Å; H152-P211 WeakPolarHBondContact NE2-CD 3.48Å
153	D	96.8	Very high	92.5	Very high	7 Å²	7	31.1 Å²	31.1	4%	0.037	16%	0.163	C	C	.	.			trans	-74.4	132	179.9	-62.1	-49.3	0	0	0	110.3	R124 V155 R156 M210 K260	R124-D153 IonicContact CZ-OD1 2.66Å; R124-D153 IonicContact NE-OD1 3.29Å; R124-D153 PolarHBondContact NE-OD1 3.19Å; R124-D153 IonicContact NH2-OD1 3.41Å; R124-D153 PolarHBondContact NH2-OD1 3.3Å; D153-V155 HydrophobicContact CB-CG2 4.35Å; D153-V155 PolarHBondContact O-N 3.37Å; D153-R156 HydrophobicContact CB-CG 4.25Å; D153-R156 PolarHBondContact O-N 3.18Å; D153-R156 IonicContact OD2-CZ 2.92Å; D153-R156 IonicContact OD2-NE 2.72Å; D153-R156 PolarHBondContact OD2-NE 2.97Å; D153-R156 IonicContact OD2-NH2 2.71Å; D153-R156 PolarHBondContact OD2-NH2 2.86Å; D153-M210 HydrophobicContact CB-CG 4.31Å; D153-M210 WeakPolarHBondContact OD2-CG 3.28Å; D153-K260 IonicContact OD1-NZ 2.65Å; D153-K260 PolarHBondContact OD1-NZ 2.9Å; D153-K260 VanDerWaalsContact OD1-NZ 3.16Å; D153-K260 VanDerWaalsContact OD2-CE 3.22Å; D153-K260 WeakPolarHBondContact OD2-CE 3.29Å; D153-K260 IonicContact OD2-NZ 2.64Å; D153-K260 PolarHBondContact OD2-NZ 3.16Å
154	A	95.4	Very high	94.3	Very high	2 Å²	2	27.2 Å²	27.2	2%	0.017	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-2.7	-177.9	0	0	0	0	0	116.4	L49 A51 I75 T78	L49-A154 HydrophobicContact CB-CB 4.38Å; A51-A154 HydrophobicContact CB-CB 3.7Å; I75-A154 HydrophobicContact CD1-CB 3.84Å; I75-A154 HydrophobicContact CG1-CB 4.09Å; T78-A154 WeakPolarHBondContact CB-O 3.41Å; T78-A154 PolarHBondContact OG1-O 3.06Å
155	V	94.1	Very high	95.8	Very high	10 Å²	10	24.8 Å²	24.8	6%	0.061	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.8	33.1	-172.8	-61	0	0	0	0	112.4	K64 Q65 L74 D153 K260 V261	K64-V155 HydrophobicContact CG-CG1 4.26Å; Q65-V155 HydrophobicContact CB-CG1 3.71Å; L74-V155 HydrophobicContact CD2-CB 4.09Å; L74-V155 HydrophobicContact CD2-CG1 4.11Å; D153-V155 HydrophobicContact CB-CG2 4.35Å; D153-V155 PolarHBondContact O-N 3.37Å; V155-K260 HydrophobicContact CG2-CG 3.86Å; V155-V261 HydrophobicContact CB-CB 4.27Å; V155-V261 WeakPolarHBondContact O-CB 3.41Å; V155-V261 WeakPolarHBondContact O-CG2 3.44Å; V155-V261 PolarHBondContact O-N 2.56Å
156	R	95.7	Very high	96.5	Very high	11 Å²	11	25.9 Å²	25.9	4%	0.042	12%	0.124	C	C	.	.			trans	-136.1	67.6	178.5	-68.3	173.7	-173.2	-96.3	16.6	109.2	D153 F158 E209 L258 K260	D153-R156 HydrophobicContact CB-CG 4.25Å; D153-R156 PolarHBondContact O-N 3.18Å; D153-R156 IonicContact OD2-CZ 2.92Å; D153-R156 IonicContact OD2-NE 2.72Å; D153-R156 PolarHBondContact OD2-NE 2.97Å; D153-R156 IonicContact OD2-NH2 2.71Å; D153-R156 PolarHBondContact OD2-NH2 2.86Å; R156-F158 PolarHBondContact O-N 3.49Å; R156-E209 IonicContact CZ-OE2 3.55Å; R156-E209 IonicContact NH1-OE2 2.65Å; R156-E209 PolarHBondContact NH1-OE2 3.34Å; R156-E209 IonicContact NH2-OE2 3.15Å; R156-E209 PolarHBondContact NH2-OE2 3.1Å; R156-L258 WeakPolarHBondContact CD-O 3.49Å; R156-L258 PolarHBondContact NH1-O 3.28Å; R156-K260 HydrophobicContact CG-CB 4.26Å; R156-K260 HydrophobicContact CG-CG 4.28Å
157	P	94.7	Very high	96.8	Very high	4 Å²	4	25.8 Å²	25.8	3%	0.026	12%	0.123	C	C	.	.			trans	-67.9	-20.7	-168.7	28.5	-37.4	0	0	0	114.5	L74 S81 V159	L74-P157 HydrophobicContact CD1-CG 3.85Å; S81-P157 PolarHBondContact OG-O 2.98Å; P157-V159 PolarHBondContact O-N 3.22Å
158	F	94.7	Very high	96.9	Very high	30 Å²	30	21.5 Å²	21.5	13%	0.132	11%	0.105	C	C	.	.			trans	-91.4	79.7	-171.4	-44.8	-58.7	0	0	0	111.4	R156 W259 A270 I273 I274	R156-F158 PolarHBondContact O-N 3.49Å; F158-W259 HydrophobicContact CD2-CZ2 4.34Å; F158-W259 HydrophobicContact CE2-CH2 4.31Å; F158-W259 AromaticContact CE2-CZ2 3.91Å; F158-W259 HydrophobicContact CE2-CZ2 3.91Å; F158-A270 HydrophobicContact CE2-CB 4.13Å; F158-A270 HydrophobicContact CZ-CB 4.09Å; F158-I273 HydrophobicContact CD1-CG2 3.83Å; F158-I273 HydrophobicContact CD2-CD1 4.28Å; F158-I273 HydrophobicContact CE1-CB 4.01Å; F158-I273 HydrophobicContact CE1-CG2 3.47Å; F158-I273 VanDerWaalsContact CE1-CG2 3.47Å; F158-I273 HydrophobicContact CE2-CB 4.31Å; F158-I273 HydrophobicContact CE2-CD1 3.91Å; F158-I273 HydrophobicContact CE2-CG2 4.3Å; F158-I273 HydrophobicContact CG-CG2 4.38Å; F158-I273 HydrophobicContact CZ-CB 3.77Å; F158-I273 HydrophobicContact CZ-CD1 4.25Å; F158-I273 HydrophobicContact CZ-CG2 3.74Å; F158-I274 HydrophobicContact CE1-CG1 3.92Å; F158-I274 HydrophobicContact CZ-CD1 4.47Å; F158-I274 HydrophobicContact CZ-CG1 4.05Å
159	V	94.7	Very high	96.9	Very high	9 Å²	9	23.4 Å²	23.4	6%	0.055	12%	0.116	C	C	.	.			trans	-137.4	126.7	178.8	63.3	0	0	0	0	111.3	F82 H152 P157 L164 P211 L258	F82-V159 HydrophobicContact CE1-CG1 4.43Å; F82-V159 HydrophobicContact CE2-CG1 4.38Å; F82-V159 HydrophobicContact CZ-CG1 3.98Å; H152-V159 WeakPolarHBondContact NE2-CB 3.42Å; P157-V159 PolarHBondContact O-N 3.22Å; V159-L164 HydrophobicContact CG1-CD1 4.48Å; V159-L164 HydrophobicContact CG2-CD1 4.34Å; V159-L164 HydrophobicContact CG2-CD2 3.89Å; V159-L164 HydrophobicContact CG2-CG 3.91Å; V159-P211 HydrophobicContact CG2-CG 4.03Å; V159-L258 HydrophobicContact CB-CD2 4.31Å; V159-L258 HydrophobicContact CG2-CD2 4.03Å
160	D	93	Very high	96.9	Very high	88 Å²	88	23.9 Å²	23.9	47%	0.471	12%	0.12	S	C	.	.			trans	-96.4	148.5	-170	-48.9	-70.3	0	0	0	113.3	D162 F163 L164	D160-D162 VanDerWaalsContact C-N 3.32Å; D160-D162 PolarHBondContact O-N 2.88Å; D160-F163 PolarHBondContact O-N 3.42Å; D160-L164 PolarHBondContact O-N 2.89Å
161	E	96.4	Very high	96.9	Very high	63 Å²	63	23.9 Å²	23.9	29%	0.294	12%	0.12	S	C	.	.	H	α-helix	trans	-56.7	-42.5	177.9	-173.6	165.9	-153.7	0	0	112.3	V85 W87 F163 L164 H165	V85-E161 HydrophobicContact CG1-CG 4.15Å; V85-E161 HydrophobicContact CG2-CB 4Å; V85-E161 HydrophobicContact CG2-CG 3.99Å; W87-E161 HydrophobicContact CZ2-CG 4.21Å; W87-E161 PolarHBondContact NE1-OE1 2.84Å; E161-F163 PolarHBondContact O-N 3.14Å; E161-F163 VanDerWaalsContact O-N 3.1Å; E161-L164 PolarHBondContact O-N 3.39Å; E161-H165 WeakPolarHBondContact O-CB 3.45Å; E161-H165 PolarHBondContact O-N 2.88Å
162	D	96.5	Very high	96.9	Very high	63 Å²	63	27.5 Å²	27.5	34%	0.337	14%	0.136	S	C	.	.	H	α-helix	trans	-57.3	-24.3	175.7	-66.5	25.6	0	0	0	113.3	K36 L39 D160 K166	K36-D162 IonicContact NZ-OD1 2.75Å; K36-D162 PolarHBondContact NZ-OD1 2.9Å; K36-D162 IonicContact NZ-OD2 3.8Å; K36-D162 PolarHBondContact NZ-OD2 3.33Å; L39-D162 HydrophobicContact CD1-CB 4.24Å; L39-D162 WeakPolarHBondContact CD1-OD1 3.28Å; D160-D162 VanDerWaalsContact C-N 3.32Å; D160-D162 PolarHBondContact O-N 2.88Å; D162-K166 WeakPolarHBondContact O-CD 3.49Å; D162-K166 VanDerWaalsContact O-CE 3.23Å; D162-K166 WeakPolarHBondContact O-CE 3.36Å; D162-K166 WeakPolarHBondContact O-CG 3.39Å
163	F	97.5	Very high	96.9	Very high	11 Å²	11	33.6 Å²	33.6	5%	0.048	17%	0.165	C	C	.	.	H	α-helix	trans	-95.1	-38.3	175.9	-169.2	-103.1	0	0	0	112.3	D160 E161 H165 K166 I167 A179 P211 I252 L258	D160-F163 PolarHBondContact O-N 3.42Å; E161-F163 PolarHBondContact O-N 3.14Å; E161-F163 VanDerWaalsContact O-N 3.1Å; F163-H165 VanDerWaalsContact C-N 3.29Å; F163-H165 PolarHBondContact O-N 3.35Å; F163-K166 HydrophobicContact CD2-CD 4.49Å; F163-K166 PolarHBondContact O-N 2.91Å; F163-I167 HydrophobicContact CD1-CG1 4.29Å; F163-I167 HydrophobicContact CE1-CD1 4.26Å; F163-I167 HydrophobicContact CE1-CG1 3.83Å; F163-I167 HydrophobicContact CZ-CD1 4.24Å; F163-I167 HydrophobicContact CZ-CG1 4.12Å; F163-I167 PolarHBondContact O-N 3.21Å; F163-I167 VanDerWaalsContact O-N 3.14Å; F163-A179 HydrophobicContact CE1-CB 3.75Å; F163-A179 HydrophobicContact CZ-CB 3.76Å; F163-P211 HydrophobicContact CD1-CG 3.96Å; F163-P211 HydrophobicContact CE1-CG 3.9Å; F163-I252 HydrophobicContact CE2-CG2 3.93Å; F163-I252 HydrophobicContact CZ-CG2 4.41Å; F163-L258 HydrophobicContact CD1-CD1 4.41Å; F163-L258 HydrophobicContact CD1-CD2 4.34Å; F163-L258 HydrophobicContact CE1-CD1 3.8Å; F163-L258 HydrophobicContact CE1-CD2 4.47Å; F163-L258 HydrophobicContact CZ-CD1 4.18Å
164	L	98.2	Very high	96.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.2	-40.9	173.2	-70.4	169.3	0	0	0	111.8	F82 V85 W87 I88 I150 V159 D160 E161 K166 I167 A168 P211	F82-L164 HydrophobicContact CD1-CD1 3.99Å; F82-L164 HydrophobicContact CD1-CD2 4.31Å; F82-L164 HydrophobicContact CE1-CD1 3.96Å; F82-L164 HydrophobicContact CE1-CD2 3.57Å; F82-L164 HydrophobicContact CE1-CG 4.44Å; F82-L164 HydrophobicContact CZ-CD2 4.43Å; V85-L164 HydrophobicContact CG2-CD1 3.93Å; W87-L164 HydrophobicContact CH2-CB 3.86Å; W87-L164 HydrophobicContact CZ2-CB 4.22Å; I88-L164 HydrophobicContact CD1-CD1 4.43Å; I150-L164 HydrophobicContact CD1-CD2 4.15Å; I150-L164 HydrophobicContact CG2-CD2 4.44Å; V159-L164 HydrophobicContact CG1-CD1 4.48Å; V159-L164 HydrophobicContact CG2-CD1 4.34Å; V159-L164 HydrophobicContact CG2-CD2 3.89Å; V159-L164 HydrophobicContact CG2-CG 3.91Å; D160-L164 PolarHBondContact O-N 2.89Å; E161-L164 PolarHBondContact O-N 3.39Å; L164-K166 PolarHBondContact O-N 2.78Å; L164-I167 PolarHBondContact O-N 3.08Å; L164-A168 WeakPolarHBondContact O-CB 3.41Å; L164-A168 PolarHBondContact O-N 3.43Å; L164-P211 HydrophobicContact CD2-CB 4.05Å; L164-P211 HydrophobicContact CD2-CG 3.83Å
165	H	98.3	Very high	97.1	Very high	39 Å²	39	38.7 Å²	38.7	18%	0.181	19%	0.191	C	C	.	.	H	α-helix	trans	-59	-46.8	175.2	-173.8	-71.2	0	0	0	111.5	W87 E161 F163 I167 A168 T169	W87-H165 HydrophobicContact CZ2-CB 4.08Å; E161-H165 WeakPolarHBondContact O-CB 3.45Å; E161-H165 PolarHBondContact O-N 2.88Å; F163-H165 VanDerWaalsContact C-N 3.29Å; F163-H165 PolarHBondContact O-N 3.35Å; H165-I167 VanDerWaalsContact C-N 3.34Å; H165-I167 PolarHBondContact O-N 2.77Å; H165-A168 PolarHBondContact O-N 2.97Å; H165-T169 PolarHBondContact CE1-OG1 3.14Å; H165-T169 PolarHBondContact ND1-OG1 3.02Å; H165-T169 PolarHBondContact O-N 3.45Å; H165-T169 PolarHBondContact O-OG1 3.05Å
166	K	98.3	Very high	97.3	Very high	115 Å²	115	38.2 Å²	38.2	50%	0.5	19%	0.188	S	C	.	.	H	α-helix	trans	-59.2	-43.7	178.6	-67.8	167.6	-172.3	167.5	0	112	D162 F163 L164 A170 I252	D162-K166 WeakPolarHBondContact O-CD 3.49Å; D162-K166 VanDerWaalsContact O-CE 3.23Å; D162-K166 WeakPolarHBondContact O-CE 3.36Å; D162-K166 WeakPolarHBondContact O-CG 3.39Å; F163-K166 HydrophobicContact CD2-CD 4.49Å; F163-K166 PolarHBondContact O-N 2.91Å; L164-K166 PolarHBondContact O-N 2.78Å; K166-A170 VanDerWaalsContact O-CB 3.27Å; K166-A170 WeakPolarHBondContact O-CB 3.34Å; K166-A170 PolarHBondContact O-N 2.79Å; K166-I252 HydrophobicContact CB-CD1 4.31Å
167	I	98.7	Very high	97.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-41.7	177.2	-69.5	-77.6	0	0	0	111.1	F163 L164 H165 A171 P211 I252	F163-I167 HydrophobicContact CD1-CG1 4.29Å; F163-I167 HydrophobicContact CE1-CD1 4.26Å; F163-I167 HydrophobicContact CE1-CG1 3.83Å; F163-I167 HydrophobicContact CZ-CD1 4.24Å; F163-I167 HydrophobicContact CZ-CG1 4.12Å; F163-I167 PolarHBondContact O-N 3.21Å; F163-I167 VanDerWaalsContact O-N 3.14Å; L164-I167 PolarHBondContact O-N 3.08Å; H165-I167 VanDerWaalsContact C-N 3.34Å; H165-I167 PolarHBondContact O-N 2.77Å; I167-A171 WeakPolarHBondContact O-CB 3.35Å; I167-A171 PolarHBondContact O-N 3.02Å; I167-P211 HydrophobicContact CG1-CG 4.24Å; I167-I252 HydrophobicContact CD1-CB 4.41Å; I167-I252 HydrophobicContact CD1-CD1 3.96Å; I167-I252 HydrophobicContact CD1-CG1 4.37Å; I167-I252 HydrophobicContact CG1-CD1 4.44Å
168	A	98.6	Very high	97.6	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.5	-46.4	178.2	0	0	0	0	0	112.6	V41 F43 V45 W87 I150 L164 H165 A171 K172	V41-A168 HydrophobicContact CG1-CB 4.47Å; F43-A168 HydrophobicContact CE2-CB 4.35Å; F43-A168 HydrophobicContact CZ-CB 4.24Å; F43-A168 WeakPolarHBondContact CZ-O 3.44Å; V45-A168 HydrophobicContact CG2-CB 4.49Å; W87-A168 HydrophobicContact CH2-CB 4.14Å; W87-A168 HydrophobicContact CZ3-CB 3.99Å; I150-A168 HydrophobicContact CD1-CB 4.48Å; L164-A168 WeakPolarHBondContact O-CB 3.41Å; L164-A168 PolarHBondContact O-N 3.43Å; H165-A168 PolarHBondContact O-N 2.97Å; A168-A171 PolarHBondContact O-N 3.08Å; A168-K172 PolarHBondContact O-N 3.45Å
169	T	98.5	Very high	97.8	Very high	40 Å²	40	36 Å²	36	25%	0.245	18%	0.178	C	C	.	.	H	α-helix	trans	-61.9	-51.8	176.9	-55.1	0	0	0	0	111.1	H165 A171 K172 E173	H165-T169 PolarHBondContact CE1-OG1 3.14Å; H165-T169 PolarHBondContact ND1-OG1 3.02Å; H165-T169 PolarHBondContact O-N 3.45Å; H165-T169 PolarHBondContact O-OG1 3.05Å; T169-A171 VanDerWaalsContact C-N 3.27Å; T169-A171 PolarHBondContact O-N 3.11Å; T169-K172 WeakPolarHBondContact O-CB 3.41Å; T169-K172 PolarHBondContact O-N 3.44Å; T169-K172 VanDerWaalsContact O-N 3.11Å; T169-E173 WeakPolarHBondContact CG2-OE1 3.4Å; T169-E173 WeakPolarHBondContact O-CG 3.5Å; T169-E173 PolarHBondContact O-N 2.85Å; T169-E173 VanDerWaalsContact O-N 3.08Å
170	A	98.7	Very high	98	Very high	10 Å²	10	36.3 Å²	36.3	8%	0.083	18%	0.18	C	C	.	.	H	α-helix	trans	-61.5	-35.4	179.3	0	0	0	0	0	112.5	K166 E173 Q174 A177 K250 I252	K166-A170 VanDerWaalsContact O-CB 3.27Å; K166-A170 WeakPolarHBondContact O-CB 3.34Å; K166-A170 PolarHBondContact O-N 2.79Å; A170-E173 PolarHBondContact O-N 3.46Å; A170-Q174 WeakPolarHBondContact O-CB 3.12Å; A170-Q174 WeakPolarHBondContact O-CG 3.29Å; A170-Q174 PolarHBondContact O-N 3.17Å; A170-A177 HydrophobicContact CB-CB 3.65Å; A170-K250 HydrophobicContact CB-CB 4.19Å; A170-K250 HydrophobicContact CB-CG 4.03Å; A170-I252 HydrophobicContact CB-CD1 3.86Å
171	A	98.8	Very high	98.2	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-67.1	-40.5	174.3	0	0	0	0	0	112.7	V148 I167 A168 T169 E173 G175 A177 G213 T215	V148-A171 HydrophobicContact CG1-CB 3.87Å; V148-A171 HydrophobicContact CG2-CB 4.23Å; I167-A171 WeakPolarHBondContact O-CB 3.35Å; I167-A171 PolarHBondContact O-N 3.02Å; A168-A171 PolarHBondContact O-N 3.08Å; T169-A171 VanDerWaalsContact C-N 3.27Å; T169-A171 PolarHBondContact O-N 3.11Å; A171-E173 VanDerWaalsContact C-N 3.3Å; A171-E173 PolarHBondContact O-N 3.27Å; A171-G175 CarbonylContact O-C 3.46Å; A171-G175 WeakPolarHBondContact O-CA 3.37Å; A171-G175 PolarHBondContact O-N 3.3Å; A171-G175 VanDerWaalsContact O-N 3.08Å; A171-A177 HydrophobicContact CB-CB 4.22Å; A171-G213 WeakPolarHBondContact CB-O 3.42Å; A171-T215 WeakPolarHBondContact O-CG2 3.42Å
172	K	98.4	Very high	98.3	Very high	75 Å²	75	36 Å²	36	33%	0.326	18%	0.178	S	C	.	.	H	α-helix	trans	-60.3	-39.7	174.1	167.9	174.5	167.2	177.3	0	112	D42 F43 V148 A168 T169	D42-K172 IonicContact OD1-NZ 3.44Å; D42-K172 PolarHBondContact OD1-NZ 3.09Å; D42-K172 IonicContact OD2-NZ 3.46Å; D42-K172 PolarHBondContact OD2-NZ 3.42Å; F43-K172 HydrophobicContact CD1-CD 3.29Å; F43-K172 HydrophobicContact CD2-CD 4.31Å; F43-K172 HydrophobicContact CE1-CB 4.18Å; F43-K172 HydrophobicContact CE1-CD 3.23Å; F43-K172 HydrophobicContact CE1-CG 4.31Å; F43-K172 HydrophobicContact CE2-CB 4.08Å; F43-K172 HydrophobicContact CE2-CD 4.28Å; F43-K172 HydrophobicContact CG-CD 3.84Å; F43-K172 HydrophobicContact CZ-CB 3.8Å; F43-K172 HydrophobicContact CZ-CD 3.76Å; F43-K172 HydrophobicContact CZ-CG 4.42Å; V148-K172 HydrophobicContact CG2-CB 4.03Å; A168-K172 PolarHBondContact O-N 3.45Å; T169-K172 WeakPolarHBondContact O-CB 3.41Å; T169-K172 PolarHBondContact O-N 3.44Å; T169-K172 VanDerWaalsContact O-N 3.11Å
173	E	98.1	Very high	98.3	Very high	129 Å²	129	34.9 Å²	34.9	60%	0.603	17%	0.171	S	C	*	.	H	α-helix	trans	-78.5	-45.4	-177.7	-68.8	172.2	-172.5	0	0	113.6	T169 A170 A171	T169-E173 WeakPolarHBondContact CG2-OE1 3.4Å; T169-E173 WeakPolarHBondContact O-CG 3.5Å; T169-E173 PolarHBondContact O-N 2.85Å; T169-E173 VanDerWaalsContact O-N 3.08Å; A170-E173 PolarHBondContact O-N 3.46Å; A171-E173 VanDerWaalsContact C-N 3.3Å; A171-E173 PolarHBondContact O-N 3.27Å
174	Q	98.3	Very high	98.2	Very high	103 Å²	103	40.4 Å²	40.4	48%	0.481	21%	0.206	S	C	.	.	H	α-helix	trans	-107.3	6.3	-166.2	-50.4	-61.6	-42.6	0	0	113.1	A170 A176 T247 K250	A170-Q174 WeakPolarHBondContact O-CB 3.12Å; A170-Q174 WeakPolarHBondContact O-CG 3.29Å; A170-Q174 PolarHBondContact O-N 3.17Å; Q174-A176 PolarHBondContact O-N 2.78Å; Q174-T247 WeakPolarHBondContact O-CG2 3.36Å; Q174-K250 HydrophobicContact CB-CB 4.26Å; Q174-K250 HydrophobicContact CG-CB 4.04Å
175	G	98.7	Very high	98	Very high	12 Å²	12	44.7 Å²	44.7	12%	0.124	24%	0.236	C	C	.	.	S	Bend	trans	77	-36	-175.8	0	0	0	0	0	114	A171 F214 T215	A171-G175 CarbonylContact O-C 3.46Å; A171-G175 WeakPolarHBondContact O-CA 3.37Å; A171-G175 PolarHBondContact O-N 3.3Å; A171-G175 VanDerWaalsContact O-N 3.08Å; G175-F214 CarbonylContact O-C 3.6Å; G175-F214 WeakPolarHBondContact O-CA 3.34Å; G175-T215 PolarHBondContact O-N 3.49Å; G175-T215 PolarHBondContact O-OG1 3.2Å
176	A	98.8	Very high	98	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	151.7	174.2	0	0	0	0	0	112.6	Q174 G213 F214 A241 T247 A249 K250	Q174-A176 PolarHBondContact O-N 2.78Å; A176-G213 CarbonylContact C-O 3.57Å; A176-G213 WeakPolarHBondContact CA-O 3.19Å; A176-F214 HydrophobicContact CB-CD1 3.67Å; A176-F214 HydrophobicContact CB-CE1 3.95Å; A176-A241 HydrophobicContact CB-CB 4.4Å; A176-T247 HydrophobicContact CB-CG2 3.88Å; A176-A249 HydrophobicContact CB-CB 3.71Å; A176-A249 CarbonylContact O-C 3.55Å; A176-A249 WeakPolarHBondContact O-CA 3.42Å; A176-K250 PolarHBondContact O-N 3.01Å
177	A	98.9	Very high	97.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	152.8	175.3	0	0	0	0	0	111.4	A170 A171 Q212 G213 K250	A170-A177 HydrophobicContact CB-CB 3.65Å; A171-A177 HydrophobicContact CB-CB 4.22Å; A177-Q212 CarbonylContact O-C 3.59Å; A177-Q212 WeakPolarHBondContact O-CA 3.34Å; A177-G213 PolarHBondContact N-O 3.05Å; A177-G213 PolarHBondContact O-N 3.45Å; A177-K250 CarbonylContact C-O 3.44Å; A177-K250 WeakPolarHBondContact CA-O 3.43Å; A177-K250 HydrophobicContact CB-CB 4.13Å; A177-K250 WeakPolarHBondContact CB-O 3.31Å
178	G	98.7	Very high	97.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	141.6	-175.3	0	0	0	0	0	114.3	K250 L251 I252	G178-K250 PolarHBondContact N-O 2.89Å; G178-L251 WeakPolarHBondContact O-CA 3.3Å; G178-I252 PolarHBondContact O-N 2.71Å
179	A	98.7	Very high	97.8	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	137.1	171.3	0	0	0	0	0	111	F163 E209 P211 I252 L258	F163-A179 HydrophobicContact CE1-CB 3.75Å; F163-A179 HydrophobicContact CZ-CB 3.76Å; A179-E209 HydrophobicContact CB-CB 4.17Å; A179-E209 PolarHBondContact O-N 3.23Å; A179-P211 WeakPolarHBondContact CB-O 3.45Å; A179-P211 PolarHBondContact N-O 2.64Å; A179-I252 CarbonylContact C-O 3.57Å; A179-I252 WeakPolarHBondContact CA-O 3.5Å; A179-L258 HydrophobicContact CB-CD1 3.76Å
180	I	98.5	Very high	97.7	Very high	15 Å²	15	52.4 Å²	52.4	8%	0.077	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	156.4	173.2	53.8	158.9	0	0	0	112	R206 A207 L251 I252 G254	I180-R206 HydrophobicContact CB-CB 4.1Å; I180-R206 HydrophobicContact CB-CG 4.42Å; I180-R206 HydrophobicContact CD1-CG 3.93Å; I180-R206 HydrophobicContact CG2-CB 4.26Å; I180-A207 CarbonylContact C-O 3.56Å; I180-A207 VanDerWaalsContact CA-O 3.31Å; I180-A207 WeakPolarHBondContact CA-O 3.26Å; I180-L251 HydrophobicContact CD1-CB 3.9Å; I180-L251 HydrophobicContact CG1-CB 4.16Å; I180-L251 HydrophobicContact CG2-CB 4.06Å; I180-L251 HydrophobicContact CG2-CD1 4.26Å; I180-L251 HydrophobicContact CG2-CD2 3.98Å; I180-L251 HydrophobicContact CG2-CG 4.32Å; I180-I252 WeakPolarHBondContact CG1-O 3.45Å; I180-I252 PolarHBondContact N-O 3.04Å; I180-G254 PolarHBondContact O-N 3.16Å
181	R	97.7	Very high	97.7	Very high	77 Å²	77	54 Å²	54	29%	0.291	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	150	171.4	-70	-65.2	-60.1	152.7	6	111.1	R206 A207 E209 G254	R181-R206 WeakPolarHBondContact O-CA 3.43Å; R181-R206 WeakPolarHBondContact O-CB 3.49Å; R181-R206 WeakPolarHBondContact O-CD 3.39Å; R181-A207 HydrophobicContact CB-CB 4.35Å; R181-A207 PolarHBondContact N-O 2.9Å; R181-A207 PolarHBondContact O-N 2.8Å; R181-E209 HydrophobicContact CB-CG 4.24Å; R181-E209 HydrophobicContact CG-CG 3.82Å; R181-G254 WeakPolarHBondContact CD-O 3.44Å; R181-G254 PolarHBondContact NH1-O 3.43Å
182	P	96.8	Very high	97.6	Very high	67 Å²	67	59.7 Å²	59.7	44%	0.435	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	142.2	169.6	28.2	-35	0	0	0	110.6	V184	P182-V184 PolarHBondContact O-N 2.82Å
183	L	97.1	Very high	97.5	Very high	39 Å²	39	62.2 Å²	62.2	20%	0.204	36%	0.355	C	S	.	.			trans	-71.2	124.9	175.1	-68.6	168.5	0	0	0	110.3	V187 R202 A207	L183-V187 HydrophobicContact CD1-CG2 3.89Å; L183-V187 HydrophobicContact CD2-CG2 4.16Å; L183-R202 HydrophobicContact CB-CG 3.75Å; L183-R202 HydrophobicContact CD1-CG 4.19Å; L183-R202 WeakPolarHBondContact O-CD 2.41Å; L183-A207 HydrophobicContact CD2-CB 4.18Å
184	V	94.8	Very high	97.4	Very high	127 Å²	127	59 Å²	59	77%	0.77	36%	0.356	S	S	*	.	S	Bend	trans	-76.5	-58.9	175	-179.6	0	0	0	0	109.8	P182 R202	P182-V184 PolarHBondContact O-N 2.82Å; V184-R202 PolarHBondContact O-NH1 3.08Å
185	S	95.6	Very high	97.4	Very high	91 Å²	91	62 Å²	62	64%	0.636	37%	0.365	S	S	*	.	S	Bend	trans	-75.4	157	176.2	-55.1	0	0	0	0	112.5	R202	S185-R202 WeakPolarHBondContact O-CD 3.48Å
186	T	96.4	Very high	97.3	Very high	86 Å²	86	66.9 Å²	66.9	53%	0.528	39%	0.388	S	S	.	.			trans	-63.3	143.8	159.2	-54	0	0	0	0	109.5	I188 S199	T186-I188 HydrophobicContact CG2-CG2 4.34Å; T186-S199 WeakPolarHBondContact CG2-OG 3.3Å
187	V	97.6	Very high	97.3	Very high	56 Å²	56	71.3 Å²	71.3	34%	0.339	41%	0.411	S	S	.	.			trans	-108.5	130.9	173.2	-180	0	0	0	0	108.1	L183 L200	L183-V187 HydrophobicContact CD1-CG2 3.89Å; L183-V187 HydrophobicContact CD2-CG2 4.16Å; V187-L200 HydrophobicContact CB-CB 4.44Å; V187-L200 HydrophobicContact CB-CD1 4.21Å; V187-L200 HydrophobicContact CG1-CD1 3.74Å; V187-L200 HydrophobicContact CG1-CG 4.32Å; V187-L200 PolarHBondContact O-N 3.25Å
188	I	97.6	Very high	97.2	Very high	93 Å²	93	75.6 Å²	75.6	48%	0.477	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	149.6	-179.1	54.8	165.8	0	0	0	110.5	T186 T190 L196 H198	T186-I188 HydrophobicContact CG2-CG2 4.34Å; I188-T190 HydrophobicContact CD1-CG2 4.44Å; I188-L196 HydrophobicContact CB-CD1 3.68Å; I188-L196 HydrophobicContact CD1-CD1 4Å; I188-L196 HydrophobicContact CG1-CD1 4.44Å; I188-L196 HydrophobicContact CG2-CD1 3.68Å; I188-H198 CarbonylContact C-O 3.49Å; I188-H198 VanDerWaalsContact CA-O 3.31Å; I188-H198 WeakPolarHBondContact CA-O 3.39Å
189	A	97.1	Very high	97.1	Very high	28 Å²	28	78.8 Å²	78.8	23%	0.231	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	154.4	161.9	0	0	0	0	0	109.9	D197 H198	A189-D197 HydrophobicContact CB-CB 4Å; A189-D197 PolarHBondContact O-N 2.86Å; A189-H198 VanDerWaalsContact CB-CE1 3.5Å; A189-H198 WeakPolarHBondContact CB-CE1 3.35Å; A189-H198 PolarHBondContact N-O 2.85Å
190	T	97.6	Very high	97.1	Very high	92 Å²	92	81 Å²	81	56%	0.564	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.2	143.1	178.5	54.6	0	0	0	0	110.8	I188 Y195	I188-T190 HydrophobicContact CD1-CG2 4.44Å; T190-Y195 CarbonylContact C-O 3.57Å; T190-Y195 WeakPolarHBondContact CA-O 3.2Å; T190-Y195 WeakPolarHBondContact CB-O 2.6Å
191	T	97.1	Very high	97	Very high	45 Å²	45	85.2 Å²	85.2	28%	0.276	48%	0.484	S	S	.	.			trans	-71.5	166	173.8	80.5	0	0	0	0	111.3	E193 G194 Y195 D197	T191-E193 WeakPolarHBondContact CB-OE2 2.71Å; T191-E193 PolarHBondContact O-N 3.12Å; T191-E193 VanDerWaalsContact O-N 3.16Å; T191-E193 PolarHBondContact OG1-N 3.38Å; T191-E193 PolarHBondContact OG1-OE2 3.14Å; T191-G194 PolarHBondContact O-N 3.43Å; T191-Y195 PolarHBondContact N-O 3Å; T191-Y195 PolarHBondContact OG1-N 3.47Å; T191-D197 HydrophobicContact CG2-CB 4.12Å
192	S	96.3	Very high	96.9	Very high	118 Å²	118	87.6 Å²	87.6	83%	0.825	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-22.8	175.9	23.3	0	0	0	0	113.8
193	E	96.9	Very high	96.8	Very high	128 Å²	128	87.9 Å²	87.9	60%	0.598	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	0.1	-179.4	-47.7	66.8	-135.3	0	0	112.2	T191 Y195	T191-E193 WeakPolarHBondContact CB-OE2 2.71Å; T191-E193 PolarHBondContact O-N 3.12Å; T191-E193 VanDerWaalsContact O-N 3.16Å; T191-E193 PolarHBondContact OG1-N 3.38Å; T191-E193 PolarHBondContact OG1-OE2 3.14Å; E193-Y195 HydrophobicContact CB-CD2 3.81Å; E193-Y195 HydrophobicContact CB-CE2 3.78Å
194	G	95.8	Very high	96.8	Very high	61 Å²	61	93.1 Å²	93.1	63%	0.629	52%	0.523	S	S	*	.	S	Bend	trans	89.2	10.6	176.6	0	0	0	0	0	115.7	T191	T191-G194 PolarHBondContact O-N 3.43Å
195	Y	97.8	Very high	96.9	Very high	166 Å²	166	92.3 Å²	92.3	65%	0.651	51%	0.506	S	S	*	.			trans	-83.7	161.8	175	-61	-71.4	0	0	0	112.1	T190 T191 E193 D197	T190-Y195 CarbonylContact C-O 3.57Å; T190-Y195 WeakPolarHBondContact CA-O 3.2Å; T190-Y195 WeakPolarHBondContact CB-O 2.6Å; T191-Y195 PolarHBondContact N-O 3Å; T191-Y195 PolarHBondContact OG1-N 3.47Å; E193-Y195 HydrophobicContact CB-CD2 3.81Å; E193-Y195 HydrophobicContact CB-CE2 3.78Å; Y195-D197 PolarHBondContact O-N 3.46Å
196	L	97.8	Very high	97	Very high	116 Å²	116	93.4 Å²	93.4	61%	0.607	50%	0.496	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66	126.8	166.9	172.6	63.4	0	0	0	109.6	I188	I188-L196 HydrophobicContact CB-CD1 3.68Å; I188-L196 HydrophobicContact CD1-CD1 4Å; I188-L196 HydrophobicContact CG1-CD1 4.44Å; I188-L196 HydrophobicContact CG2-CD1 3.68Å
197	D	97.8	Very high	97.1	Very high	93 Å²	93	90.6 Å²	90.6	50%	0.497	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-76.5	168.2	167.9	5.6	0	0	0	108.8	A189 T191 Y195	A189-D197 HydrophobicContact CB-CB 4Å; A189-D197 PolarHBondContact O-N 2.86Å; T191-D197 HydrophobicContact CG2-CB 4.12Å; Y195-D197 PolarHBondContact O-N 3.46Å
198	H	97.8	Very high	97.1	Very high	89 Å²	89	90.1 Å²	90.1	41%	0.412	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	165.9	178.7	61.7	-89.9	0	0	0	112.5	I188 A189	I188-H198 CarbonylContact C-O 3.49Å; I188-H198 VanDerWaalsContact CA-O 3.31Å; I188-H198 WeakPolarHBondContact CA-O 3.39Å; A189-H198 VanDerWaalsContact CB-CE1 3.5Å; A189-H198 WeakPolarHBondContact CB-CE1 3.35Å; A189-H198 PolarHBondContact N-O 2.85Å
199	S	97.4	Very high	97.1	Very high	68 Å²	68	87.4 Å²	87.4	48%	0.476	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	138.3	171.2	-178.8	0	0	0	0	110.9	T186	T186-S199 WeakPolarHBondContact CG2-OG 3.3Å
200	L	97.1	Very high	97.2	Very high	45 Å²	45	86.5 Å²	86.5	24%	0.236	46%	0.458	C	S	.	.			trans	-75.3	146.7	169.4	-61.6	-173.7	0	0	0	111.1	V187 R202 Y205	V187-L200 HydrophobicContact CB-CB 4.44Å; V187-L200 HydrophobicContact CB-CD1 4.21Å; V187-L200 HydrophobicContact CG1-CD1 3.74Å; V187-L200 HydrophobicContact CG1-CG 4.32Å; V187-L200 PolarHBondContact O-N 3.25Å; L200-R202 PolarHBondContact O-N 2.85Å; L200-Y205 HydrophobicContact CB-CD2 3.96Å; L200-Y205 HydrophobicContact CB-CE2 3.77Å; L200-Y205 HydrophobicContact CD1-CD1 4.29Å; L200-Y205 HydrophobicContact CD1-CD2 4.37Å; L200-Y205 HydrophobicContact CD1-CE1 4.09Å; L200-Y205 HydrophobicContact CD1-CE2 4.2Å; L200-Y205 HydrophobicContact CD1-CG 4.43Å; L200-Y205 HydrophobicContact CD2-CE2 4.33Å; L200-Y205 HydrophobicContact CG-CE2 4.33Å
201	E	96.6	Very high	97.2	Very high	104 Å²	104	82.1 Å²	82.1	49%	0.486	43%	0.431	S	S	.	.			trans	-73.1	88.1	174.8	-171.9	-167.4	129.9	0	0	110.2	A203 K204 Y205	E201-A203 PolarHBondContact O-N 3.46Å; E201-K204 HydrophobicContact CB-CD 4.36Å; E201-K204 VanDerWaalsContact CD-CE 3.46Å; E201-K204 HydrophobicContact CG-CD 4.43Å; E201-K204 PolarHBondContact O-N 3.46Å; E201-K204 WeakPolarHBondContact OE1-CD 3.39Å; E201-K204 WeakPolarHBondContact OE1-CE 3.37Å; E201-K204 WeakPolarHBondContact OE1-CG 3.5Å; E201-K204 IonicContact OE1-NZ 2.85Å; E201-K204 PolarHBondContact OE1-NZ 3.42Å; E201-K204 VanDerWaalsContact OE2-CE 3.27Å; E201-K204 WeakPolarHBondContact OE2-CE 3.33Å; E201-K204 IonicContact OE2-NZ 3.51Å; E201-K204 PolarHBondContact OE2-NZ 3.5Å; E201-Y205 WeakPolarHBondContact O-CD2 3.49Å
202	R	96.1	Very high	97.3	Very high	127 Å²	127	80 Å²	80	48%	0.479	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-45.8	-29.2	-170.9	-166.2	179.5	62.5	171.9	-6.7	115.3	L183 V184 S185 L200 K204 Y205	L183-R202 HydrophobicContact CB-CG 3.75Å; L183-R202 HydrophobicContact CD1-CG 4.19Å; L183-R202 WeakPolarHBondContact O-CD 2.41Å; V184-R202 PolarHBondContact O-NH1 3.08Å; S185-R202 WeakPolarHBondContact O-CD 3.48Å; L200-R202 PolarHBondContact O-N 2.85Å; R202-K204 VanDerWaalsContact C-N 3.33Å; R202-K204 PolarHBondContact O-N 3.38Å; R202-Y205 PolarHBondContact O-N 3.01Å
203	A	94.6	Very high	97.4	Very high	73 Å²	73	74.3 Å²	74.3	60%	0.603	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-63.2	-32.3	176.7	0	0	0	0	0	114.1	E201 R206	E201-A203 PolarHBondContact O-N 3.46Å; A203-R206 PolarHBondContact O-NH1 3.27Å
204	K	96.8	Very high	97.5	Very high	150 Å²	150	68.2 Å²	68.2	65%	0.652	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-81.3	-18.4	179.8	-72.9	172.8	177.7	157.7	0	114	E201 R202	E201-K204 HydrophobicContact CB-CD 4.36Å; E201-K204 VanDerWaalsContact CD-CE 3.46Å; E201-K204 HydrophobicContact CG-CD 4.43Å; E201-K204 PolarHBondContact O-N 3.46Å; E201-K204 WeakPolarHBondContact OE1-CD 3.39Å; E201-K204 WeakPolarHBondContact OE1-CE 3.37Å; E201-K204 WeakPolarHBondContact OE1-CG 3.5Å; E201-K204 IonicContact OE1-NZ 2.85Å; E201-K204 PolarHBondContact OE1-NZ 3.42Å; E201-K204 VanDerWaalsContact OE2-CE 3.27Å; E201-K204 WeakPolarHBondContact OE2-CE 3.33Å; E201-K204 IonicContact OE2-NZ 3.51Å; E201-K204 PolarHBondContact OE2-NZ 3.5Å; R202-K204 VanDerWaalsContact C-N 3.33Å; R202-K204 PolarHBondContact O-N 3.38Å
205	Y	97.6	Very high	97.7	Very high	109 Å²	109	66 Å²	66	43%	0.427	32%	0.324	S	S	.	.			trans	-109.8	158.8	-173.3	-61.3	-89.7	0	0	0	112.4	L200 E201 R202	L200-Y205 HydrophobicContact CB-CD2 3.96Å; L200-Y205 HydrophobicContact CB-CE2 3.77Å; L200-Y205 HydrophobicContact CD1-CD1 4.29Å; L200-Y205 HydrophobicContact CD1-CD2 4.37Å; L200-Y205 HydrophobicContact CD1-CE1 4.09Å; L200-Y205 HydrophobicContact CD1-CE2 4.2Å; L200-Y205 HydrophobicContact CD1-CG 4.43Å; L200-Y205 HydrophobicContact CD2-CE2 4.33Å; L200-Y205 HydrophobicContact CG-CE2 4.33Å; E201-Y205 WeakPolarHBondContact O-CD2 3.49Å; R202-Y205 PolarHBondContact O-N 3.01Å
206	R	98.1	Very high	97.7	Very high	114 Å²	114	59.1 Å²	59.1	43%	0.43	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	154.3	178.4	-64.4	-66.6	-179.3	-79.8	-3.5	109.1	I180 R181 A203	I180-R206 HydrophobicContact CB-CB 4.1Å; I180-R206 HydrophobicContact CB-CG 4.42Å; I180-R206 HydrophobicContact CD1-CG 3.93Å; I180-R206 HydrophobicContact CG2-CB 4.26Å; R181-R206 WeakPolarHBondContact O-CA 3.43Å; R181-R206 WeakPolarHBondContact O-CB 3.49Å; R181-R206 WeakPolarHBondContact O-CD 3.39Å; A203-R206 PolarHBondContact O-NH1 3.27Å
207	A	97.8	Very high	97.7	Very high	28 Å²	28	57.1 Å²	57.1	23%	0.231	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	125.9	160.5	0	0	0	0	0	108	I180 R181 L183	I180-A207 CarbonylContact C-O 3.56Å; I180-A207 VanDerWaalsContact CA-O 3.31Å; I180-A207 WeakPolarHBondContact CA-O 3.26Å; R181-A207 HydrophobicContact CB-CB 4.35Å; R181-A207 PolarHBondContact N-O 2.9Å; R181-A207 PolarHBondContact O-N 2.8Å; L183-A207 HydrophobicContact CD2-CB 4.18Å
208	S	98.1	Very high	97.7	Very high	45 Å²	45	53.6 Å²	53.6	32%	0.315	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	132.7	167.1	-176.2	0	0	0	0	108.9	Q212 E236	S208-Q212 PolarHBondContact OG-NE2 2.92Å; S208-E236 WeakPolarHBondContact CB-OE2 3.49Å; S208-E236 PolarHBondContact OG-OE2 3.2Å
209	E	97.9	Very high	97.7	Very high	37 Å²	37	49.4 Å²	49.4	17%	0.173	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	172.2	-176	-60.8	-66.8	-169.6	0	0	111.1	R156 A179 R181 Q212	R156-E209 IonicContact CZ-OE2 3.55Å; R156-E209 IonicContact NH1-OE2 2.65Å; R156-E209 PolarHBondContact NH1-OE2 3.34Å; R156-E209 IonicContact NH2-OE2 3.15Å; R156-E209 PolarHBondContact NH2-OE2 3.1Å; A179-E209 HydrophobicContact CB-CB 4.17Å; A179-E209 PolarHBondContact O-N 3.23Å; R181-E209 HydrophobicContact CB-CG 4.24Å; R181-E209 HydrophobicContact CG-CG 3.82Å; E209-Q212 WeakPolarHBondContact O-CG 3.36Å
210	M	98.1	Very high	97.8	Very high	8 Å²	8	47 Å²	47	4%	0.039	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	151.3	172.5	-53.6	-66.5	120.3	0	0	109	R124 I151 H152 D153 Q212	R124-M210 PolarHBondContact NH2-SD 2.93Å; I151-M210 HydrophobicContact CG2-SD 4.43Å; H152-M210 HydrophobicContact CB-CB 4.44Å; H152-M210 WeakPolarHBondContact CE1-CB 3.47Å; H152-M210 PolarHBondContact NE2-O 3.24Å; D153-M210 HydrophobicContact CB-CG 4.31Å; D153-M210 WeakPolarHBondContact OD2-CG 3.28Å; M210-Q212 HydrophobicContact CE-CG 3.9Å; M210-Q212 VanDerWaalsContact CE-NE2 3.27Å; M210-Q212 HydrophobicContact SD-CG 3.93Å
211	P	98.6	Very high	97.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-72.2	153.7	4.1	28.6	-36.3	0	0	0	114.9	I150 H152 V159 F163 L164 I167 A179	I150-P211 HydrophobicContact CG2-CB 3.65Å; H152-P211 HydrophobicContact CB-CB 4.48Å; H152-P211 WeakPolarHBondContact CE1-CA 3.5Å; H152-P211 WeakPolarHBondContact CE1-CB 3.47Å; H152-P211 WeakPolarHBondContact CE1-CD 3.46Å; H152-P211 WeakPolarHBondContact CE1-CG 3.43Å; H152-P211 WeakPolarHBondContact ND1-CA 3.45Å; H152-P211 WeakPolarHBondContact ND1-CD 3.47Å; H152-P211 VanDerWaalsContact NE2-CD 3.35Å; H152-P211 WeakPolarHBondContact NE2-CD 3.48Å; V159-P211 HydrophobicContact CG2-CG 4.03Å; F163-P211 HydrophobicContact CD1-CG 3.96Å; F163-P211 HydrophobicContact CE1-CG 3.9Å; L164-P211 HydrophobicContact CD2-CB 4.05Å; L164-P211 HydrophobicContact CD2-CG 3.83Å; I167-P211 HydrophobicContact CG1-CG 4.24Å; A179-P211 WeakPolarHBondContact CB-O 3.45Å; A179-P211 PolarHBondContact N-O 2.64Å
212	Q	98.9	Very high	97.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	140.4	166.3	-63.6	178.5	-20.3	0	0	108.3	I150 I151 A177 S208 E209 M210 F214 E236 L238	I150-Q212 CarbonylContact C-O 3.5Å; I150-Q212 VanDerWaalsContact CA-O 3.29Å; I150-Q212 WeakPolarHBondContact CA-O 3.29Å; I151-Q212 PolarHBondContact N-O 2.78Å; I151-Q212 PolarHBondContact O-N 3.25Å; A177-Q212 CarbonylContact O-C 3.59Å; A177-Q212 WeakPolarHBondContact O-CA 3.34Å; S208-Q212 PolarHBondContact OG-NE2 2.92Å; E209-Q212 WeakPolarHBondContact O-CG 3.36Å; M210-Q212 HydrophobicContact CE-CG 3.9Å; M210-Q212 VanDerWaalsContact CE-NE2 3.27Å; M210-Q212 HydrophobicContact SD-CG 3.93Å; Q212-F214 HydrophobicContact CB-CE2 3.67Å; Q212-F214 HydrophobicContact CB-CZ 4.15Å; Q212-E236 VanDerWaalsContact NE2-CD 3.35Å; Q212-E236 PolarHBondContact NE2-OE1 3.12Å; Q212-E236 PolarHBondContact NE2-OE2 3.39Å; Q212-E236 VanDerWaalsContact NE2-OE2 3.15Å; Q212-E236 PolarHBondContact OE1-OE1 3.3Å; Q212-L238 HydrophobicContact CB-CD2 4.32Å; Q212-L238 HydrophobicContact CG-CD1 4.29Å; Q212-L238 HydrophobicContact CG-CD2 4.34Å; Q212-L238 HydrophobicContact CG-CG 4.31Å
213	G	98.8	Very high	98	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	141.5	-178.7	0	0	0	0	0	111.3	V149 A171 A176 A177	V149-G213 WeakPolarHBondContact O-CA 3.48Å; A171-G213 WeakPolarHBondContact CB-O 3.42Å; A176-G213 CarbonylContact C-O 3.57Å; A176-G213 WeakPolarHBondContact CA-O 3.19Å; A177-G213 PolarHBondContact N-O 3.05Å; A177-G213 PolarHBondContact O-N 3.45Å
214	F	98.9	Very high	98.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	147.1	179.1	-57.2	-97.3	0	0	0	109.5	V148 V149 I151 G175 A176 Q212 I219 C237 L238 A241	V148-F214 CarbonylContact C-O 3.46Å; V148-F214 WeakPolarHBondContact CA-O 3.43Å; V148-F214 WeakPolarHBondContact CG1-O 3.31Å; V149-F214 PolarHBondContact N-O 3.27Å; V149-F214 PolarHBondContact O-N 3.4Å; I151-F214 HydrophobicContact CB-CE2 4.45Å; I151-F214 HydrophobicContact CD1-CD2 3.87Å; I151-F214 HydrophobicContact CD1-CE2 3.73Å; I151-F214 HydrophobicContact CG1-CD2 4.49Å; I151-F214 HydrophobicContact CG1-CE2 4.45Å; G175-F214 CarbonylContact O-C 3.6Å; G175-F214 WeakPolarHBondContact O-CA 3.34Å; A176-F214 HydrophobicContact CB-CD1 3.67Å; A176-F214 HydrophobicContact CB-CE1 3.95Å; Q212-F214 HydrophobicContact CB-CE2 3.67Å; Q212-F214 HydrophobicContact CB-CZ 4.15Å; F214-I219 HydrophobicContact CB-CB 3.71Å; F214-I219 HydrophobicContact CB-CG1 4.4Å; F214-I219 HydrophobicContact CB-CG2 4Å; F214-I219 HydrophobicContact CD1-CB 4.32Å; F214-I219 HydrophobicContact CD1-CD1 4.04Å; F214-I219 HydrophobicContact CD2-CD1 4.39Å; F214-I219 HydrophobicContact CD2-CG1 4.41Å; F214-I219 HydrophobicContact CE1-CD1 4.19Å; F214-I219 HydrophobicContact CG-CB 3.98Å; F214-I219 HydrophobicContact CG-CD1 4.17Å; F214-I219 HydrophobicContact CG-CG1 4.2Å; F214-I219 HydrophobicContact CZ-CD1 4.46Å; F214-C237 HydrophobicContact CE1-CB 4.3Å; F214-C237 HydrophobicContact CE2-CB 3.98Å; F214-C237 HydrophobicContact CZ-CB 3.49Å; F214-C237 VanDerWaalsContact CZ-CB 3.49Å; F214-L238 HydrophobicContact CE1-CD2 3.88Å; F214-L238 HydrophobicContact CE2-CD2 4.49Å; F214-L238 HydrophobicContact CZ-CD2 3.6Å; F214-L238 HydrophobicContact CZ-CG 4.19Å; F214-A241 HydrophobicContact CD1-CB 4.1Å; F214-A241 HydrophobicContact CE1-CB 3.91Å
215	T	98.7	Very high	98.2	Very high	13 Å²	13	39.5 Å²	39.5	8%	0.08	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	140.2	159.2	58.4	0	0	0	0	109	K147 A171 G175 D217 V218 I219	K147-T215 VanDerWaalsContact O-CA 3.26Å; K147-T215 WeakPolarHBondContact O-CA 3.23Å; A171-T215 WeakPolarHBondContact O-CG2 3.42Å; G175-T215 PolarHBondContact O-N 3.49Å; G175-T215 PolarHBondContact O-OG1 3.2Å; T215-D217 PolarHBondContact O-N 3.02Å; T215-V218 PolarHBondContact O-N 3.36Å; T215-V218 VanDerWaalsContact OG1-CG2 3.28Å; T215-V218 WeakPolarHBondContact OG1-CG2 3.33Å; T215-I219 PolarHBondContact O-N 2.87Å
216	Y	98	Very high	98.1	Very high	23 Å²	23	35 Å²	35	9%	0.09	17%	0.174	C	C	.	.	H	α-helix	trans	-54.6	-43	-174.7	174.5	-83.3	0	0	0	112	V132 L135 G136 K145 P146 K147 V149 V218 I219 C220	V132-Y216 HydrophobicContact CG1-CE2 4.37Å; L135-Y216 HydrophobicContact CB-CD2 4.45Å; L135-Y216 HydrophobicContact CB-CE2 3.9Å; G136-Y216 VanDerWaalsContact CA-OH 3.23Å; G136-Y216 WeakPolarHBondContact CA-OH 3.29Å; G136-Y216 PolarHBondContact N-OH 2.9Å; K145-Y216 HydrophobicContact CD-CD1 4.4Å; K145-Y216 HydrophobicContact CD-CE1 4.49Å; K145-Y216 HydrophobicContact CG-CD1 4.41Å; P146-Y216 HydrophobicContact CG-CD2 3.76Å; P146-Y216 HydrophobicContact CG-CE2 4.5Å; P146-Y216 HydrophobicContact CG-CG 4.43Å; P146-Y216 WeakPolarHBondContact O-CB 3.42Å; K147-Y216 PolarHBondContact O-N 2.79Å; V149-Y216 HydrophobicContact CG2-CD2 3.72Å; V149-Y216 HydrophobicContact CG2-CG 4.42Å; Y216-V218 PolarHBondContact O-N 3.23Å; Y216-I219 WeakPolarHBondContact O-CG2 3.48Å; Y216-I219 PolarHBondContact O-N 3.39Å; Y216-C220 HydrophobicContact CE1-CB 4.3Å; Y216-C220 WeakPolarHBondContact CE1-SG 3.49Å; Y216-C220 WeakPolarHBondContact O-CB 3.23Å; Y216-C220 PolarHBondContact O-N 2.81Å; Y216-C220 PolarHBondContact O-SG 2.81Å; Y216-C220 VanDerWaalsContact O-SG 3.38Å; Y216-C220 PolarHBondContact OH-SG 2.81Å; Y216-C220 VanDerWaalsContact OH-SG 3.34Å
217	D	97.3	Very high	98	Very high	73 Å²	73	32.8 Å²	32.8	39%	0.39	17%	0.173	S	C	.	.	H	α-helix	trans	-65.6	-42	-175.2	-54.6	-59.7	0	0	0	111.9	K145 T215 C220 E221	K145-D217 IonicContact NZ-OD1 2.71Å; K145-D217 PolarHBondContact NZ-OD1 2.81Å; T215-D217 PolarHBondContact O-N 3.02Å; D217-C220 PolarHBondContact O-N 2.77Å; D217-E221 WeakPolarHBondContact O-CB 3.31Å; D217-E221 PolarHBondContact O-N 3.32Å
218	V	98.6	Very high	98	Very high	20 Å²	20	37.3 Å²	37.3	12%	0.121	19%	0.189	C	C	.	.	H	α-helix	trans	-62.4	-47.9	175.9	167.4	0	0	0	0	111.7	T215 Y216 C220 E221 A222 A241 C245 T247	T215-V218 PolarHBondContact O-N 3.36Å; T215-V218 VanDerWaalsContact OG1-CG2 3.28Å; T215-V218 WeakPolarHBondContact OG1-CG2 3.33Å; Y216-V218 PolarHBondContact O-N 3.23Å; V218-C220 VanDerWaalsContact C-N 3.32Å; V218-C220 PolarHBondContact O-N 2.96Å; V218-E221 PolarHBondContact O-N 3.29Å; V218-A222 VanDerWaalsContact O-CB 3.31Å; V218-A222 WeakPolarHBondContact O-CB 3.31Å; V218-A222 PolarHBondContact O-N 3.17Å; V218-A241 HydrophobicContact CG1-CB 3.93Å; V218-C245 HydrophobicContact CG1-CB 4.06Å; V218-C245 PolarHBondContact O-SG 3.43Å; V218-T247 HydrophobicContact CG1-CG2 4.11Å
219	I	98.6	Very high	98	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-71.5	-29.7	-177.2	-167.9	58.8	0	0	0	112	V132 V149 I151 F214 T215 Y216 Y223 C237	V132-I219 HydrophobicContact CG1-CG2 4.11Å; V132-I219 HydrophobicContact CG2-CG1 4.37Å; V132-I219 HydrophobicContact CG2-CG2 4.47Å; V149-I219 HydrophobicContact CB-CG2 4.46Å; I151-I219 HydrophobicContact CD1-CD1 4.12Å; I151-I219 HydrophobicContact CD1-CG1 3.96Å; F214-I219 HydrophobicContact CB-CB 3.71Å; F214-I219 HydrophobicContact CB-CG1 4.4Å; F214-I219 HydrophobicContact CB-CG2 4Å; F214-I219 HydrophobicContact CD1-CB 4.32Å; F214-I219 HydrophobicContact CD1-CD1 4.04Å; F214-I219 HydrophobicContact CD2-CD1 4.39Å; F214-I219 HydrophobicContact CD2-CG1 4.41Å; F214-I219 HydrophobicContact CE1-CD1 4.19Å; F214-I219 HydrophobicContact CG-CB 3.98Å; F214-I219 HydrophobicContact CG-CD1 4.17Å; F214-I219 HydrophobicContact CG-CG1 4.2Å; F214-I219 HydrophobicContact CZ-CD1 4.46Å; T215-I219 PolarHBondContact O-N 2.87Å; Y216-I219 WeakPolarHBondContact O-CG2 3.48Å; Y216-I219 PolarHBondContact O-N 3.39Å; I219-Y223 HydrophobicContact CD1-CD2 3.94Å; I219-Y223 HydrophobicContact CD1-CE2 3.56Å; I219-Y223 HydrophobicContact CG1-CD2 3.93Å; I219-Y223 HydrophobicContact CG1-CE2 3.77Å; I219-Y223 VanDerWaalsContact O-CD2 3.23Å; I219-Y223 WeakPolarHBondContact O-CD2 3.34Å; I219-Y223 PolarHBondContact O-N 2.81Å; I219-Y223 VanDerWaalsContact O-N 3.14Å; I219-C237 HydrophobicContact CD1-CB 4.44Å
220	C	97.9	Very high	98	Very high	18 Å²	18	37.9 Å²	37.9	12%	0.122	20%	0.196	C	C	.	.	H	α-helix	trans	-67	-49.7	169.7	-76.4	0	0	0	0	112.7	V132 Y216 D217 V218 A222 Y223 Q224	V132-C220 WeakPolarHBondContact CG1-SG 3.38Å; Y216-C220 HydrophobicContact CE1-CB 4.3Å; Y216-C220 WeakPolarHBondContact CE1-SG 3.49Å; Y216-C220 WeakPolarHBondContact O-CB 3.23Å; Y216-C220 PolarHBondContact O-N 2.81Å; Y216-C220 PolarHBondContact O-SG 2.81Å; Y216-C220 VanDerWaalsContact O-SG 3.38Å; Y216-C220 PolarHBondContact OH-SG 2.81Å; Y216-C220 VanDerWaalsContact OH-SG 3.34Å; D217-C220 PolarHBondContact O-N 2.77Å; V218-C220 VanDerWaalsContact C-N 3.32Å; V218-C220 PolarHBondContact O-N 2.96Å; C220-A222 VanDerWaalsContact C-N 3.3Å; C220-A222 PolarHBondContact O-N 2.9Å; C220-Y223 PolarHBondContact O-N 2.95Å; C220-Q224 WeakPolarHBondContact O-CB 3.42Å; C220-Q224 VanDerWaalsContact O-CG 3.27Å; C220-Q224 WeakPolarHBondContact O-CG 3.36Å; C220-Q224 PolarHBondContact O-N 3.14Å
221	E	98.2	Very high	97.9	Very high	78 Å²	78	38.8 Å²	38.8	36%	0.364	20%	0.199	S	C	.	.	H	α-helix	trans	-61.9	-39.8	179.2	-176.9	-174	-164	0	0	111.2	D217 V218 Q224 K225 C245	D217-E221 WeakPolarHBondContact O-CB 3.31Å; D217-E221 PolarHBondContact O-N 3.32Å; V218-E221 PolarHBondContact O-N 3.29Å; E221-Q224 PolarHBondContact O-N 2.91Å; E221-K225 VanDerWaalsContact CD-NZ 3.33Å; E221-K225 HydrophobicContact CG-CD 4.14Å; E221-K225 WeakPolarHBondContact O-CG 3.3Å; E221-K225 PolarHBondContact O-N 2.77Å; E221-K225 VanDerWaalsContact O-N 3.16Å; E221-K225 VanDerWaalsContact OE1-CE 3.28Å; E221-K225 WeakPolarHBondContact OE1-CE 3.23Å; E221-K225 IonicContact OE1-NZ 3.35Å; E221-K225 PolarHBondContact OE1-NZ 2.89Å; E221-C245 PolarHBondContact OE2-SG 2.78Å
222	A	98.4	Very high	97.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.3	-49.3	174	0	0	0	0	0	111.5	V218 C220 Q224 K225 C226 L240 C245	V218-A222 VanDerWaalsContact O-CB 3.31Å; V218-A222 WeakPolarHBondContact O-CB 3.31Å; V218-A222 PolarHBondContact O-N 3.17Å; C220-A222 VanDerWaalsContact C-N 3.3Å; C220-A222 PolarHBondContact O-N 2.9Å; A222-Q224 VanDerWaalsContact C-N 3.33Å; A222-Q224 PolarHBondContact O-N 3.22Å; A222-K225 PolarHBondContact O-N 3.34Å; A222-C226 PolarHBondContact O-N 3.3Å; A222-C226 PolarHBondContact O-SG 3.45Å; A222-L240 HydrophobicContact CB-CB 4.27Å; A222-C245 PolarHBondContact N-SG 2.92Å
223	Y	98.3	Very high	97.6	Very high	9 Å²	9	50.3 Å²	50.3	4%	0.035	25%	0.251	C	S	.	.	H	α-helix	trans	-68.9	-26.1	177.5	-82.4	-56.5	0	0	0	114.4	H125 I128 C129 I219 C220 K225 F231 C237 L240	H125-Y223 HydrophobicContact CB-CE1 3.96Å; H125-Y223 AromaticContact ND1-CE1 3.63Å; H125-Y223 AromaticContact ND1-CZ 3.71Å; H125-Y223 PolarHBondContact ND1-OH 3.26Å; I128-Y223 HydrophobicContact CB-CE2 4.34Å; I128-Y223 WeakPolarHBondContact CB-OH 3.37Å; I128-Y223 HydrophobicContact CG2-CE2 3.63Å; I128-Y223 VanDerWaalsContact CG2-OH 3.31Å; I128-Y223 WeakPolarHBondContact CG2-OH 3.47Å; C129-Y223 HydrophobicContact CB-CD1 3.88Å; C129-Y223 HydrophobicContact CB-CD2 4.35Å; C129-Y223 HydrophobicContact CB-CE1 4.3Å; C129-Y223 HydrophobicContact CB-CG 3.94Å; I219-Y223 HydrophobicContact CD1-CD2 3.94Å; I219-Y223 HydrophobicContact CD1-CE2 3.56Å; I219-Y223 HydrophobicContact CG1-CD2 3.93Å; I219-Y223 HydrophobicContact CG1-CE2 3.77Å; I219-Y223 VanDerWaalsContact O-CD2 3.23Å; I219-Y223 WeakPolarHBondContact O-CD2 3.34Å; I219-Y223 PolarHBondContact O-N 2.81Å; I219-Y223 VanDerWaalsContact O-N 3.14Å; C220-Y223 PolarHBondContact O-N 2.95Å; Y223-K225 VanDerWaalsContact C-N 3.29Å; Y223-F231 AromaticContact CD1-CE1 3.72Å; Y223-F231 HydrophobicContact CD1-CE1 3.72Å; Y223-F231 HydrophobicContact CD1-CZ 4Å; Y223-F231 HydrophobicContact CE1-CE1 4.15Å; Y223-C237 PolarHBondContact OH-SG 3.09Å; Y223-L240 HydrophobicContact CD1-CD1 4.33Å; Y223-L240 HydrophobicContact CE1-CD1 3.71Å
224	Q	97.4	Very high	97.4	Very high	160 Å²	160	51.6 Å²	51.6	75%	0.748	26%	0.264	S	S	*	.	H	α-helix	trans	-70.7	-24.6	172.6	-75	170.1	-2.5	0	0	113	C220 E221 A222	C220-Q224 WeakPolarHBondContact O-CB 3.42Å; C220-Q224 VanDerWaalsContact O-CG 3.27Å; C220-Q224 WeakPolarHBondContact O-CG 3.36Å; C220-Q224 PolarHBondContact O-N 3.14Å; E221-Q224 PolarHBondContact O-N 2.91Å; A222-Q224 VanDerWaalsContact C-N 3.33Å; A222-Q224 PolarHBondContact O-N 3.22Å
225	K	98.1	Very high	97.2	Very high	94 Å²	94	56.8 Å²	56.8	41%	0.409	30%	0.296	S	S	.	.	H	α-helix	trans	-102.1	-10	-179.4	-65	172.2	-178.1	176.9	0	114.3	E221 A222 Y223 T227 Y244	E221-K225 VanDerWaalsContact CD-NZ 3.33Å; E221-K225 HydrophobicContact CG-CD 4.14Å; E221-K225 WeakPolarHBondContact O-CG 3.3Å; E221-K225 PolarHBondContact O-N 2.77Å; E221-K225 VanDerWaalsContact O-N 3.16Å; E221-K225 VanDerWaalsContact OE1-CE 3.28Å; E221-K225 WeakPolarHBondContact OE1-CE 3.23Å; E221-K225 IonicContact OE1-NZ 3.35Å; E221-K225 PolarHBondContact OE1-NZ 2.89Å; A222-K225 PolarHBondContact O-N 3.34Å; Y223-K225 VanDerWaalsContact C-N 3.29Å; K225-T227 PolarHBondContact O-N 3.05Å; K225-Y244 HydrophobicContact CB-CD1 3.44Å; K225-Y244 VanDerWaalsContact CB-CD1 3.44Å; K225-Y244 HydrophobicContact CB-CE1 4.13Å; K225-Y244 HydrophobicContact CB-CG 3.74Å; K225-Y244 HydrophobicContact CD-CD1 4.3Å; K225-Y244 WeakPolarHBondContact CD-O 3.43Å; K225-Y244 PolarHBondContact NZ-O 2.79Å; K225-Y244 VanDerWaalsContact O-CE1 3.25Å; K225-Y244 WeakPolarHBondContact O-CE1 3.36Å
226	C	95.1	Very high	97.1	Very high	16 Å²	16	58.2 Å²	58.2	11%	0.108	30%	0.302	C	S	.	.			trans	-55.9	135.7	177.5	-77	0	0	0	0	111.8	A222 D230 F231	A222-C226 PolarHBondContact O-N 3.3Å; A222-C226 PolarHBondContact O-SG 3.45Å; C226-D230 HydrophobicContact CB-CB 4.28Å; C226-F231 HydrophobicContact CB-CD2 3.95Å; C226-F231 HydrophobicContact CB-CE1 4.49Å; C226-F231 HydrophobicContact CB-CE2 3.47Å; C226-F231 VanDerWaalsContact CB-CE2 3.47Å; C226-F231 HydrophobicContact CB-CZ 3.78Å
227	T	97.5	Very high	97.2	Very high	67 Å²	67	57.1 Å²	57.1	41%	0.411	30%	0.297	S	S	.	.			trans	-79	164.9	170.2	74.4	0	0	0	0	111	K225 S229 D230 F231	K225-T227 PolarHBondContact O-N 3.05Å; T227-S229 PolarHBondContact O-N 2.86Å; T227-S229 WeakPolarHBondContact OG1-CB 3.39Å; T227-S229 PolarHBondContact OG1-N 2.91Å; T227-D230 WeakPolarHBondContact CA-OD2 3.48Å; T227-D230 VanDerWaalsContact CB-OD2 3.26Å; T227-D230 WeakPolarHBondContact CB-OD2 3.27Å; T227-D230 PolarHBondContact N-OD2 3.21Å; T227-D230 PolarHBondContact O-N 3.14Å; T227-D230 VanDerWaalsContact O-N 3.09Å; T227-D230 PolarHBondContact OG1-N 3.44Å; T227-D230 PolarHBondContact OG1-OD2 2.91Å; T227-F231 WeakPolarHBondContact O-CD2 3.28Å; T227-F231 PolarHBondContact O-N 3.09Å
228	E	97.4	Very high	97.2	Very high	122 Å²	122	54.4 Å²	54.4	57%	0.57	28%	0.283	S	S	*	.	H	α-helix	trans	-57.6	-30.4	171.9	-172.3	65.7	178.2	0	0	112.3	R126 F231 E232	R126-E228 IonicContact CZ-OE1 3.16Å; R126-E228 IonicContact CZ-OE2 2.83Å; R126-E228 IonicContact NH1-OE1 3.16Å; R126-E228 PolarHBondContact NH1-OE1 2.85Å; R126-E228 IonicContact NH1-OE2 2.71Å; R126-E228 PolarHBondContact NH1-OE2 2.85Å; R126-E228 IonicContact NH2-OE1 3.33Å; R126-E228 PolarHBondContact NH2-OE1 3.16Å; R126-E228 IonicContact NH2-OE2 2.77Å; R126-E228 PolarHBondContact NH2-OE2 3.44Å; E228-F231 PolarHBondContact O-N 3.38Å; E228-E232 WeakPolarHBondContact O-CB 3.29Å; E228-E232 PolarHBondContact O-N 2.89Å
229	S	97.3	Very high	97.2	Very high	70 Å²	70	58.2 Å²	58.2	49%	0.49	30%	0.299	S	S	.	.	H	α-helix	trans	-68.1	-39.5	175	-168.2	0	0	0	0	112.3	T227 E232 F233	T227-S229 PolarHBondContact O-N 2.86Å; T227-S229 WeakPolarHBondContact OG1-CB 3.39Å; T227-S229 PolarHBondContact OG1-N 2.91Å; S229-E232 PolarHBondContact O-N 3.43Å; S229-F233 PolarHBondContact O-N 3.24Å
230	D	97.3	Very high	97.2	Very high	24 Å²	24	58.4 Å²	58.4	13%	0.128	30%	0.3	C	S	.	.	H	α-helix	trans	-68.8	-37.7	175.6	-53.2	-72.5	0	0	0	111.2	H125 C226 T227 E232 G234 L240 Q243 Y244	H125-D230 PolarHBondContact CD2-O 3.19Å; C226-D230 HydrophobicContact CB-CB 4.28Å; T227-D230 WeakPolarHBondContact CA-OD2 3.48Å; T227-D230 VanDerWaalsContact CB-OD2 3.26Å; T227-D230 WeakPolarHBondContact CB-OD2 3.27Å; T227-D230 PolarHBondContact N-OD2 3.21Å; T227-D230 PolarHBondContact O-N 3.14Å; T227-D230 VanDerWaalsContact O-N 3.09Å; T227-D230 PolarHBondContact OG1-N 3.44Å; T227-D230 PolarHBondContact OG1-OD2 2.91Å; D230-E232 VanDerWaalsContact C-N 3.34Å; D230-G234 VanDerWaalsContact O-CA 3.24Å; D230-G234 WeakPolarHBondContact O-CA 3.39Å; D230-G234 PolarHBondContact O-N 3.43Å; D230-L240 HydrophobicContact CB-CD2 3.95Å; D230-Q243 PolarHBondContact OD1-NE2 3.17Å; D230-Y244 PolarHBondContact OD2-OH 3.39Å
231	F	96.9	Very high	97.2	Very high	27 Å²	27	57.5 Å²	57.5	12%	0.118	29%	0.294	C	S	.	.	H	α-helix	trans	-65.5	-35.7	174.5	-82	-62.6	0	0	0	112.9	T123 H125 R126 C129 Y223 C226 T227 E228	T123-F231 VanDerWaalsContact CB-O 3.29Å; T123-F231 WeakPolarHBondContact CB-O 3.13Å; T123-F231 WeakPolarHBondContact CG2-O 3.5Å; T123-F231 PolarHBondContact OG1-O 3.29Å; H125-F231 HydrophobicContact CB-CD1 3.91Å; H125-F231 HydrophobicContact CB-CE1 4.47Å; R126-F231 HydrophobicContact CB-CD1 4.44Å; R126-F231 HydrophobicContact CG-CB 4Å; R126-F231 HydrophobicContact CG-CD1 3.62Å; R126-F231 HydrophobicContact CG-CE1 4.43Å; R126-F231 HydrophobicContact CG-CG 4.06Å; C129-F231 HydrophobicContact CB-CE1 3.93Å; C129-F231 HydrophobicContact CB-CZ 4.49Å; Y223-F231 AromaticContact CD1-CE1 3.72Å; Y223-F231 HydrophobicContact CD1-CE1 3.72Å; Y223-F231 HydrophobicContact CD1-CZ 4Å; Y223-F231 HydrophobicContact CE1-CE1 4.15Å; C226-F231 HydrophobicContact CB-CD2 3.95Å; C226-F231 HydrophobicContact CB-CE1 4.49Å; C226-F231 HydrophobicContact CB-CE2 3.47Å; C226-F231 VanDerWaalsContact CB-CE2 3.47Å; C226-F231 HydrophobicContact CB-CZ 3.78Å; T227-F231 WeakPolarHBondContact O-CD2 3.28Å; T227-F231 PolarHBondContact O-N 3.09Å; E228-F231 PolarHBondContact O-N 3.38Å
232	E	95.8	Very high	97.3	Very high	83 Å²	83	57.9 Å²	57.9	39%	0.388	30%	0.298	S	S	.	.	H	α-helix	trans	-87.9	-43.5	-175.7	-152.7	60.3	-156.2	0	0	113.5	T123 R126 E228 S229 D230	T123-E232 WeakPolarHBondContact CG2-OE1 3.41Å; T123-E232 VanDerWaalsContact CG2-OE2 3.31Å; T123-E232 WeakPolarHBondContact CG2-OE2 3.23Å; R126-E232 IonicContact CZ-OE2 3.49Å; R126-E232 IonicContact NE-OE2 3.3Å; R126-E232 PolarHBondContact NE-OE2 3Å; R126-E232 IonicContact NH2-OE2 2.65Å; R126-E232 PolarHBondContact NH2-OE2 3.01Å; E228-E232 WeakPolarHBondContact O-CB 3.29Å; E228-E232 PolarHBondContact O-N 2.89Å; S229-E232 PolarHBondContact O-N 3.43Å; D230-E232 VanDerWaalsContact C-N 3.34Å
233	F	94.8	Very high	97.3	Very high	160 Å²	160	62.1 Å²	62.1	70%	0.702	32%	0.318	S	S	*	.	H	α-helix	trans	-110	-13	-173.1	-52.5	-64.3	0	0	0	114.5	S229	S229-F233 PolarHBondContact O-N 3.24Å
234	G	95.1	Very high	97.3	Very high	26 Å²	26	63.9 Å²	63.9	27%	0.268	33%	0.325	S	S	.	.			trans	-63.2	149.2	177.8	0	0	0	0	0	112.8	H125 D230	H125-G234 PolarHBondContact CD2-O 3.13Å; H125-G234 PolarHBondContact NE2-O 3.02Å; D230-G234 VanDerWaalsContact O-CA 3.24Å; D230-G234 WeakPolarHBondContact O-CA 3.39Å; D230-G234 PolarHBondContact O-N 3.43Å
235	T	94.1	Very high	97.3	Very high	110 Å²	110	57.7 Å²	57.7	68%	0.675	30%	0.299	S	S	*	.			trans	-127.2	-18.8	176	54.2	0	0	0	0	114.2	R124 H125	R124-T235 PolarHBondContact NH1-O 3.43Å; H125-T235 PolarHBondContact NE2-N 3.47Å
236	E	97.8	Very high	97.3	Very high	42 Å²	42	56.1 Å²	56.1	20%	0.196	31%	0.31	C	S	.	.			trans	-124.1	118.4	-162.5	179.3	48.2	-88.7	0	0	111.4	H125 S208 Q212 L238 H239	H125-E236 PolarHBondContact NE2-N 3.16Å; S208-E236 WeakPolarHBondContact CB-OE2 3.49Å; S208-E236 PolarHBondContact OG-OE2 3.2Å; Q212-E236 VanDerWaalsContact NE2-CD 3.35Å; Q212-E236 PolarHBondContact NE2-OE1 3.12Å; Q212-E236 PolarHBondContact NE2-OE2 3.39Å; Q212-E236 VanDerWaalsContact NE2-OE2 3.15Å; Q212-E236 PolarHBondContact OE1-OE1 3.3Å; E236-L238 HydrophobicContact CG-CB 4.26Å; E236-L238 WeakPolarHBondContact OE1-CB 3.41Å; E236-L238 VanDerWaalsContact OE1-CG 3.3Å; E236-L238 WeakPolarHBondContact OE1-CG 3.08Å; E236-L238 PolarHBondContact OE1-N 3.33Å; E236-H239 HydrophobicContact CB-CB 4.11Å; E236-H239 HydrophobicContact CG-CB 3.88Å
237	C	98.6	Very high	97.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-78.6	-28.6	-177.9	-59.5	0	0	0	0	112.5	I151 F214 I219 Y223 H239 L240 A241	I151-C237 HydrophobicContact CD1-CB 4.26Å; F214-C237 HydrophobicContact CE1-CB 4.3Å; F214-C237 HydrophobicContact CE2-CB 3.98Å; F214-C237 HydrophobicContact CZ-CB 3.49Å; F214-C237 VanDerWaalsContact CZ-CB 3.49Å; I219-C237 HydrophobicContact CD1-CB 4.44Å; Y223-C237 PolarHBondContact OH-SG 3.09Å; C237-H239 PolarHBondContact O-N 2.65Å; C237-L240 PolarHBondContact O-N 3.46Å; C237-A241 PolarHBondContact O-N 3.24Å; C237-A241 VanDerWaalsContact O-N 3.17Å
238	L	98.7	Very high	97.5	Very high	16 Å²	16	59.2 Å²	59.2	8%	0.084	32%	0.323	C	S	.	.	H	α-helix	trans	-63.8	-34.4	175.3	-55.3	168.8	0	0	0	111.1	Q212 F214 E236 A241 L242 A249 L251	Q212-L238 HydrophobicContact CB-CD2 4.32Å; Q212-L238 HydrophobicContact CG-CD1 4.29Å; Q212-L238 HydrophobicContact CG-CD2 4.34Å; Q212-L238 HydrophobicContact CG-CG 4.31Å; F214-L238 HydrophobicContact CE1-CD2 3.88Å; F214-L238 HydrophobicContact CE2-CD2 4.49Å; F214-L238 HydrophobicContact CZ-CD2 3.6Å; F214-L238 HydrophobicContact CZ-CG 4.19Å; E236-L238 HydrophobicContact CG-CB 4.26Å; E236-L238 WeakPolarHBondContact OE1-CB 3.41Å; E236-L238 VanDerWaalsContact OE1-CG 3.3Å; E236-L238 WeakPolarHBondContact OE1-CG 3.08Å; E236-L238 PolarHBondContact OE1-N 3.33Å; L238-A241 PolarHBondContact O-N 3Å; L238-L242 PolarHBondContact O-N 3.13Å; L238-L242 VanDerWaalsContact O-N 3.1Å; L238-A249 HydrophobicContact CB-CB 4.27Å; L238-A249 HydrophobicContact CD2-CB 3.67Å; L238-A249 HydrophobicContact CG-CB 4.43Å; L238-L251 HydrophobicContact CD1-CD2 4.27Å
239	H	98.4	Very high	97.6	Very high	101 Å²	101	54 Å²	54	47%	0.468	30%	0.301	S	S	.	.	H	α-helix	trans	-67.3	-42.1	177.1	-177.1	31	0	0	0	111.5	E236 C237 L242 Q243	E236-H239 HydrophobicContact CB-CB 4.11Å; E236-H239 HydrophobicContact CG-CB 3.88Å; C237-H239 PolarHBondContact O-N 2.65Å; H239-L242 PolarHBondContact O-N 2.76Å; H239-Q243 PolarHBondContact CE1-OE1 2.88Å; H239-Q243 VanDerWaalsContact CE1-OE1 3.23Å; H239-Q243 VanDerWaalsContact O-CB 3.25Å; H239-Q243 WeakPolarHBondContact O-CB 3.49Å; H239-Q243 PolarHBondContact O-N 2.69Å
240	L	98.5	Very high	97.6	Very high	3 Å²	3	56.2 Å²	56.2	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-43.1	175.9	-55.9	177.4	0	0	0	111.8	H125 A222 Y223 D230 C237 L242 Q243 Y244	H125-L240 WeakPolarHBondContact CE1-CD1 3.41Å; H125-L240 WeakPolarHBondContact ND1-CD1 3.47Å; A222-L240 HydrophobicContact CB-CB 4.27Å; Y223-L240 HydrophobicContact CD1-CD1 4.33Å; Y223-L240 HydrophobicContact CE1-CD1 3.71Å; D230-L240 HydrophobicContact CB-CD2 3.95Å; C237-L240 PolarHBondContact O-N 3.46Å; L240-L242 VanDerWaalsContact C-N 3.33Å; L240-L242 PolarHBondContact O-N 2.94Å; L240-Q243 PolarHBondContact O-N 3.2Å; L240-Y244 HydrophobicContact CB-CD2 4.45Å; L240-Y244 HydrophobicContact CD2-CD2 4.44Å; L240-Y244 HydrophobicContact CD2-CE2 4.2Å; L240-Y244 WeakPolarHBondContact O-CB 3.32Å; L240-Y244 PolarHBondContact O-N 3.33Å
241	A	98.7	Very high	97.7	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-62.9	-37.9	176.5	0	0	0	0	0	112.5	A176 F214 V218 C237 L238 C245 G246 T247	A176-A241 HydrophobicContact CB-CB 4.4Å; F214-A241 HydrophobicContact CD1-CB 4.1Å; F214-A241 HydrophobicContact CE1-CB 3.91Å; V218-A241 HydrophobicContact CG1-CB 3.93Å; C237-A241 PolarHBondContact O-N 3.24Å; C237-A241 VanDerWaalsContact O-N 3.17Å; L238-A241 PolarHBondContact O-N 3Å; A241-C245 CarbonylContact O-C 3.23Å; A241-C245 WeakPolarHBondContact O-CA 3.48Å; A241-C245 WeakPolarHBondContact O-CB 3.44Å; A241-C245 PolarHBondContact O-N 3.34Å; A241-C245 VanDerWaalsContact O-N 3.15Å; A241-G246 PolarHBondContact O-N 3.03Å; A241-T247 PolarHBondContact O-N 2.97Å
242	L	98.6	Very high	97.8	Very high	85 Å²	85	59.6 Å²	59.6	45%	0.445	32%	0.321	S	S	.	.	H	α-helix	trans	-68.3	-48.1	173.3	178.9	62.7	0	0	0	112	L238 H239 L240 G246 T247 N248	L238-L242 PolarHBondContact O-N 3.13Å; L238-L242 VanDerWaalsContact O-N 3.1Å; H239-L242 PolarHBondContact O-N 2.76Å; L240-L242 VanDerWaalsContact C-N 3.33Å; L240-L242 PolarHBondContact O-N 2.94Å; L242-G246 VanDerWaalsContact O-CA 3.23Å; L242-G246 WeakPolarHBondContact O-CA 3.22Å; L242-G246 PolarHBondContact O-N 2.83Å; L242-G246 VanDerWaalsContact O-N 3.12Å; L242-T247 PolarHBondContact N-O 3.33Å; L242-N248 HydrophobicContact CD1-CB 4.37Å
243	Q	98.3	Very high	97.9	Very high	89 Å²	89	60.8 Å²	60.8	42%	0.416	33%	0.33	S	S	.	.	H	α-helix	trans	-67.8	-39.9	-174.5	-178.5	160.9	-58.8	0	0	113.1	D230 H239 L240	D230-Q243 PolarHBondContact OD1-NE2 3.17Å; H239-Q243 PolarHBondContact CE1-OE1 2.88Å; H239-Q243 VanDerWaalsContact CE1-OE1 3.23Å; H239-Q243 VanDerWaalsContact O-CB 3.25Å; H239-Q243 WeakPolarHBondContact O-CB 3.49Å; H239-Q243 PolarHBondContact O-N 2.69Å; L240-Q243 PolarHBondContact O-N 3.2Å
244	Y	98.5	Very high	98	Very high	47 Å²	47	53.4 Å²	53.4	18%	0.184	30%	0.299	C	S	.	.	H	α-helix	trans	-107.7	-18.4	-170.1	-69.6	-62.4	0	0	0	115.2	K225 D230 L240	K225-Y244 HydrophobicContact CB-CD1 3.44Å; K225-Y244 VanDerWaalsContact CB-CD1 3.44Å; K225-Y244 HydrophobicContact CB-CE1 4.13Å; K225-Y244 HydrophobicContact CB-CG 3.74Å; K225-Y244 HydrophobicContact CD-CD1 4.3Å; K225-Y244 WeakPolarHBondContact CD-O 3.43Å; K225-Y244 PolarHBondContact NZ-O 2.79Å; K225-Y244 VanDerWaalsContact O-CE1 3.25Å; K225-Y244 WeakPolarHBondContact O-CE1 3.36Å; D230-Y244 PolarHBondContact OD2-OH 3.39Å; L240-Y244 HydrophobicContact CB-CD2 4.45Å; L240-Y244 HydrophobicContact CD2-CD2 4.44Å; L240-Y244 HydrophobicContact CD2-CE2 4.2Å; L240-Y244 WeakPolarHBondContact O-CB 3.32Å; L240-Y244 PolarHBondContact O-N 3.33Å
245	C	98.4	Very high	98	Very high	29 Å²	29	53.9 Å²	53.9	20%	0.196	30%	0.297	C	S	.	.	H	α-helix	trans	-126.6	7	179.5	-59.6	0	0	0	0	112.9	V218 E221 A222 A241 T247	V218-C245 HydrophobicContact CG1-CB 4.06Å; V218-C245 PolarHBondContact O-SG 3.43Å; E221-C245 PolarHBondContact OE2-SG 2.78Å; A222-C245 PolarHBondContact N-SG 2.92Å; A241-C245 CarbonylContact O-C 3.23Å; A241-C245 WeakPolarHBondContact O-CA 3.48Å; A241-C245 WeakPolarHBondContact O-CB 3.44Å; A241-C245 PolarHBondContact O-N 3.34Å; A241-C245 VanDerWaalsContact O-N 3.15Å; C245-T247 PolarHBondContact O-N 2.77Å; C245-T247 PolarHBondContact O-OG1 2.65Å; C245-T247 VanDerWaalsContact O-OG1 3.09Å
246	G	98.4	Very high	98	Very high	62 Å²	62	53.1 Å²	53.1	64%	0.639	29%	0.294	S	S	*	.			trans	60.1	11.6	-176.6	0	0	0	0	0	114.5	A241 L242 N248	A241-G246 PolarHBondContact O-N 3.03Å; L242-G246 VanDerWaalsContact O-CA 3.23Å; L242-G246 WeakPolarHBondContact O-CA 3.22Å; L242-G246 PolarHBondContact O-N 2.83Å; L242-G246 VanDerWaalsContact O-N 3.12Å; G246-N248 PolarHBondContact O-N 2.88Å
247	T	98.6	Very high	97.7	Very high	21 Å²	21	53.5 Å²	53.5	13%	0.129	30%	0.299	C	S	.	.			trans	-86.6	101.5	-166.3	-60	0	0	0	0	110.1	Q174 A176 V218 A241 L242 C245 A249	Q174-T247 WeakPolarHBondContact O-CG2 3.36Å; A176-T247 HydrophobicContact CB-CG2 3.88Å; V218-T247 HydrophobicContact CG1-CG2 4.11Å; A241-T247 PolarHBondContact O-N 2.97Å; L242-T247 PolarHBondContact N-O 3.33Å; C245-T247 PolarHBondContact O-N 2.77Å; C245-T247 PolarHBondContact O-OG1 2.65Å; C245-T247 VanDerWaalsContact O-OG1 3.09Å; T247-A249 PolarHBondContact O-N 2.87Å
248	N	97.9	Very high	97.5	Very high	126 Å²	126	53.6 Å²	53.6	67%	0.674	30%	0.3	S	S	*	.			trans	-76.6	112.1	179.1	-170.9	9.2	0	0	0	111	L242 G246	L242-N248 HydrophobicContact CD1-CB 4.37Å; G246-N248 PolarHBondContact O-N 2.88Å
249	A	98.7	Very high	97.2	Very high	14 Å²	14	56.1 Å²	56.1	12%	0.116	31%	0.308	C	S	.	.			trans	-76.8	139.5	-169.6	0	0	0	0	0	114.1	A176 L238 T247 L251	A176-A249 HydrophobicContact CB-CB 3.71Å; A176-A249 CarbonylContact O-C 3.55Å; A176-A249 WeakPolarHBondContact O-CA 3.42Å; L238-A249 HydrophobicContact CB-CB 4.27Å; L238-A249 HydrophobicContact CD2-CB 3.67Å; L238-A249 HydrophobicContact CG-CB 4.43Å; T247-A249 PolarHBondContact O-N 2.87Å; A249-L251 PolarHBondContact O-N 3.43Å; A249-L251 VanDerWaalsContact O-N 3.16Å
250	K	98.8	Very high	97	Very high	115 Å²	115	54.7 Å²	54.7	50%	0.5	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	106.9	172.3	-176.6	63.1	178.2	-173.6	0	111.2	A170 Q174 A176 A177 G178 I252	A170-K250 HydrophobicContact CB-CB 4.19Å; A170-K250 HydrophobicContact CB-CG 4.03Å; Q174-K250 HydrophobicContact CB-CB 4.26Å; Q174-K250 HydrophobicContact CG-CB 4.04Å; A176-K250 PolarHBondContact O-N 3.01Å; A177-K250 CarbonylContact C-O 3.44Å; A177-K250 WeakPolarHBondContact CA-O 3.43Å; A177-K250 HydrophobicContact CB-CB 4.13Å; A177-K250 WeakPolarHBondContact CB-O 3.31Å; G178-K250 PolarHBondContact N-O 2.89Å; K250-I252 HydrophobicContact CG-CG1 4.25Å
251	L	98.7	Very high	96.7	Very high	89 Å²	89	54.5 Å²	54.5	47%	0.466	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	137.5	172	-51.9	-178.3	0	0	0	110.6	G178 I180 L238 A249	G178-L251 WeakPolarHBondContact O-CA 3.3Å; I180-L251 HydrophobicContact CD1-CB 3.9Å; I180-L251 HydrophobicContact CG1-CB 4.16Å; I180-L251 HydrophobicContact CG2-CB 4.06Å; I180-L251 HydrophobicContact CG2-CD1 4.26Å; I180-L251 HydrophobicContact CG2-CD2 3.98Å; I180-L251 HydrophobicContact CG2-CG 4.32Å; L238-L251 HydrophobicContact CD1-CD2 4.27Å; A249-L251 PolarHBondContact O-N 3.43Å; A249-L251 VanDerWaalsContact O-N 3.16Å
252	I	98.6	Very high	96.3	Very high	34 Å²	34	55.5 Å²	55.5	17%	0.174	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	125.4	-178.7	-50.9	-174.6	0	0	0	109.5	F163 K166 I167 A170 G178 A179 I180 K250 G254	F163-I252 HydrophobicContact CE2-CG2 3.93Å; F163-I252 HydrophobicContact CZ-CG2 4.41Å; K166-I252 HydrophobicContact CB-CD1 4.31Å; I167-I252 HydrophobicContact CD1-CB 4.41Å; I167-I252 HydrophobicContact CD1-CD1 3.96Å; I167-I252 HydrophobicContact CD1-CG1 4.37Å; I167-I252 HydrophobicContact CG1-CD1 4.44Å; A170-I252 HydrophobicContact CB-CD1 3.86Å; G178-I252 PolarHBondContact O-N 2.71Å; A179-I252 CarbonylContact C-O 3.57Å; A179-I252 WeakPolarHBondContact CA-O 3.5Å; I180-I252 WeakPolarHBondContact CG1-O 3.45Å; I180-I252 PolarHBondContact N-O 3.04Å; K250-I252 HydrophobicContact CG-CG1 4.25Å; I252-G254 PolarHBondContact O-N 3.3Å
253	D	98.2	Very high	95.8	Very high	108 Å²	108	56.5 Å²	56.5	58%	0.578	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.3	116	175.1	-71.2	-71.7	0	0	0	111.5
254	G	96.7	Very high	95.3	Very high	5 Å²	5	59.6 Å²	59.6	5%	0.052	32%	0.316	C	S	.	.			trans	-86.9	158.8	-179.3	0	0	0	0	0	113.7	I180 R181 I252	I180-G254 PolarHBondContact O-N 3.16Å; R181-G254 WeakPolarHBondContact CD-O 3.44Å; R181-G254 PolarHBondContact NH1-O 3.43Å; I252-G254 PolarHBondContact O-N 3.3Å
255	P	95.3	Very high	94.8	Very high	35 Å²	35	66.3 Å²	66.3	23%	0.227	34%	0.341	C	S	.	.			trans	-64.7	159.7	170.4	28.4	-34.4	0	0	0	111.4	T257 L258	P255-T257 WeakPolarHBondContact CB-OG1 3.31Å; P255-T257 WeakPolarHBondContact CG-OG1 3.48Å; P255-T257 PolarHBondContact O-N 3.21Å; P255-L258 HydrophobicContact CG-CD2 4.23Å; P255-L258 HydrophobicContact CG-CG 4.04Å
256	P	93.1	Very high	94.5	Very high	94 Å²	94	65.8 Å²	65.8	61%	0.61	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-65.2	-18.8	178.8	28.4	-35.6	0	0	0	113.3	L258	P256-L258 VanDerWaalsContact C-N 3.28Å; P256-L258 PolarHBondContact O-N 2.85Å
257	T	92.8	Very high	94	Very high	50 Å²	50	63.9 Å²	63.9	31%	0.307	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-64.9	-21.5	-178.7	43.1	0	0	0	0	114.8	P255 W259	P255-T257 WeakPolarHBondContact CB-OG1 3.31Å; P255-T257 WeakPolarHBondContact CG-OG1 3.48Å; P255-T257 PolarHBondContact O-N 3.21Å; T257-W259 PolarHBondContact O-N 3.15Å
258	L	93.5	Very high	93.6	Very high	2 Å²	2	65.7 Å²	65.7	1%	0.01	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-64.7	-4.4	-173.7	-61.5	-177.2	0	0	0	115.3	R156 V159 F163 A179 P255 P256	R156-L258 WeakPolarHBondContact CD-O 3.49Å; R156-L258 PolarHBondContact NH1-O 3.28Å; V159-L258 HydrophobicContact CB-CD2 4.31Å; V159-L258 HydrophobicContact CG2-CD2 4.03Å; F163-L258 HydrophobicContact CD1-CD1 4.41Å; F163-L258 HydrophobicContact CD1-CD2 4.34Å; F163-L258 HydrophobicContact CE1-CD1 3.8Å; F163-L258 HydrophobicContact CE1-CD2 4.47Å; F163-L258 HydrophobicContact CZ-CD1 4.18Å; A179-L258 HydrophobicContact CB-CD1 3.76Å; P255-L258 HydrophobicContact CG-CD2 4.23Å; P255-L258 HydrophobicContact CG-CG 4.04Å; P256-L258 VanDerWaalsContact C-N 3.28Å; P256-L258 PolarHBondContact O-N 2.85Å
259	W	93	Very high	93.4	Very high	69 Å²	69	61.7 Å²	61.7	26%	0.261	31%	0.313	S	S	.	.			trans	-57.7	149.5	-168.7	61.1	-99.4	0	0	0	114.2	F158 T257 V261 D266 A269 A270 I273	F158-W259 HydrophobicContact CD2-CZ2 4.34Å; F158-W259 HydrophobicContact CE2-CH2 4.31Å; F158-W259 AromaticContact CE2-CZ2 3.91Å; F158-W259 HydrophobicContact CE2-CZ2 3.91Å; T257-W259 PolarHBondContact O-N 3.15Å; W259-V261 HydrophobicContact CE3-CG2 4.33Å; W259-V261 HydrophobicContact CH2-CG2 4.01Å; W259-V261 HydrophobicContact CZ3-CB 4.21Å; W259-V261 HydrophobicContact CZ3-CG2 3.49Å; W259-V261 VanDerWaalsContact CZ3-CG2 3.49Å; W259-D266 HydrophobicContact CH2-CB 4.5Å; W259-D266 VanDerWaalsContact CH2-O 3.29Å; W259-D266 WeakPolarHBondContact CH2-O 3.23Å; W259-D266 HydrophobicContact CZ3-CB 3.81Å; W259-A269 HydrophobicContact CH2-CB 3.96Å; W259-A269 HydrophobicContact CZ2-CB 4.06Å; W259-A270 HydrophobicContact CH2-CB 3.95Å; W259-I273 HydrophobicContact CZ2-CD1 3.89Å
260	K	93.9	Very high	93.1	Very high	71 Å²	71	61 Å²	61	31%	0.309	31%	0.308	S	S	.	.			trans	-90.1	118.9	-173.7	-163.7	172.2	-173.1	152.6	0	112.2	D153 V155 R156 T262	D153-K260 IonicContact OD1-NZ 2.65Å; D153-K260 PolarHBondContact OD1-NZ 2.9Å; D153-K260 VanDerWaalsContact OD1-NZ 3.16Å; D153-K260 VanDerWaalsContact OD2-CE 3.22Å; D153-K260 WeakPolarHBondContact OD2-CE 3.29Å; D153-K260 IonicContact OD2-NZ 2.64Å; D153-K260 PolarHBondContact OD2-NZ 3.16Å; V155-K260 HydrophobicContact CG2-CG 3.86Å; R156-K260 HydrophobicContact CG-CB 4.26Å; R156-K260 HydrophobicContact CG-CG 4.28Å; K260-T262 PolarHBondContact O-N 3.19Å; K260-T262 PolarHBondContact O-OG1 2.78Å
261	V	92.9	Very high	92.7	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.299	C	S	.	.			trans	-60.2	107	170.7	179.9	0	0	0	0	109	K64 L74 V155 W259 D266 L267 A270	K64-V261 WeakPolarHBondContact CE-O 3.37Å; K64-V261 PolarHBondContact NZ-O 3.27Å; L74-V261 HydrophobicContact CD2-CB 4.06Å; L74-V261 HydrophobicContact CD2-CG1 3.96Å; L74-V261 HydrophobicContact CD2-CG2 4.08Å; V155-V261 HydrophobicContact CB-CB 4.27Å; V155-V261 WeakPolarHBondContact O-CB 3.41Å; V155-V261 WeakPolarHBondContact O-CG2 3.44Å; V155-V261 PolarHBondContact O-N 2.56Å; W259-V261 HydrophobicContact CE3-CG2 4.33Å; W259-V261 HydrophobicContact CH2-CG2 4.01Å; W259-V261 HydrophobicContact CZ3-CB 4.21Å; W259-V261 HydrophobicContact CZ3-CG2 3.49Å; W259-V261 VanDerWaalsContact CZ3-CG2 3.49Å; V261-D266 HydrophobicContact CG1-CB 4.42Å; V261-L267 HydrophobicContact CG1-CD2 3.5Å; V261-L267 HydrophobicContact CG1-CG 4.35Å; V261-A270 HydrophobicContact CG2-CB 4.12Å
262	T	89.1	Confident	92.3	Very high	20 Å²	20	57.9 Å²	57.9	12%	0.123	30%	0.3	C	S	.	.			trans	-124.3	-42.2	-167.2	-59.3	0	0	0	0	113.4	T58 K260 D266	T58-T262 WeakPolarHBondContact CG2-O 3.38Å; K260-T262 PolarHBondContact O-N 3.19Å; K260-T262 PolarHBondContact O-OG1 2.78Å; T262-D266 WeakPolarHBondContact CA-OD2 3.47Å; T262-D266 WeakPolarHBondContact CB-OD2 3.35Å; T262-D266 PolarHBondContact N-OD2 3.1Å
263	Y	89.1	Confident	92	Very high	107 Å²	107	58.7 Å²	58.7	42%	0.42	30%	0.304	S	S	.	.	S	Bend	trans	-121.6	167.7	-176.1	-53.9	-76.1	0	0	0	111.6	R57 R265 D266 L267	R57-Y263 HydrophobicContact CB-CD1 4.27Å; R57-Y263 HydrophobicContact CB-CE1 4.13Å; Y263-R265 VanDerWaalsContact C-N 3.31Å; Y263-R265 PolarHBondContact O-N 3.42Å; Y263-D266 WeakPolarHBondContact CD2-OD2 3.33Å; Y263-D266 PolarHBondContact N-OD2 3.5Å; Y263-D266 VanDerWaalsContact O-CB 3.31Å; Y263-D266 WeakPolarHBondContact O-CB 3.44Å; Y263-D266 PolarHBondContact O-N 3.17Å; Y263-L267 PolarHBondContact O-N 3.35Å
264	K	86.3	Confident	91.5	Very high	153 Å²	153	53.8 Å²	53.8	67%	0.665	28%	0.278	S	S	*	.	H	α-helix	trans	-58.1	-36.1	-178.5	-173.6	174.7	179.3	178.4	0	114.2	D266 L267	K264-D266 VanDerWaalsContact C-N 3.26Å; K264-D266 PolarHBondContact O-N 2.9Å; K264-L267 HydrophobicContact CG-CD1 4.46Å; K264-L267 WeakPolarHBondContact O-CB 3.39Å; K264-L267 PolarHBondContact O-N 2.89Å
265	R	89.6	Confident	91.2	Very high	188 Å²	188	57.8 Å²	57.8	71%	0.709	29%	0.294	S	S	*	.	H	α-helix	trans	-63.9	-33.1	174.8	76.2	-173.1	-178.4	-178.2	0.5	112.2	Y263 L267 A268 A269	Y263-R265 VanDerWaalsContact C-N 3.31Å; Y263-R265 PolarHBondContact O-N 3.42Å; R265-L267 VanDerWaalsContact C-N 3.28Å; R265-L267 PolarHBondContact O-N 3.32Å; R265-A268 PolarHBondContact O-N 2.6Å; R265-A269 PolarHBondContact O-N 3.43Å; R265-A269 VanDerWaalsContact O-N 3.13Å
266	D	92	Very high	90.8	Very high	19 Å²	19	61.7 Å²	61.7	10%	0.102	31%	0.31	C	S	.	.	H	α-helix	trans	-73.1	-27.3	-177.7	-42.5	-14.8	0	0	0	110.1	W259 V261 T262 Y263 K264 A270	W259-D266 HydrophobicContact CH2-CB 4.5Å; W259-D266 VanDerWaalsContact CH2-O 3.29Å; W259-D266 WeakPolarHBondContact CH2-O 3.23Å; W259-D266 HydrophobicContact CZ3-CB 3.81Å; V261-D266 HydrophobicContact CG1-CB 4.42Å; T262-D266 WeakPolarHBondContact CA-OD2 3.47Å; T262-D266 WeakPolarHBondContact CB-OD2 3.35Å; T262-D266 PolarHBondContact N-OD2 3.1Å; Y263-D266 WeakPolarHBondContact CD2-OD2 3.33Å; Y263-D266 PolarHBondContact N-OD2 3.5Å; Y263-D266 VanDerWaalsContact O-CB 3.31Å; Y263-D266 WeakPolarHBondContact O-CB 3.44Å; Y263-D266 PolarHBondContact O-N 3.17Å; K264-D266 VanDerWaalsContact C-N 3.26Å; K264-D266 PolarHBondContact O-N 2.9Å; D266-A270 PolarHBondContact O-N 3.33Å
267	L	88	Confident	90.4	Very high	21 Å²	21	61.2 Å²	61.2	11%	0.11	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-50.7	168.6	-54.2	170.4	0	0	0	110.2	L60 F69 V261 Y263 K264 R265 A269 A270 E271	L60-L267 HydrophobicContact CD1-CD1 3.79Å; F69-L267 HydrophobicContact CE1-CB 4.23Å; F69-L267 VanDerWaalsContact CE1-O 3.31Å; F69-L267 WeakPolarHBondContact CE1-O 3.38Å; F69-L267 HydrophobicContact CE2-CD2 4.46Å; F69-L267 HydrophobicContact CZ-CB 3.97Å; F69-L267 HydrophobicContact CZ-CD2 3.77Å; F69-L267 HydrophobicContact CZ-CG 4.46Å; V261-L267 HydrophobicContact CG1-CD2 3.5Å; V261-L267 HydrophobicContact CG1-CG 4.35Å; Y263-L267 PolarHBondContact O-N 3.35Å; K264-L267 HydrophobicContact CG-CD1 4.46Å; K264-L267 WeakPolarHBondContact O-CB 3.39Å; K264-L267 PolarHBondContact O-N 2.89Å; R265-L267 VanDerWaalsContact C-N 3.28Å; R265-L267 PolarHBondContact O-N 3.32Å; L267-A269 VanDerWaalsContact C-N 3.29Å; L267-A269 PolarHBondContact O-N 3.25Å; L267-A270 WeakPolarHBondContact O-CB 3.36Å; L267-A270 PolarHBondContact O-N 3.5Å; L267-A270 VanDerWaalsContact O-N 3.09Å; L267-E271 PolarHBondContact O-N 3.15Å
268	A	89.8	Confident	89.9	Confident	59 Å²	59	61.8 Å²	61.8	49%	0.488	31%	0.306	S	S	.	.	H	α-helix	trans	-61.1	-37.2	179.8	0	0	0	0	0	112.6	R265 E271 S272	R265-A268 PolarHBondContact O-N 2.6Å; A268-E271 PolarHBondContact O-N 3.33Å; A268-S272 PolarHBondContact O-N 3.15Å
269	A	92.6	Very high	89.3	Confident	43 Å²	43	64.5 Å²	64.5	36%	0.355	33%	0.325	S	S	.	.	H	α-helix	trans	-63.3	-45	172.1	0	0	0	0	0	112.2	W259 R265 L267 E271 S272 I273	W259-A269 HydrophobicContact CH2-CB 3.96Å; W259-A269 HydrophobicContact CZ2-CB 4.06Å; R265-A269 PolarHBondContact O-N 3.43Å; R265-A269 VanDerWaalsContact O-N 3.13Å; L267-A269 VanDerWaalsContact C-N 3.29Å; L267-A269 PolarHBondContact O-N 3.25Å; A269-E271 PolarHBondContact O-N 3.45Å; A269-S272 PolarHBondContact O-N 3.01Å; A269-I273 WeakPolarHBondContact O-CG1 3.4Å; A269-I273 PolarHBondContact O-N 3.35Å; A269-I273 VanDerWaalsContact O-N 3.12Å
270	A	92.2	Very high	88.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-62.6	-41.6	176.1	0	0	0	0	0	112	F69 F158 W259 V261 D266 L267 S272 I273 I274	F69-A270 HydrophobicContact CE1-CB 4.3Å; F158-A270 HydrophobicContact CE2-CB 4.13Å; F158-A270 HydrophobicContact CZ-CB 4.09Å; W259-A270 HydrophobicContact CH2-CB 3.95Å; V261-A270 HydrophobicContact CG2-CB 4.12Å; D266-A270 PolarHBondContact O-N 3.33Å; L267-A270 WeakPolarHBondContact O-CB 3.36Å; L267-A270 PolarHBondContact O-N 3.5Å; L267-A270 VanDerWaalsContact O-N 3.09Å; A270-S272 VanDerWaalsContact C-N 3.32Å; A270-S272 PolarHBondContact O-N 3.35Å; A270-I273 PolarHBondContact O-N 2.92Å; A270-I274 WeakPolarHBondContact O-CB 3.39Å; A270-I274 WeakPolarHBondContact O-CD1 3.45Å; A270-I274 VanDerWaalsContact O-CG1 3.22Å; A270-I274 WeakPolarHBondContact O-CG1 3.35Å; A270-I274 PolarHBondContact O-N 2.98Å
271	E	90.5	Very high	87.5	Confident	66 Å²	66	65.2 Å²	65.2	31%	0.308	34%	0.338	S	S	.	.	H	α-helix	trans	-61.8	-40.1	176.6	-163	-173.6	164.7	0	0	112	F69 L267 A268 A269 K275	F69-E271 HydrophobicContact CD1-CB 3.69Å; F69-E271 HydrophobicContact CD1-CG 3.98Å; F69-E271 HydrophobicContact CE1-CB 3.94Å; L267-E271 PolarHBondContact O-N 3.15Å; A268-E271 PolarHBondContact O-N 3.33Å; A269-E271 PolarHBondContact O-N 3.45Å; E271-K275 VanDerWaalsContact CD-NZ 3.33Å; E271-K275 HydrophobicContact CG-CD 4.35Å; E271-K275 WeakPolarHBondContact O-CB 3.48Å; E271-K275 VanDerWaalsContact O-CG 3.29Å; E271-K275 WeakPolarHBondContact O-CG 3.48Å; E271-K275 PolarHBondContact O-N 3.12Å; E271-K275 WeakPolarHBondContact OE1-CE 3.31Å; E271-K275 IonicContact OE1-NZ 2.77Å; E271-K275 PolarHBondContact OE1-NZ 3.29Å
272	S	91.1	Very high	86.6	Confident	71 Å²	71	66.3 Å²	66.3	50%	0.497	35%	0.347	S	S	.	.	H	α-helix	trans	-63.9	-47.1	177.1	-162.8	0	0	0	0	111.9	A268 A269 A270 K275 E276	A268-S272 PolarHBondContact O-N 3.15Å; A269-S272 PolarHBondContact O-N 3.01Å; A270-S272 VanDerWaalsContact C-N 3.32Å; A270-S272 PolarHBondContact O-N 3.35Å; S272-K275 PolarHBondContact O-N 3.47Å; S272-E276 WeakPolarHBondContact O-CB 3.31Å; S272-E276 PolarHBondContact O-N 2.71Å
273	I	91.3	Very high	86	Confident	51 Å²	51	66.8 Å²	66.8	26%	0.262	35%	0.35	S	S	.	.	H	α-helix	trans	-64.1	-43.9	178.2	-63.2	167.6	0	0	0	110.5	F158 W259 A269 A270 K275 E276 T277	F158-I273 HydrophobicContact CD1-CG2 3.83Å; F158-I273 HydrophobicContact CD2-CD1 4.28Å; F158-I273 HydrophobicContact CE1-CB 4.01Å; F158-I273 HydrophobicContact CE1-CG2 3.47Å; F158-I273 VanDerWaalsContact CE1-CG2 3.47Å; F158-I273 HydrophobicContact CE2-CB 4.31Å; F158-I273 HydrophobicContact CE2-CD1 3.91Å; F158-I273 HydrophobicContact CE2-CG2 4.3Å; F158-I273 HydrophobicContact CG-CG2 4.38Å; F158-I273 HydrophobicContact CZ-CB 3.77Å; F158-I273 HydrophobicContact CZ-CD1 4.25Å; F158-I273 HydrophobicContact CZ-CG2 3.74Å; W259-I273 HydrophobicContact CZ2-CD1 3.89Å; A269-I273 WeakPolarHBondContact O-CG1 3.4Å; A269-I273 PolarHBondContact O-N 3.35Å; A269-I273 VanDerWaalsContact O-N 3.12Å; A270-I273 PolarHBondContact O-N 2.92Å; I273-K275 VanDerWaalsContact C-N 3.34Å; I273-K275 PolarHBondContact O-N 3.25Å; I273-E276 PolarHBondContact O-N 2.77Å; I273-T277 PolarHBondContact O-N 3.29Å; I273-T277 PolarHBondContact O-OG1 2.81Å; I273-T277 VanDerWaalsContact O-OG1 3.1Å
274	I	89.7	Confident	85.4	Confident	6 Å²	6	63.4 Å²	63.4	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-59.3	-44.1	176.6	-73.1	166.6	0	0	0	111.1	F69 L70 Y77 F158 A270 L278	F69-I274 HydrophobicContact CB-CD1 4Å; F69-I274 HydrophobicContact CD1-CD1 4.32Å; F69-I274 HydrophobicContact CG-CD1 4.12Å; L70-I274 HydrophobicContact CD1-CG2 4.08Å; Y77-I274 HydrophobicContact CD1-CD1 4.34Å; Y77-I274 HydrophobicContact CD1-CG1 4.38Å; Y77-I274 HydrophobicContact CD2-CD1 4.1Å; Y77-I274 HydrophobicContact CE1-CD1 4.28Å; Y77-I274 HydrophobicContact CE1-CG1 4.25Å; Y77-I274 HydrophobicContact CE1-CG2 3.63Å; Y77-I274 HydrophobicContact CE2-CD1 4.03Å; Y77-I274 HydrophobicContact CE2-CG2 4.49Å; Y77-I274 HydrophobicContact CG-CD1 4.25Å; Y77-I274 WeakPolarHBondContact OH-CG2 3.43Å; F158-I274 HydrophobicContact CE1-CG1 3.92Å; F158-I274 HydrophobicContact CZ-CD1 4.47Å; F158-I274 HydrophobicContact CZ-CG1 4.05Å; A270-I274 WeakPolarHBondContact O-CB 3.39Å; A270-I274 WeakPolarHBondContact O-CD1 3.45Å; A270-I274 VanDerWaalsContact O-CG1 3.22Å; A270-I274 WeakPolarHBondContact O-CG1 3.35Å; A270-I274 PolarHBondContact O-N 2.98Å; I274-L278 HydrophobicContact CG2-CD1 3.82Å; I274-L278 VanDerWaalsContact O-CB 3.29Å; I274-L278 WeakPolarHBondContact O-CB 3.14Å; I274-L278 WeakPolarHBondContact O-CD1 3.25Å; I274-L278 VanDerWaalsContact O-CG 3.26Å; I274-L278 WeakPolarHBondContact O-CG 3.24Å; I274-L278 PolarHBondContact O-N 3.5Å
275	K	88.4	Confident	85	Confident	88 Å²	88	61 Å²	61	38%	0.383	33%	0.333	S	S	.	.	H	α-helix	trans	-62.8	-44.1	175	-77.2	169.6	-178.3	167.4	0	111.8	L70 E271 S272 I273 L278 S279	L70-K275 HydrophobicContact CD1-CG 3.97Å; L70-K275 HydrophobicContact CD2-CG 4.2Å; L70-K275 HydrophobicContact CG-CG 4.45Å; E271-K275 VanDerWaalsContact CD-NZ 3.33Å; E271-K275 HydrophobicContact CG-CD 4.35Å; E271-K275 WeakPolarHBondContact O-CB 3.48Å; E271-K275 VanDerWaalsContact O-CG 3.29Å; E271-K275 WeakPolarHBondContact O-CG 3.48Å; E271-K275 PolarHBondContact O-N 3.12Å; E271-K275 WeakPolarHBondContact OE1-CE 3.31Å; E271-K275 IonicContact OE1-NZ 2.77Å; E271-K275 PolarHBondContact OE1-NZ 3.29Å; S272-K275 PolarHBondContact O-N 3.47Å; I273-K275 VanDerWaalsContact C-N 3.34Å; I273-K275 PolarHBondContact O-N 3.25Å; K275-L278 PolarHBondContact O-N 2.72Å; K275-S279 VanDerWaalsContact O-CB 3.28Å; K275-S279 WeakPolarHBondContact O-CB 3.26Å; K275-S279 PolarHBondContact O-N 3.04Å; K275-S279 PolarHBondContact O-OG 3.48Å
276	E	87.9	Confident	84.5	Confident	118 Å²	118	53 Å²	53	55%	0.551	31%	0.305	S	S	*	.	H	α-helix	trans	-60.5	-55.2	178.6	-173	179.1	169.6	0	0	111.2	S272 I273 L278 S279 Q280	S272-E276 WeakPolarHBondContact O-CB 3.31Å; S272-E276 PolarHBondContact O-N 2.71Å; I273-E276 PolarHBondContact O-N 2.77Å; E276-L278 VanDerWaalsContact C-N 3.31Å; E276-L278 PolarHBondContact O-N 3.35Å; E276-S279 CarbonylContact O-C 3.48Å; E276-S279 WeakPolarHBondContact O-CA 3.44Å; E276-S279 PolarHBondContact O-N 3.19Å; E276-Q280 PolarHBondContact O-N 3.26Å
277	T	85.1	Confident	83.6	Confident	83 Å²	83	54 Å²	54	51%	0.509	32%	0.32	S	S	.	.	H	α-helix	trans	-56.6	-42.8	177.3	-53.8	0	0	0	0	112.2	I273 S279 Q280	I273-T277 PolarHBondContact O-N 3.29Å; I273-T277 PolarHBondContact O-OG1 2.81Å; I273-T277 VanDerWaalsContact O-OG1 3.1Å; T277-S279 PolarHBondContact O-N 2.8Å; T277-Q280 PolarHBondContact O-N 3.3Å
278	L	80.8	Confident	83	Confident	62 Å²	62	56.8 Å²	56.8	33%	0.325	35%	0.353	S	S	.	.	H	α-helix	trans	-70.2	-13.6	176.9	-73.3	171.9	0	0	0	113.7	L70 I274 K275 E276 T323	L70-L278 HydrophobicContact CD1-CD1 3.68Å; I274-L278 HydrophobicContact CG2-CD1 3.82Å; I274-L278 VanDerWaalsContact O-CB 3.29Å; I274-L278 WeakPolarHBondContact O-CB 3.14Å; I274-L278 WeakPolarHBondContact O-CD1 3.25Å; I274-L278 VanDerWaalsContact O-CG 3.26Å; I274-L278 WeakPolarHBondContact O-CG 3.24Å; I274-L278 PolarHBondContact O-N 3.5Å; K275-L278 PolarHBondContact O-N 2.72Å; E276-L278 VanDerWaalsContact C-N 3.31Å; E276-L278 PolarHBondContact O-N 3.35Å; L278-T323 WeakPolarHBondContact O-CB 3.15Å; L278-T323 PolarHBondContact O-OG1 3.09Å
279	S	82.8	Confident	82.6	Confident	59 Å²	59	59.8 Å²	59.8	41%	0.413	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	6.3	-179.4	-54.4	0	0	0	0	113.5	K275 E276 T277 L306	K275-S279 VanDerWaalsContact O-CB 3.28Å; K275-S279 WeakPolarHBondContact O-CB 3.26Å; K275-S279 PolarHBondContact O-N 3.04Å; K275-S279 PolarHBondContact O-OG 3.48Å; E276-S279 CarbonylContact O-C 3.48Å; E276-S279 WeakPolarHBondContact O-CA 3.44Å; E276-S279 PolarHBondContact O-N 3.19Å; T277-S279 PolarHBondContact O-N 2.8Å; S279-L306 WeakPolarHBondContact O-CD2 3.31Å
280	Q	76.6	Confident	81.9	Confident	106 Å²	106	66 Å²	66	50%	0.495	38%	0.382	S	S	.	.	S	Bend	trans	-81.4	-19.4	178.5	-72	178.8	-5.7	0	0	113.8	E276 T277 D307	E276-Q280 PolarHBondContact O-N 3.26Å; T277-Q280 PolarHBondContact O-N 3.3Å; Q280-D307 PolarHBondContact O-N 3.44Å
281	S	71.2	Confident	81.3	Confident	50 Å²	50	69.2 Å²	69.2	35%	0.35	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	142.5	-179.1	-44.5	0	0	0	0	111.4	D307	S281-D307 WeakPolarHBondContact CA-O 3.5Å; S281-D307 WeakPolarHBondContact CB-O 3.44Å
282	A	74.9	Confident	80.6	Confident	23 Å²	23	67.5 Å²	67.5	19%	0.19	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	150.2	174	0	0	0	0	0	111.2	D307 M308 V309	A282-D307 PolarHBondContact N-O 3.42Å; A282-M308 HydrophobicContact CB-CE 4.42Å; A282-M308 HydrophobicContact CB-SD 3.77Å; A282-M308 WeakPolarHBondContact O-CA 3.41Å; A282-V309 PolarHBondContact O-N 2.96Å
283	C	76.2	Confident	80	Confident	29 Å²	29	66.9 Å²	66.9	20%	0.196	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.6	177.8	-173.6	0	0	0	0	110	V309 V322	C283-V309 VanDerWaalsContact CA-O 3.31Å; C283-V309 WeakPolarHBondContact CA-O 3.47Å; C283-V309 PolarHBondContact SG-O 2.94Å; C283-V322 HydrophobicContact CB-CG1 3.83Å; C283-V322 HydrophobicContact CB-CG2 4.23Å
284	L	76.1	Confident	79.4	Confident	36 Å²	36	67 Å²	67	19%	0.188	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	103.2	178.5	-145	166.7	0	0	0	108.8	T286 A296 L299 M308 V309	L284-T286 HydrophobicContact CD2-CG2 3.83Å; L284-A296 HydrophobicContact CD1-CB 4.46Å; L284-A296 HydrophobicContact CD2-CB 3.95Å; L284-L299 HydrophobicContact CD1-CB 3.68Å; L284-L299 HydrophobicContact CD1-CD1 3.99Å; L284-M308 HydrophobicContact CB-CE 3.84Å; L284-M308 HydrophobicContact CD1-CE 4.06Å; L284-M308 HydrophobicContact CG-CE 4.39Å; L284-V309 PolarHBondContact N-O 2.75Å
285	I	78.1	Confident	78.9	Confident	103 Å²	103	70.7 Å²	70.7	53%	0.528	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	127.7	-178.3	-56.5	174.4	0	0	0	108.8
286	T	78.4	Confident	78.5	Confident	19 Å²	19	66.6 Å²	66.6	12%	0.117	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	149	175.6	51.9	0	0	0	0	113.1	L284 A292 A296 A313	L284-T286 HydrophobicContact CD2-CG2 3.83Å; T286-A292 HydrophobicContact CG2-CB 4.38Å; T286-A296 HydrophobicContact CG2-CB 3.79Å; T286-A313 PolarHBondContact O-N 2.77Å; T286-A313 VanDerWaalsContact O-N 3.12Å
287	G	74.6	Confident	78	Confident	42 Å²	42	64.5 Å²	64.5	43%	0.433	40%	0.402	S	S	.	.			trans	-67.7	162.1	164.1	0	0	0	0	0	111.7	L289	G287-L289 PolarHBondContact O-N 2.89Å
288	G	74.2	Confident	77.9	Confident	78 Å²	78	65 Å²	65	80%	0.804	41%	0.405	S	S	*	.	S	Bend	trans	-72.5	20.1	-176.1	0	0	0	0	0	116.4
289	L	82.2	Confident	77.9	Confident	123 Å²	123	64.2 Å²	64.2	64%	0.644	40%	0.401	S	S	*	.			trans	-84.8	130.1	176.9	-173.5	69.5	0	0	0	109.6	G287 A291 A292 V293	G287-L289 PolarHBondContact O-N 2.89Å; L289-A291 HydrophobicContact CD2-CB 4.33Å; L289-A291 HydrophobicContact CG-CB 4.4Å; L289-A291 PolarHBondContact O-N 3.39Å; L289-A291 VanDerWaalsContact O-N 3.16Å; L289-A292 HydrophobicContact CB-CB 4.35Å; L289-A292 WeakPolarHBondContact O-CB 3.25Å; L289-A292 PolarHBondContact O-N 2.88Å; L289-V293 PolarHBondContact O-N 2.9Å; L289-V293 VanDerWaalsContact O-N 3.1Å
290	E	77.7	Confident	77.6	Confident	172 Å²	172	64.4 Å²	64.4	80%	0.804	40%	0.395	S	S	*	.	H	α-helix	trans	-54.8	-38.8	-176.5	-63.4	-172.6	133.8	0	0	113	A292 V293 A294	E290-A292 VanDerWaalsContact C-N 3.34Å; E290-A292 PolarHBondContact O-N 2.95Å; E290-V293 PolarHBondContact O-N 2.54Å; E290-A294 WeakPolarHBondContact O-CB 3.49Å; E290-A294 PolarHBondContact O-N 3.02Å
291	A	79.6	Confident	77.6	Confident	68 Å²	68	67.5 Å²	67.5	56%	0.562	41%	0.407	S	S	*	.	H	α-helix	trans	-62.3	-37.7	176.1	0	0	0	0	0	113.1	L289 L295	L289-A291 HydrophobicContact CD2-CB 4.33Å; L289-A291 HydrophobicContact CG-CB 4.4Å; L289-A291 PolarHBondContact O-N 3.39Å; L289-A291 VanDerWaalsContact O-N 3.16Å; A291-L295 WeakPolarHBondContact O-CB 3.37Å; A291-L295 PolarHBondContact O-N 2.88Å
292	A	76.3	Confident	77.9	Confident	30 Å²	30	69 Å²	69	25%	0.248	42%	0.422	C	S	.	.	H	α-helix	trans	-70.5	-40.7	176.5	0	0	0	0	0	111.3	T286 L289 E290 L295 A296	T286-A292 HydrophobicContact CG2-CB 4.38Å; L289-A292 HydrophobicContact CB-CB 4.35Å; L289-A292 WeakPolarHBondContact O-CB 3.25Å; L289-A292 PolarHBondContact O-N 2.88Å; E290-A292 VanDerWaalsContact C-N 3.34Å; E290-A292 PolarHBondContact O-N 2.95Å; A292-L295 PolarHBondContact O-N 2.92Å; A292-A296 PolarHBondContact O-N 2.92Å
293	V	77.3	Confident	77.7	Confident	58 Å²	58	73 Å²	73	35%	0.352	44%	0.436	S	S	.	.	H	α-helix	trans	-65.4	-39.8	174.8	177.8	0	0	0	0	111.2	L289 E290 A296 N297	L289-V293 PolarHBondContact O-N 2.9Å; L289-V293 VanDerWaalsContact O-N 3.1Å; E290-V293 PolarHBondContact O-N 2.54Å; V293-A296 PolarHBondContact O-N 3.36Å; V293-N297 PolarHBondContact O-N 3.22Å; V293-N297 VanDerWaalsContact O-N 3.08Å; V293-N297 PolarHBondContact O-ND2 2.9Å
294	A	79	Confident	76.8	Confident	54 Å²	54	75 Å²	75	45%	0.446	46%	0.461	S	S	.	.	H	α-helix	trans	-61.6	-45.2	173.6	0	0	0	0	0	111.5	E290 N297 V298	E290-A294 WeakPolarHBondContact O-CB 3.49Å; E290-A294 PolarHBondContact O-N 3.02Å; A294-N297 PolarHBondContact O-N 3.39Å; A294-V298 WeakPolarHBondContact O-CG2 3.47Å; A294-V298 PolarHBondContact O-N 2.57Å; A294-V298 VanDerWaalsContact O-N 3.09Å
295	L	79.6	Confident	75.7	Confident	84 Å²	84	78.3 Å²	78.3	44%	0.44	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-42.1	175.8	-177.9	60.3	0	0	0	112.1	A291 A292 N297 V298 L299 L329	A291-L295 WeakPolarHBondContact O-CB 3.37Å; A291-L295 PolarHBondContact O-N 2.88Å; A292-L295 PolarHBondContact O-N 2.92Å; L295-N297 VanDerWaalsContact C-N 3.33Å; L295-N297 PolarHBondContact O-N 3.44Å; L295-V298 PolarHBondContact O-N 2.93Å; L295-V298 VanDerWaalsContact O-N 3.16Å; L295-L299 HydrophobicContact CD1-CD1 4.31Å; L295-L299 HydrophobicContact CD1-CG 4.25Å; L295-L299 HydrophobicContact CG-CD1 4.01Å; L295-L299 HydrophobicContact CG-CG 4.4Å; L295-L299 WeakPolarHBondContact O-CG 3.36Å; L295-L299 PolarHBondContact O-N 3.23Å; L295-L329 HydrophobicContact CD2-CD1 4.08Å
296	A	80.1	Confident	74.7	Confident	2 Å²	2	76.4 Å²	76.4	2%	0.017	49%	0.485	C	S	.	.	H	α-helix	trans	-58.1	-44.3	174.8	0	0	0	0	0	112.3	L284 T286 A292 V293 V298 L299 Q300	L284-A296 HydrophobicContact CD1-CB 4.46Å; L284-A296 HydrophobicContact CD2-CB 3.95Å; T286-A296 HydrophobicContact CG2-CB 3.79Å; A292-A296 PolarHBondContact O-N 2.92Å; V293-A296 PolarHBondContact O-N 3.36Å; A296-V298 VanDerWaalsContact C-N 3.31Å; A296-V298 PolarHBondContact O-N 3.33Å; A296-L299 PolarHBondContact O-N 2.84Å; A296-Q300 VanDerWaalsContact O-CB 3.26Å; A296-Q300 WeakPolarHBondContact O-CB 3.27Å; A296-Q300 PolarHBondContact O-N 3Å
297	N	77.9	Confident	73.6	Confident	73 Å²	73	81.2 Å²	81.2	39%	0.39	51%	0.51	S	S	.	.	H	α-helix	trans	-65.4	-31.1	177	-77.1	-66.6	0	0	0	113.1	V293 A294 L295 K301	V293-N297 PolarHBondContact O-N 3.22Å; V293-N297 VanDerWaalsContact O-N 3.08Å; V293-N297 PolarHBondContact O-ND2 2.9Å; A294-N297 PolarHBondContact O-N 3.39Å; L295-N297 VanDerWaalsContact C-N 3.33Å; L295-N297 PolarHBondContact O-N 3.44Å; N297-K301 WeakPolarHBondContact O-CD 3.39Å; N297-K301 VanDerWaalsContact O-CG 3.28Å; N297-K301 WeakPolarHBondContact O-CG 3.08Å; N297-K301 PolarHBondContact O-N 3.05Å
298	V	82.8	Confident	72.5	Confident	93 Å²	93	80.6 Å²	80.6	56%	0.564	50%	0.496	S	S	*	.	H	α-helix	trans	-72.6	-47	173.4	171.7	0	0	0	0	110.8	A294 L295 A296 K301 A302	A294-V298 WeakPolarHBondContact O-CG2 3.47Å; A294-V298 PolarHBondContact O-N 2.57Å; A294-V298 VanDerWaalsContact O-N 3.09Å; L295-V298 PolarHBondContact O-N 2.93Å; L295-V298 VanDerWaalsContact O-N 3.16Å; A296-V298 VanDerWaalsContact C-N 3.31Å; A296-V298 PolarHBondContact O-N 3.33Å; V298-K301 PolarHBondContact O-N 3.09Å; V298-A302 PolarHBondContact O-N 3.27Å
299	L	79.3	Confident	71.4	Confident	47 Å²	47	81 Å²	81	25%	0.246	48%	0.482	C	S	.	.	H	α-helix	trans	-61.5	-44.7	177.5	-69.3	171.7	0	0	0	111.5	L284 L295 A296 K301 A302 F303	L284-L299 HydrophobicContact CD1-CB 3.68Å; L284-L299 HydrophobicContact CD1-CD1 3.99Å; L295-L299 HydrophobicContact CD1-CD1 4.31Å; L295-L299 HydrophobicContact CD1-CG 4.25Å; L295-L299 HydrophobicContact CG-CD1 4.01Å; L295-L299 HydrophobicContact CG-CG 4.4Å; L295-L299 WeakPolarHBondContact O-CG 3.36Å; L295-L299 PolarHBondContact O-N 3.23Å; A296-L299 PolarHBondContact O-N 2.84Å; L299-K301 VanDerWaalsContact C-N 3.27Å; L299-K301 PolarHBondContact O-N 3.22Å; L299-A302 PolarHBondContact O-N 3.45Å; L299-A302 VanDerWaalsContact O-N 3.09Å; L299-F303 HydrophobicContact CB-CD2 4.26Å; L299-F303 HydrophobicContact CB-CE2 4.24Å; L299-F303 HydrophobicContact CD2-CE2 4.18Å; L299-F303 WeakPolarHBondContact O-CD2 3.11Å; L299-F303 PolarHBondContact O-N 3.46Å
300	Q	77.5	Confident	70	Confident	62 Å²	62	77.6 Å²	77.6	29%	0.29	47%	0.469	S	S	.	.	H	α-helix	trans	-58.6	-36.7	176.4	-173.1	175	27.3	0	0	112.6	A296 M308	A296-Q300 VanDerWaalsContact O-CB 3.26Å; A296-Q300 WeakPolarHBondContact O-CB 3.27Å; A296-Q300 PolarHBondContact O-N 3Å; Q300-M308 HydrophobicContact CG-CB 3.75Å; Q300-M308 HydrophobicContact CG-CG 4.43Å; Q300-M308 PolarHBondContact NE2-O 2.8Å
301	K	77.2	Confident	68.6	Low	172 Å²	172	70.7 Å²	70.7	75%	0.748	44%	0.439	S	S	*	.	H	α-helix	trans	-73.8	-34.2	174.4	-72.6	171.5	-176.8	176.8	0	112.9	N297 V298 L299	N297-K301 WeakPolarHBondContact O-CD 3.39Å; N297-K301 VanDerWaalsContact O-CG 3.28Å; N297-K301 WeakPolarHBondContact O-CG 3.08Å; N297-K301 PolarHBondContact O-N 3.05Å; V298-K301 PolarHBondContact O-N 3.09Å; L299-K301 VanDerWaalsContact C-N 3.27Å; L299-K301 PolarHBondContact O-N 3.22Å
302	A	76.7	Confident	66.9	Low	80 Å²	80	70.4 Å²	70.4	66%	0.661	44%	0.436	S	S	*	.	H	α-helix	trans	-70.8	-37.5	176.5	0	0	0	0	0	112.2	V298 L299 G304	V298-A302 PolarHBondContact O-N 3.27Å; L299-A302 PolarHBondContact O-N 3.45Å; L299-A302 VanDerWaalsContact O-N 3.09Å; A302-G304 PolarHBondContact O-N 2.77Å; A302-G304 VanDerWaalsContact O-N 3.15Å
303	F	70.4	Confident	65.2	Low	108 Å²	108	72.5 Å²	72.5	47%	0.474	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	34.1	176.5	-68.6	-59.5	0	0	0	113.6	L299 A305 L306 M308	L299-F303 HydrophobicContact CB-CD2 4.26Å; L299-F303 HydrophobicContact CB-CE2 4.24Å; L299-F303 HydrophobicContact CD2-CE2 4.18Å; L299-F303 WeakPolarHBondContact O-CD2 3.11Å; L299-F303 PolarHBondContact O-N 3.46Å; F303-A305 PolarHBondContact O-N 3.42Å; F303-L306 HydrophobicContact CB-CD1 4.27Å; F303-L306 HydrophobicContact CD1-CD1 4.39Å; F303-L306 HydrophobicContact CG-CD1 4.49Å; F303-L306 PolarHBondContact O-N 2.84Å; F303-M308 HydrophobicContact CB-CG 4.34Å; F303-M308 HydrophobicContact CB-SD 4.5Å
304	G	56.9	Low	63.6	Low	71 Å²	71	73.5 Å²	73.5	73%	0.732	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	23.5	-167.9	0	0	0	0	0	118.4	A302	A302-G304 PolarHBondContact O-N 2.77Å; A302-G304 VanDerWaalsContact O-N 3.15Å
305	A	53.8	Low	61.6	Low	106 Å²	106	75.4 Å²	75.4	88%	0.876	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.3	2.4	170	0	0	0	0	0	113.2	F303	F303-A305 PolarHBondContact O-N 3.42Å
306	L	57.8	Low	59.5	Low	63 Å²	63	80.8 Å²	80.8	33%	0.33	51%	0.507	S	S	.	.	S	Bend	trans	-102.2	143.1	173.8	-73.6	171.3	0	0	0	110.6	S279 F303 M308	S279-L306 WeakPolarHBondContact O-CD2 3.31Å; F303-L306 HydrophobicContact CB-CD1 4.27Å; F303-L306 HydrophobicContact CD1-CD1 4.39Å; F303-L306 HydrophobicContact CG-CD1 4.49Å; F303-L306 PolarHBondContact O-N 2.84Å; L306-M308 VanDerWaalsContact C-N 3.3Å; L306-M308 HydrophobicContact CB-CG 3.82Å; L306-M308 HydrophobicContact CB-SD 3.92Å; L306-M308 HydrophobicContact CD1-SD 4.17Å; L306-M308 PolarHBondContact O-N 2.87Å
307	D	54.6	Low	57.6	Low	120 Å²	120	84.4 Å²	84.4	64%	0.642	53%	0.526	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.5	89.6	166.7	-86.1	-31.7	0	0	0	109.2	Q280 S281 A282	Q280-D307 PolarHBondContact O-N 3.44Å; S281-D307 WeakPolarHBondContact CA-O 3.5Å; S281-D307 WeakPolarHBondContact CB-O 3.44Å; A282-D307 PolarHBondContact N-O 3.42Å
308	M	51.3	Low	55.4	Low	28 Å²	28	85.5 Å²	85.5	14%	0.138	54%	0.539	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	118	-174	-71.2	-62.5	-54.8	0	0	111.8	A282 L284 Q300 F303 L306	A282-M308 HydrophobicContact CB-CE 4.42Å; A282-M308 HydrophobicContact CB-SD 3.77Å; A282-M308 WeakPolarHBondContact O-CA 3.41Å; L284-M308 HydrophobicContact CB-CE 3.84Å; L284-M308 HydrophobicContact CD1-CE 4.06Å; L284-M308 HydrophobicContact CG-CE 4.39Å; Q300-M308 HydrophobicContact CG-CB 3.75Å; Q300-M308 HydrophobicContact CG-CG 4.43Å; Q300-M308 PolarHBondContact NE2-O 2.8Å; F303-M308 HydrophobicContact CB-CG 4.34Å; F303-M308 HydrophobicContact CB-SD 4.5Å; L306-M308 VanDerWaalsContact C-N 3.3Å; L306-M308 HydrophobicContact CB-CG 3.82Å; L306-M308 HydrophobicContact CB-SD 3.92Å; L306-M308 HydrophobicContact CD1-SD 4.17Å; L306-M308 PolarHBondContact O-N 2.87Å
309	V	51.7	Low	53.2	Low	87 Å²	87	88.7 Å²	88.7	53%	0.527	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.4	127.7	172.7	-175.8	0	0	0	0	110.1	A282 C283 L284 T311	A282-V309 PolarHBondContact O-N 2.96Å; C283-V309 VanDerWaalsContact CA-O 3.31Å; C283-V309 WeakPolarHBondContact CA-O 3.47Å; C283-V309 PolarHBondContact SG-O 2.94Å; L284-V309 PolarHBondContact N-O 2.75Å; V309-T311 HydrophobicContact CG1-CG2 4.27Å
310	S	52.4	Low	51	Low	52 Å²	52	90.6 Å²	90.6	36%	0.364	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.4	137.2	174.2	-175.9	0	0	0	0	110.7
311	T	48.6	Very low	48.9	Very low	27 Å²	27	92.2 Å²	92.2	17%	0.166	58%	0.579	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-141.5	135	177.8	57.6	0	0	0	0	111.1	V309 L317	V309-T311 HydrophobicContact CG1-CG2 4.27Å; T311-L317 HydrophobicContact CG2-CD1 4.18Å; T311-L317 HydrophobicContact CG2-CD2 4.3Å
312	A	43.4	Very low	47	Very low	61 Å²	61	86.3 Å²	86.3	50%	0.504	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.2	146.6	173.8	0	0	0	0	0	111.8	G314	A312-G314 PolarHBondContact O-N 2.89Å; A312-G314 VanDerWaalsContact O-N 3.09Å
313	A	41.7	Very low	45.1	Very low	75 Å²	75	84.7 Å²	84.7	62%	0.62	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	112	176	0	0	0	0	0	112	T286	T286-A313 PolarHBondContact O-N 2.77Å; T286-A313 VanDerWaalsContact O-N 3.12Å
314	G	42.1	Very low	43.4	Very low	78 Å²	78	85.1 Å²	85.1	80%	0.804	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	149.1	-28.8	-180	0	0	0	0	0	113.8	A312	A312-G314 PolarHBondContact O-N 2.89Å; A312-G314 VanDerWaalsContact O-N 3.09Å
315	C	38	Very low	42.3	Very low	94 Å²	94	89.1 Å²	89.1	64%	0.635	54%	0.542	S	S	*	.			trans	-75.8	133.1	175.6	-66.8	0	0	0	0	112.2	L317	C315-L317 HydrophobicContact CB-CD1 4.45Å; C315-L317 PolarHBondContact O-N 2.66Å
316	Q	34.9	Very low	41.2	Very low	198 Å²	198	89.8 Å²	89.8	93%	0.925	53%	0.531	S	S	*	.			trans	-76	98.3	167	-71.6	-178.5	-26.6	0	0	109.8
317	L	39.8	Very low	40.1	Very low	78 Å²	78	92 Å²	92	41%	0.408	55%	0.547	S	S	.	.			trans	-75.8	132.8	167.7	-74.7	90	0	0	0	110.2	T311 C315 I319	T311-L317 HydrophobicContact CG2-CD1 4.18Å; T311-L317 HydrophobicContact CG2-CD2 4.3Å; C315-L317 HydrophobicContact CB-CD1 4.45Å; C315-L317 PolarHBondContact O-N 2.66Å; L317-I319 PolarHBondContact O-N 3.41Å
318	S	32.4	Very low	38.9	Very low	96 Å²	96	92.4 Å²	92.4	67%	0.671	55%	0.548	S	S	*	.			trans	-68.2	112.2	166.5	-173.6	0	0	0	0	109.2	T320	S318-T320 VanDerWaalsContact C-N 3.3Å; S318-T320 PolarHBondContact O-N 2.85Å; S318-T320 PolarHBondContact OG-OG1 2.9Å
319	I	37.7	Very low	37.9	Very low	159 Å²	159	96.4 Å²	96.4	82%	0.815	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	87	178	-54.2	175.6	0	0	0	108.5	L317	L317-I319 PolarHBondContact O-N 3.41Å
320	T	32.5	Very low	36.8	Very low	88 Å²	88	96.6 Å²	96.6	54%	0.54	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-143.9	-23.6	-177.4	-33.4	0	0	0	0	113.4	S318	S318-T320 VanDerWaalsContact C-N 3.3Å; S318-T320 PolarHBondContact O-N 2.85Å; S318-T320 PolarHBondContact OG-OG1 2.9Å
321	T	34.1	Very low	35.7	Very low	95 Å²	95	101.7 Å²	101.7	58%	0.583	59%	0.594	S	S	*	*	S	Bend	trans	-145.3	46.5	177.8	-34.5	0	0	0	0	111.9
322	V	36.4	Very low	34.9	Very low	48 Å²	48	111.7 Å²	111.7	29%	0.291	65%	0.645	S	S	.	*			trans	-126.9	107.5	171.6	-177.2	0	0	0	0	109.7	C283 M324	C283-V322 HydrophobicContact CB-CG1 3.83Å; C283-V322 HydrophobicContact CB-CG2 4.23Å; V322-M324 HydrophobicContact CG1-CG 4.32Å; V322-M324 PolarHBondContact O-N 3.46Å; V322-M324 VanDerWaalsContact O-N 3.12Å
323	T	35.9	Very low	34.5	Very low	46 Å²	46	114.2 Å²	114.2	28%	0.282	65%	0.652	S	S	.	*			trans	-71.7	100.5	165	-57.8	0	0	0	0	107.8	L278 F325	L278-T323 WeakPolarHBondContact O-CB 3.15Å; L278-T323 PolarHBondContact O-OG1 3.09Å; T323-F325 VanDerWaalsContact C-N 3.3Å; T323-F325 HydrophobicContact CG2-CD2 4.45Å; T323-F325 PolarHBondContact O-N 3.39Å
324	M	35	Very low	34.1	Very low	118 Å²	118	116.3 Å²	116.3	58%	0.581	65%	0.654	S	S	*	*			trans	-68.7	82.6	-178.3	-77.3	-88.3	-76	0	0	111.5	V322 N326	V322-M324 HydrophobicContact CG1-CG 4.32Å; V322-M324 PolarHBondContact O-N 3.46Å; V322-M324 VanDerWaalsContact O-N 3.12Å; M324-N326 VanDerWaalsContact C-N 3.27Å; M324-N326 VanDerWaalsContact CE-OD1 3.3Å; M324-N326 WeakPolarHBondContact CE-OD1 3.11Å; M324-N326 PolarHBondContact O-N 3.06Å
325	F	34.8	Very low	33.7	Very low	154 Å²	154	118.4 Å²	118.4	68%	0.675	65%	0.646	S	S	*	*			trans	-66.7	92.6	153.7	-94.4	-83.6	0	0	0	108.2	T323 V327	T323-F325 VanDerWaalsContact C-N 3.3Å; T323-F325 HydrophobicContact CG2-CD2 4.45Å; T323-F325 PolarHBondContact O-N 3.39Å; F325-V327 PolarHBondContact O-N 3.05Å
326	N	30.3	Very low	33.4	Very low	121 Å²	121	119.8 Å²	119.8	65%	0.647	65%	0.646	S	S	*	*			trans	-68	75.3	175.2	-97.6	-11.7	0	0	0	111.1	M324 L328	M324-N326 VanDerWaalsContact C-N 3.27Å; M324-N326 VanDerWaalsContact CE-OD1 3.3Å; M324-N326 WeakPolarHBondContact CE-OD1 3.11Å; M324-N326 PolarHBondContact O-N 3.06Å; N326-L328 PolarHBondContact O-N 3.16Å
327	V	34.3	Very low	33.3	Very low	110 Å²	110	114.9 Å²	114.9	67%	0.667	63%	0.629	S	S	*	*			trans	-79.5	77.2	162.8	-175.9	0	0	0	0	107.4	F325 L329	F325-V327 PolarHBondContact O-N 3.05Å; V327-L329 VanDerWaalsContact C-N 3.29Å; V327-L329 HydrophobicContact CG1-CD1 4.32Å; V327-L329 HydrophobicContact CG1-CG 4.22Å; V327-L329 PolarHBondContact O-N 3.37Å
328	L	29.2	Very low	32.9	Very low	128 Å²	128	117.4 Å²	117.4	67%	0.67	64%	0.644	S	S	*	*			trans	-75.8	78.7	-176	-163.1	81.6	0	0	0	110.7	N326 T330	N326-L328 PolarHBondContact O-N 3.16Å; L328-T330 HydrophobicContact CD1-CG2 4.44Å; L328-T330 HydrophobicContact CD2-CG2 4.25Å; L328-T330 HydrophobicContact CG-CG2 3.99Å; L328-T330 PolarHBondContact O-N 2.61Å
329	L	31.6	Very low	32.9	Very low	111 Å²	111	118.9 Å²	118.9	58%	0.581	64%	0.642	S	S	*	*			trans	-74.5	63.8	171.7	-79.2	167.6	0	0	0	111.3	L295 V327	L295-L329 HydrophobicContact CD2-CD1 4.08Å; V327-L329 VanDerWaalsContact C-N 3.29Å; V327-L329 HydrophobicContact CG1-CD1 4.32Å; V327-L329 HydrophobicContact CG1-CG 4.22Å; V327-L329 PolarHBondContact O-N 3.37Å
330	T	27.6	Very low	32.5	Very low	92 Å²	92	115.8 Å²	115.8	56%	0.564	63%	0.628	S	S	*	*			trans	-88.2	122.8	164.4	45.7	0	0	0	0	109.6	L328	L328-T330 HydrophobicContact CD1-CG2 4.44Å; L328-T330 HydrophobicContact CD2-CG2 4.25Å; L328-T330 HydrophobicContact CG-CG2 3.99Å; L328-T330 PolarHBondContact O-N 2.61Å
331	N	29.9	Very low	32.5	Very low	159 Å²	159	118.2 Å²	118.2	85%	0.85	64%	0.636	S	S	*	*			trans	74.4	75.5	176.2	-51	-24.1	0	0	0	116.1
332	L	31.2	Very low	32.4	Very low	236 Å²	236	120.3 Å²	120.3	100%	1.236	64%	0.64	S	S	*	*			trans	-129.3	0	137.5	-77.4	177.3	0	0	0	108.2

Retrieved 332 of 332 residues in 992.7 ms (Link to these results)

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