A0A3B3UBT7_9TELE Loading...

Tocopherol (alpha) transfer protein-like

AlphaFold DB , UniProt , Accession A0A3B3UBT7, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 345 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.8	Very low	34.6	Very low	257 Å²	257	144.7 Å²	144.7	100%	1.266	82%	0.821	S	S	*	*				0	107.1	0	-84.3	171.7	158.5	0	0	106.1
2	A	34.2	Very low	34.5	Very low	97 Å²	97	142.5 Å²	142.5	80%	0.802	82%	0.817	S	S	*	*			trans	-128.8	117.6	-173.8	0	0	0	0	0	109.3
3	D	35.8	Very low	34.6	Very low	137 Å²	137	141.2 Å²	141.2	73%	0.733	82%	0.816	S	S	*	*				61.9	133.7	127.3	-97.1	2	0	0	0	125.3
4	Q	34.5	Very low	34.5	Very low	146 Å²	146	145.4 Å²	145.4	68%	0.682	83%	0.825	S	S	*	*			trans	85.9	113.1	136.4	-69.6	170.1	40	0	0	121.9
5	H	34.3	Very low	34.4	Very low	152 Å²	152	141.3 Å²	141.3	70%	0.704	82%	0.816	S	S	*	*				162.2	113.7	108.1	-101.1	-84.6	0	0	0	108.6
6	E	35.6	Very low	34.5	Very low	159 Å²	159	142.8 Å²	142.8	74%	0.743	82%	0.82	S	S	*	*				78.3	114.6	84.7	-134.1	-175.3	-176.1	0	0	114.8
7	S	31.4	Very low	34.4	Very low	120 Å²	120	144.8 Å²	144.8	84%	0.839	82%	0.82	S	S	*	*			trans	-151.5	120.8	155.7	64.8	0	0	0	0	110.2
8	V	37.2	Very low	34.2	Very low	124 Å²	124	142.4 Å²	142.4	75%	0.752	82%	0.822	S	S	*	*			trans	-78.8	145.2	178.1	174.7	0	0	0	0	110.9
9	S	30.5	Very low	34.1	Very low	119 Å²	119	142 Å²	142	83%	0.832	82%	0.822	S	S	*	*			trans	-152.9	138.9	150.4	-174.4	0	0	0	0	111.9
10	L	33.1	Very low	34	Very low	162 Å²	162	140 Å²	140	85%	0.848	82%	0.822	S	S	*	*			trans	-81.5	145.6	-164.8	-71.6	138.7	0	0	0	113.7
11	S	34.7	Very low	34	Very low	119 Å²	119	137.7 Å²	137.7	83%	0.832	82%	0.82	S	S	*	*			trans	-73.6	155.4	178.5	-41.2	0	0	0	0	114.6
12	P	33.1	Very low	33.6	Very low	118 Å²	118	129 Å²	129	77%	0.766	80%	0.795	S	S	*	*			trans	-111.2	166.9	147.3	9.9	12.1	0	0	0	112.5
13	P	36	Very low	33.6	Very low	125 Å²	125	133.3 Å²	133.3	81%	0.812	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-85.1	150.7	-157.5	33.3	-33.9	0	0	0	114.4
14	Q	33.2	Very low	33.5	Very low	201 Å²	201	131.3 Å²	131.3	94%	0.939	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-68.3	127.7	174.2	-78.6	174.3	-37.8	0	0	111.2
15	A	32.3	Very low	33.6	Very low	84 Å²	84	136 Å²	136	69%	0.694	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-100.6	130.2	167.3	0	0	0	0	0	109.5	H17	A15-H17 PolarHBondContact O-N 3.46Å
16	D	36.1	Very low	33.6	Very low	164 Å²	164	137 Å²	137	88%	0.877	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-58.5	124.1	176.6	-72.9	-47.4	0	0	0	112.2
17	H	33	Very low	33.9	Very low	177 Å²	177	135.1 Å²	135.1	82%	0.819	81%	0.811	S	S	*	*			trans	-112.2	92.3	160.9	-82.7	-60	0	0	0	109.4	A15 T19	A15-H17 PolarHBondContact O-N 3.46Å; H17-T19 PolarHBondContact O-N 3.21Å
18	A	30.8	Very low	34.6	Very low	103 Å²	103	132.1 Å²	132.1	85%	0.851	80%	0.799	S	S	*	*			trans	-63.9	108.1	160	0	0	0	0	0	108.9	A20	A18-A20 PolarHBondContact O-N 3.39Å
19	T	32.7	Very low	34.8	Very low	134 Å²	134	132.2 Å²	132.2	82%	0.822	80%	0.802	S	S	*	*			trans	-77.9	111	166.9	43.2	0	0	0	0	109.2	H17 A21	H17-T19 PolarHBondContact O-N 3.21Å; T19-A21 PolarHBondContact O-N 3.15Å; T19-A21 VanDerWaalsContact O-N 3.15Å
20	A	31.8	Very low	35.8	Very low	101 Å²	101	131.9 Å²	131.9	84%	0.835	80%	0.798	S	S	*	*			trans	-56.6	110.4	169.5	0	0	0	0	0	110.4	A18 G22	A18-A20 PolarHBondContact O-N 3.39Å; A20-G22 PolarHBondContact O-N 3.33Å
21	A	34.8	Very low	36.9	Very low	93 Å²	93	128 Å²	128	77%	0.769	78%	0.782	S	S	*	*			trans	-74.6	111.3	166	0	0	0	0	0	107.9	T19 H23	T19-A21 PolarHBondContact O-N 3.15Å; T19-A21 VanDerWaalsContact O-N 3.15Å; A21-H23 PolarHBondContact O-N 2.96Å
22	G	30.1	Very low	37.9	Very low	73 Å²	73	128.3 Å²	128.3	75%	0.753	78%	0.781	S	S	*	*			trans	-56.7	127.3	175.8	0	0	0	0	0	111	A20 S24	A20-G22 PolarHBondContact O-N 3.33Å; G22-S24 PolarHBondContact O-N 3.33Å
23	H	35.2	Very low	39.8	Very low	189 Å²	189	130.7 Å²	130.7	88%	0.875	78%	0.784	S	S	*	*			trans	-60	99.4	165.5	-68	-73	0	0	0	108.9	A21 W25	A21-H23 PolarHBondContact O-N 2.96Å; H23-W25 PolarHBondContact O-N 3Å; H23-W25 VanDerWaalsContact O-N 3.12Å
24	S	32.3	Very low	42.2	Very low	94 Å²	94	126.6 Å²	126.6	66%	0.657	75%	0.753	S	S	*	*			trans	-68	108.3	167	62.8	0	0	0	0	108	G22 F26	G22-S24 PolarHBondContact O-N 3.33Å; S24-F26 PolarHBondContact O-N 3.12Å
25	W	38.1	Very low	44.8	Very low	245 Å²	245	121.5 Å²	121.5	93%	0.928	74%	0.739	S	S	*	*			trans	-64.5	5.8	175.3	-174.9	-92.3	0	0	0	113.9	H23	H23-W25 PolarHBondContact O-N 3Å; H23-W25 VanDerWaalsContact O-N 3.12Å
26	F	33	Very low	47.7	Very low	173 Å²	173	119.3 Å²	119.3	76%	0.759	72%	0.718	S	S	*	*	S	Bend	trans	-76.8	127.1	178.2	-66.5	-73.8	0	0	0	109	S24 G28	S24-F26 PolarHBondContact O-N 3.12Å; F26-G28 PolarHBondContact O-N 3.27Å
27	P	42.1	Very low	50.5	Low	119 Å²	119	115.5 Å²	115.5	77%	0.773	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-53.4	134.7	167.5	23.2	-30.3	0	0	0	107.1
28	G	47.3	Very low	53.6	Low	57 Å²	57	107.8 Å²	107.8	59%	0.588	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-49.6	158.1	172.3	0	0	0	0	0	110.3	F26	F26-G28 PolarHBondContact O-N 3.27Å
29	P	41.3	Very low	56.8	Low	126 Å²	126	105.7 Å²	105.7	82%	0.818	64%	0.643	S	S	*	*	S	Bend	trans	-47.6	135.9	177.7	20.1	-31	0	0	0	109.3
30	P	51.7	Low	59.9	Low	113 Å²	113	104.1 Å²	104.1	73%	0.734	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-51.3	143.6	-179.9	21.1	-31.7	0	0	0	108.6
31	P	55.9	Low	63	Low	80 Å²	80	105.7 Å²	105.7	52%	0.519	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-49.7	139.3	179.6	19.9	-30.9	0	0	0	108.6	M33 Y343	P31-M33 PolarHBondContact O-N 3.12Å; P31-Y343 HydrophobicContact CG-CD1 4.09Å; P31-Y343 HydrophobicContact CG-CE1 3.74Å
32	P	54.8	Low	66	Low	125 Å²	125	102.3 Å²	102.3	81%	0.812	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-52	124.6	-172.6	19.3	-30.6	0	0	0	108.7	Y34	P32-Y34 PolarHBondContact O-N 3.06Å
33	M	73.6	Confident	69.3	Low	168 Å²	168	100.4 Å²	100.4	83%	0.828	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-47	131.8	170.8	-73.7	-179.5	62.3	0	0	107.7	P31 S35	P31-M33 PolarHBondContact O-N 3.12Å; M33-S35 PolarHBondContact O-N 3.24Å; M33-S35 VanDerWaalsContact O-N 3.12Å
34	Y	86.1	Confident	72.3	Confident	40 Å²	40	94.2 Å²	94.2	16%	0.157	55%	0.549	C	S	.	.	P	Polyproline II helix	trans	-48.2	125	-177.1	164.2	-90.8	0	0	0	110.9	P32 C36 R57 L58 D81 A82 L85 R89 E179	P32-Y34 PolarHBondContact O-N 3.06Å; Y34-C36 HydrophobicContact CE1-CB 3.92Å; Y34-C36 WeakPolarHBondContact OH-CA 3.1Å; Y34-C36 WeakPolarHBondContact OH-CB 3.43Å; Y34-R57 VanDerWaalsContact CE1-CD 3.41Å; Y34-L58 HydrophobicContact CD1-CD2 3.79Å; Y34-L58 HydrophobicContact CG-CD2 4.39Å; Y34-D81 WeakPolarHBondContact CB-OD2 3.37Å; Y34-D81 HydrophobicContact CD2-CB 4.26Å; Y34-D81 HydrophobicContact CG-CB 3.95Å; Y34-A82 HydrophobicContact CD2-CB 4.37Å; Y34-L85 HydrophobicContact CD1-CD1 4.3Å; Y34-L85 HydrophobicContact CD2-CD1 3.92Å; Y34-L85 HydrophobicContact CE1-CD1 3.78Å; Y34-L85 HydrophobicContact CE2-CD1 3.36Å; Y34-L85 HydrophobicContact CG-CD1 4.36Å; Y34-R89 PolarHBondContact OH-NH2 3.27Å; Y34-E179 WeakPolarHBondContact CE2-OE1 3.39Å; Y34-E179 VanDerWaalsContact OH-CD 3.29Å; Y34-E179 PolarHBondContact OH-OE1 3.21Å; Y34-E179 PolarHBondContact OH-OE2 2.89Å
35	S	88.6	Confident	75.4	Confident	93 Å²	93	91.9 Å²	91.9	65%	0.65	53%	0.527	S	S	*	.			trans	-114.8	118.5	175.1	-173.7	0	0	0	0	108.4	M33 T37	M33-S35 PolarHBondContact O-N 3.24Å; M33-S35 VanDerWaalsContact O-N 3.12Å; S35-T37 PolarHBondContact O-N 3.15Å
36	C	92.4	Very high	78.3	Confident	39 Å²	39	80.2 Å²	80.2	26%	0.264	48%	0.482	S	S	.	.			trans	-65	121.9	178.9	177.1	0	0	0	0	110	Y34	Y34-C36 HydrophobicContact CE1-CB 3.92Å; Y34-C36 WeakPolarHBondContact OH-CA 3.1Å; Y34-C36 WeakPolarHBondContact OH-CB 3.43Å
37	T	95.6	Very high	81.4	Confident	84 Å²	84	77 Å²	77	52%	0.515	47%	0.465	S	S	.	.			trans	-90.2	-8.6	-179	51.3	0	0	0	0	113.6	S35 E179	S35-T37 PolarHBondContact O-N 3.15Å; T37-E179 PolarHBondContact N-OE1 3.22Å; T37-E179 WeakPolarHBondContact OG1-CB 3.3Å; T37-E179 VanDerWaalsContact OG1-CG 3.23Å; T37-E179 WeakPolarHBondContact OG1-CG 3.33Å; T37-E179 PolarHBondContact OG1-OE1 3.38Å
38	L	96.9	Very high	84	Confident	14 Å²	14	79.2 Å²	79.2	7%	0.073	47%	0.465	C	S	.	.			trans	-63.1	137.3	-179.8	-61.3	178.9	0	0	0	112.8	L42 V43 A46 E179 E180 V183	L38-L42 HydrophobicContact CB-CB 4.1Å; L38-L42 HydrophobicContact CD2-CB 4.05Å; L38-L42 HydrophobicContact CD2-CD1 4.15Å; L38-V43 HydrophobicContact CB-CG2 3.79Å; L38-V43 HydrophobicContact CD1-CG2 4.44Å; L38-A46 HydrophobicContact CD1-CB 4.4Å; L38-E179 HydrophobicContact CD2-CB 3.54Å; L38-E179 HydrophobicContact CG-CB 4.01Å; L38-E180 HydrophobicContact CD2-CG 4.37Å; L38-V183 HydrophobicContact CD1-CG2 3.75Å; L38-V183 HydrophobicContact CD2-CG2 3.84Å; L38-V183 HydrophobicContact CG-CG2 4.47Å
39	T	97.6	Very high	86.4	Confident	60 Å²	60	79.3 Å²	79.3	37%	0.368	45%	0.451	S	S	.	.			trans	-66.1	161.4	168.9	79	0	0	0	0	111.4	E41 L42 V43	T39-E41 VanDerWaalsContact CB-OE2 3.27Å; T39-E41 WeakPolarHBondContact CB-OE2 3.41Å; T39-E41 PolarHBondContact O-N 3.32Å; T39-E41 PolarHBondContact OG1-OE2 3.04Å; T39-L42 PolarHBondContact O-N 3.17Å; T39-L42 PolarHBondContact OG1-N 3.47Å; T39-V43 WeakPolarHBondContact O-CG2 3.35Å; T39-V43 PolarHBondContact O-N 3.36Å
40	P	97.8	Very high	89.1	Confident	100 Å²	100	73.3 Å²	73.3	65%	0.649	41%	0.412	S	S	*	.	H	α-helix	trans	-53.9	-37.8	176.8	-27.7	36.8	0	0	0	114	V43 A44	P40-V43 PolarHBondContact O-N 2.87Å; P40-A44 PolarHBondContact O-N 3.07Å
41	E	97.8	Very high	91.3	Very high	134 Å²	134	74.1 Å²	74.1	63%	0.626	41%	0.406	S	S	*	.	H	α-helix	trans	-65.9	-42.3	177.9	-57.5	71.3	-152.7	0	0	111.1	T39 A44 K45	T39-E41 VanDerWaalsContact CB-OE2 3.27Å; T39-E41 WeakPolarHBondContact CB-OE2 3.41Å; T39-E41 PolarHBondContact O-N 3.32Å; T39-E41 PolarHBondContact OG1-OE2 3.04Å; E41-A44 PolarHBondContact O-N 2.98Å; E41-K45 WeakPolarHBondContact O-CB 3.48Å; E41-K45 PolarHBondContact O-N 3.22Å
42	L	98.1	Very high	93.3	Very high	22 Å²	22	70.4 Å²	70.4	12%	0.115	38%	0.381	C	S	.	.	H	α-helix	trans	-72.2	-31.4	177.2	-69.3	178	0	0	0	112.4	L38 T39 K45 A46 E180 V183 N184	L38-L42 HydrophobicContact CB-CB 4.1Å; L38-L42 HydrophobicContact CD2-CB 4.05Å; L38-L42 HydrophobicContact CD2-CD1 4.15Å; T39-L42 PolarHBondContact O-N 3.17Å; T39-L42 PolarHBondContact OG1-N 3.47Å; L42-K45 HydrophobicContact CD2-CD 4.28Å; L42-K45 PolarHBondContact O-N 3.03Å; L42-A46 VanDerWaalsContact O-CB 3.25Å; L42-A46 WeakPolarHBondContact O-CB 3.48Å; L42-A46 PolarHBondContact O-N 3.48Å; L42-E180 HydrophobicContact CD1-CB 3.79Å; L42-E180 HydrophobicContact CD1-CG 3.36Å; L42-V183 HydrophobicContact CD2-CG1 4.29Å; L42-N184 VanDerWaalsContact CD2-OD1 3.28Å; L42-N184 WeakPolarHBondContact CD2-OD1 3.47Å
43	V	98.3	Very high	95.3	Very high	34 Å²	34	67.9 Å²	67.9	21%	0.206	36%	0.357	C	S	.	.	H	α-helix	trans	-62.5	-45.4	170.1	168.1	0	0	0	0	110.8	L38 T39 P40 A46 R47 P54	L38-V43 HydrophobicContact CB-CG2 3.79Å; L38-V43 HydrophobicContact CD1-CG2 4.44Å; T39-V43 WeakPolarHBondContact O-CG2 3.35Å; T39-V43 PolarHBondContact O-N 3.36Å; P40-V43 PolarHBondContact O-N 2.87Å; V43-A46 PolarHBondContact O-N 3.43Å; V43-R47 PolarHBondContact O-N 2.95Å; V43-P54 HydrophobicContact CG1-CG 3.4Å; V43-P54 VanDerWaalsContact CG1-CG 3.4Å
44	A	98.2	Very high	96.3	Very high	58 Å²	58	61.9 Å²	61.9	48%	0.479	33%	0.331	S	S	.	.	H	α-helix	trans	-61.7	-46	176.1	0	0	0	0	0	111.4	P40 E41 A46 R47 E48	P40-A44 PolarHBondContact O-N 3.07Å; E41-A44 PolarHBondContact O-N 2.98Å; A44-A46 PolarHBondContact O-N 3.13Å; A44-R47 WeakPolarHBondContact O-CB 3.39Å; A44-R47 PolarHBondContact O-N 3.29Å; A44-E48 PolarHBondContact O-N 3.4Å
45	K	98.2	Very high	96.8	Very high	45 Å²	45	65.2 Å²	65.2	20%	0.196	35%	0.348	C	S	.	.	H	α-helix	trans	-60.8	-42.3	175.5	-175.9	177	-178.7	177.2	0	112.7	E41 L42 R47 E48 E49 N142 V183 N184	E41-K45 WeakPolarHBondContact O-CB 3.48Å; E41-K45 PolarHBondContact O-N 3.22Å; L42-K45 HydrophobicContact CD2-CD 4.28Å; L42-K45 PolarHBondContact O-N 3.03Å; K45-R47 VanDerWaalsContact C-N 3.34Å; K45-E48 PolarHBondContact O-N 3.23Å; K45-E49 WeakPolarHBondContact CE-OE1 3.24Å; K45-E49 HydrophobicContact CG-CG 4.22Å; K45-E49 WeakPolarHBondContact O-CB 3.27Å; K45-E49 PolarHBondContact O-N 3.12Å; K45-N142 PolarHBondContact NZ-O 3.43Å; K45-V183 HydrophobicContact CB-CG1 4.35Å; K45-V183 HydrophobicContact CD-CG1 4.14Å; K45-V183 HydrophobicContact CG-CG1 4.13Å; K45-N184 PolarHBondContact NZ-OD1 2.99Å
46	A	98.3	Very high	97.1	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.2	-40	177.1	0	0	0	0	0	111.4	L38 L42 V43 A44 E48 L50 Q51 E52 V183	L38-A46 HydrophobicContact CD1-CB 4.4Å; L42-A46 VanDerWaalsContact O-CB 3.25Å; L42-A46 WeakPolarHBondContact O-CB 3.48Å; L42-A46 PolarHBondContact O-N 3.48Å; V43-A46 PolarHBondContact O-N 3.43Å; A44-A46 PolarHBondContact O-N 3.13Å; A46-E48 PolarHBondContact O-N 3.31Å; A46-L50 HydrophobicContact CB-CD1 4.26Å; A46-L50 CarbonylContact O-C 3.58Å; A46-L50 VanDerWaalsContact O-CA 3.25Å; A46-L50 WeakPolarHBondContact O-CA 3.42Å; A46-L50 WeakPolarHBondContact O-CB 3.47Å; A46-L50 PolarHBondContact O-N 3.25Å; A46-Q51 PolarHBondContact O-N 3.19Å; A46-Q51 VanDerWaalsContact O-N 3.15Å; A46-E52 HydrophobicContact CB-CB 3.97Å; A46-E52 HydrophobicContact CB-CG 4.47Å; A46-E52 PolarHBondContact O-N 3.21Å; A46-V183 HydrophobicContact CB-CG1 4.1Å; A46-V183 HydrophobicContact CB-CG2 3.98Å
47	R	98.3	Very high	97.2	Very high	105 Å²	105	64.7 Å²	64.7	40%	0.396	33%	0.326	S	S	.	.	H	α-helix	trans	-60.2	-45.8	173.6	-173.6	-176.2	-72.7	-97	6.3	111.8	V43 A44 K45 Q51 E52 E55	V43-R47 PolarHBondContact O-N 2.95Å; A44-R47 WeakPolarHBondContact O-CB 3.39Å; A44-R47 PolarHBondContact O-N 3.29Å; K45-R47 VanDerWaalsContact C-N 3.34Å; R47-Q51 VanDerWaalsContact O-CA 3.32Å; R47-Q51 WeakPolarHBondContact O-CA 3.48Å; R47-Q51 PolarHBondContact O-N 2.66Å; R47-E52 WeakPolarHBondContact CA-O 3.46Å; R47-E52 WeakPolarHBondContact CB-O 3.11Å; R47-E55 IonicContact CZ-OE1 2.63Å; R47-E55 IonicContact CZ-OE2 2.72Å; R47-E55 IonicContact NH1-OE1 3.09Å; R47-E55 PolarHBondContact NH1-OE1 3.1Å; R47-E55 IonicContact NH1-OE2 2.96Å; R47-E55 VanDerWaalsContact NH2-CD 3.33Å; R47-E55 IonicContact NH2-OE1 3.56Å; R47-E55 PolarHBondContact NH2-OE1 3.22Å; R47-E55 VanDerWaalsContact NH2-OE1 3.1Å; R47-E55 IonicContact NH2-OE2 3.23Å; R47-E55 PolarHBondContact NH2-OE2 2.9Å
48	E	98.1	Very high	97.2	Very high	166 Å²	166	64.5 Å²	64.5	78%	0.776	32%	0.322	S	S	*	.	H	α-helix	trans	-73.5	-52	-177.6	-173.5	-179.1	178.8	0	0	112.8	A44 K45 A46	A44-E48 PolarHBondContact O-N 3.4Å; K45-E48 PolarHBondContact O-N 3.23Å; A46-E48 PolarHBondContact O-N 3.31Å
49	E	97.6	Very high	97.2	Very high	60 Å²	60	70.5 Å²	70.5	28%	0.28	34%	0.343	S	S	.	.	H	α-helix	trans	-82.9	-31.5	-172.9	-69.8	-165.5	-158.4	0	0	113.6	K45 K92 R222 K224	K45-E49 WeakPolarHBondContact CE-OE1 3.24Å; K45-E49 HydrophobicContact CG-CG 4.22Å; K45-E49 WeakPolarHBondContact O-CB 3.27Å; K45-E49 PolarHBondContact O-N 3.12Å; E49-K92 WeakPolarHBondContact O-CD 3.19Å; E49-K92 WeakPolarHBondContact O-CE 3.27Å; E49-R222 IonicContact OE2-CZ 3.28Å; E49-R222 IonicContact OE2-NH2 3.1Å; E49-R222 PolarHBondContact OE2-NH2 3.29Å; E49-K224 IonicContact OE2-NZ 2.76Å; E49-K224 PolarHBondContact OE2-NZ 3.04Å
50	L	97.9	Very high	97.2	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-117.1	-2.4	-169.7	-42.6	-178.2	0	0	0	113.4	A46 E52 R89 K92 F93 V183 R222	A46-L50 HydrophobicContact CB-CD1 4.26Å; A46-L50 CarbonylContact O-C 3.58Å; A46-L50 VanDerWaalsContact O-CA 3.25Å; A46-L50 WeakPolarHBondContact O-CA 3.42Å; A46-L50 WeakPolarHBondContact O-CB 3.47Å; A46-L50 PolarHBondContact O-N 3.25Å; L50-E52 PolarHBondContact O-N 3.37Å; L50-E52 VanDerWaalsContact O-N 3.15Å; L50-R89 HydrophobicContact CD1-CB 4.02Å; L50-R89 HydrophobicContact CD1-CG 4.1Å; L50-K92 HydrophobicContact CD2-CG 4.48Å; L50-K92 CarbonylContact O-C 3.52Å; L50-K92 WeakPolarHBondContact O-CA 3.37Å; L50-K92 WeakPolarHBondContact O-CB 3.44Å; L50-F93 WeakPolarHBondContact O-CD2 3.37Å; L50-V183 HydrophobicContact CD1-CB 4.47Å; L50-V183 HydrophobicContact CD1-CG1 4.5Å; L50-V183 HydrophobicContact CD1-CG2 4.14Å; L50-R222 VanDerWaalsContact CD2-CZ 3.43Å
51	Q	98	Very high	97.2	Very high	130 Å²	130	63.1 Å²	63.1	61%	0.607	30%	0.296	S	S	*	.			trans	60.6	20.6	-177.1	-51.5	-176.8	-31.4	0	0	113.3	A46 R47 K53 K92	A46-Q51 PolarHBondContact O-N 3.19Å; A46-Q51 VanDerWaalsContact O-N 3.15Å; R47-Q51 VanDerWaalsContact O-CA 3.32Å; R47-Q51 WeakPolarHBondContact O-CA 3.48Å; R47-Q51 PolarHBondContact O-N 2.66Å; Q51-K53 PolarHBondContact O-N 3.07Å; Q51-K92 PolarHBondContact OE1-O 2.75Å
52	E	97.8	Very high	97.2	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.005	28%	0.284	C	S	.	.			trans	-74	115.1	177.2	-177.2	168.2	160	0	0	110.3	A46 R47 L50 P54 R57 R89 F93	A46-E52 HydrophobicContact CB-CB 3.97Å; A46-E52 HydrophobicContact CB-CG 4.47Å; A46-E52 PolarHBondContact O-N 3.21Å; R47-E52 WeakPolarHBondContact CA-O 3.46Å; R47-E52 WeakPolarHBondContact CB-O 3.11Å; L50-E52 PolarHBondContact O-N 3.37Å; L50-E52 VanDerWaalsContact O-N 3.15Å; E52-P54 WeakPolarHBondContact O-CD 3.23Å; E52-R57 IonicContact OE1-CZ 2.66Å; E52-R57 IonicContact OE1-NE 2.72Å; E52-R57 PolarHBondContact OE1-NE 2.82Å; E52-R57 IonicContact OE1-NH2 3.6Å; E52-R57 PolarHBondContact OE1-NH2 2.73Å; E52-R89 IonicContact OE1-CZ 3.19Å; E52-R89 IonicContact OE1-NE 2.89Å; E52-R89 PolarHBondContact OE1-NE 2.97Å; E52-R89 IonicContact OE1-NH2 3.62Å; E52-R89 PolarHBondContact OE1-NH2 3.41Å; E52-R89 WeakPolarHBondContact OE2-CG 3.23Å; E52-R89 IonicContact OE2-CZ 3.23Å; E52-R89 IonicContact OE2-NE 2.82Å; E52-R89 PolarHBondContact OE2-NE 2.87Å; E52-R89 IonicContact OE2-NH2 3.98Å; E52-F93 HydrophobicContact CB-CD2 3.87Å; E52-F93 HydrophobicContact CB-CE2 3.34Å; E52-F93 HydrophobicContact CB-CZ 3.73Å; E52-F93 HydrophobicContact CG-CD2 4.43Å; E52-F93 HydrophobicContact CG-CE1 4.13Å; E52-F93 HydrophobicContact CG-CE2 3.53Å; E52-F93 HydrophobicContact CG-CZ 3.35Å; E52-F93 WeakPolarHBondContact OE2-CE2 3.49Å
53	K	96.4	Very high	97.2	Very high	72 Å²	72	60.9 Å²	60.9	31%	0.313	29%	0.29	S	S	.	.			trans	-101.3	112.2	172.9	-60.1	-164.3	-160.1	173	0	109.3	Q51 E55 W56 R57	Q51-K53 PolarHBondContact O-N 3.07Å; K53-E55 HydrophobicContact CB-CG 4.27Å; K53-E55 PolarHBondContact O-N 2.72Å; K53-E55 VanDerWaalsContact O-N 3.12Å; K53-W56 HydrophobicContact CB-CB 4.3Å; K53-W56 HydrophobicContact CB-CD2 4.22Å; K53-W56 HydrophobicContact CB-CE3 4.18Å; K53-W56 HydrophobicContact CB-CG 4.34Å; K53-W56 HydrophobicContact CD-CD2 4.03Å; K53-W56 HydrophobicContact CD-CE3 3.55Å; K53-W56 HydrophobicContact CD-CH2 3.94Å; K53-W56 HydrophobicContact CD-CZ2 4.36Å; K53-W56 HydrophobicContact CD-CZ3 3.52Å; K53-W56 HydrophobicContact CG-CE3 4.22Å; K53-W56 CarbonylContact O-C 3.59Å; K53-W56 PolarHBondContact O-N 2.77Å; K53-R57 PolarHBondContact O-N 3.44Å
54	P	94.8	Very high	97.2	Very high	42 Å²	42	59.2 Å²	59.2	27%	0.273	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.4	-40.3	179.8	-31.2	35.5	0	0	0	114.2	V43 E52 W56 R57	V43-P54 HydrophobicContact CG1-CG 3.4Å; V43-P54 VanDerWaalsContact CG1-CG 3.4Å; E52-P54 WeakPolarHBondContact O-CD 3.23Å; P54-W56 PolarHBondContact O-N 2.68Å; P54-R57 PolarHBondContact O-N 2.99Å
55	E	95.5	Very high	97.2	Very high	110 Å²	110	58.1 Å²	58.1	51%	0.514	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-23	177.9	58.8	-87.7	-161.1	0	0	114.1	R47 K53	R47-E55 IonicContact CZ-OE1 2.63Å; R47-E55 IonicContact CZ-OE2 2.72Å; R47-E55 IonicContact NH1-OE1 3.09Å; R47-E55 PolarHBondContact NH1-OE1 3.1Å; R47-E55 IonicContact NH1-OE2 2.96Å; R47-E55 VanDerWaalsContact NH2-CD 3.33Å; R47-E55 IonicContact NH2-OE1 3.56Å; R47-E55 PolarHBondContact NH2-OE1 3.22Å; R47-E55 VanDerWaalsContact NH2-OE1 3.1Å; R47-E55 IonicContact NH2-OE2 3.23Å; R47-E55 PolarHBondContact NH2-OE2 2.9Å; K53-E55 HydrophobicContact CB-CG 4.27Å; K53-E55 PolarHBondContact O-N 2.72Å; K53-E55 VanDerWaalsContact O-N 3.12Å
56	W	95.8	Very high	97.2	Very high	101 Å²	101	59.8 Å²	59.8	38%	0.383	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-7.5	-178.4	-58.9	-16.1	0	0	0	113.2	K53 P54 L58 R59 D60	K53-W56 HydrophobicContact CB-CB 4.3Å; K53-W56 HydrophobicContact CB-CD2 4.22Å; K53-W56 HydrophobicContact CB-CE3 4.18Å; K53-W56 HydrophobicContact CB-CG 4.34Å; K53-W56 HydrophobicContact CD-CD2 4.03Å; K53-W56 HydrophobicContact CD-CE3 3.55Å; K53-W56 HydrophobicContact CD-CH2 3.94Å; K53-W56 HydrophobicContact CD-CZ2 4.36Å; K53-W56 HydrophobicContact CD-CZ3 3.52Å; K53-W56 HydrophobicContact CG-CE3 4.22Å; K53-W56 CarbonylContact O-C 3.59Å; K53-W56 PolarHBondContact O-N 2.77Å; P54-W56 PolarHBondContact O-N 2.68Å; W56-L58 PolarHBondContact O-N 2.78Å; W56-R59 VanDerWaalsContact CE3-NH2 3.34Å; W56-R59 CarbonylContact O-C 3.57Å; W56-R59 WeakPolarHBondContact O-CA 3.31Å; W56-R59 VanDerWaalsContact O-CB 3.31Å; W56-R59 WeakPolarHBondContact O-CB 3.41Å; W56-R59 PolarHBondContact O-N 3.5Å; W56-D60 WeakPolarHBondContact CB-OD2 3.27Å; W56-D60 PolarHBondContact O-N 2.86Å
57	R	95.4	Very high	97.2	Very high	20 Å²	20	61.2 Å²	61.2	8%	0.075	28%	0.282	C	S	.	.	H	α-helix	trans	-47.2	-54.2	-172.5	-176	-174.5	-67.3	127.7	-8	113.7	Y34 E52 K53 P54 R59 D60 V61 L85	Y34-R57 VanDerWaalsContact CE1-CD 3.41Å; E52-R57 IonicContact OE1-CZ 2.66Å; E52-R57 IonicContact OE1-NE 2.72Å; E52-R57 PolarHBondContact OE1-NE 2.82Å; E52-R57 IonicContact OE1-NH2 3.6Å; E52-R57 PolarHBondContact OE1-NH2 2.73Å; K53-R57 PolarHBondContact O-N 3.44Å; P54-R57 PolarHBondContact O-N 2.99Å; R57-R59 VanDerWaalsContact C-N 3.33Å; R57-R59 PolarHBondContact O-N 3.3Å; R57-D60 PolarHBondContact O-N 2.87Å; R57-V61 VanDerWaalsContact O-CG2 3.27Å; R57-V61 WeakPolarHBondContact O-CG2 3.48Å; R57-V61 PolarHBondContact O-N 3.12Å; R57-L85 HydrophobicContact CG-CD1 4.33Å; R57-L85 HydrophobicContact CG-CD2 3.64Å
58	L	94.9	Very high	97.1	Very high	80 Å²	80	56.3 Å²	56.3	42%	0.419	26%	0.264	S	S	.	.	H	α-helix	trans	-68.1	-33.4	-178.7	-66.9	-178.5	0	0	0	112.5	Y34 W56 Q62	Y34-L58 HydrophobicContact CD1-CD2 3.79Å; Y34-L58 HydrophobicContact CG-CD2 4.39Å; W56-L58 PolarHBondContact O-N 2.78Å; L58-Q62 WeakPolarHBondContact O-CB 3.4Å; L58-Q62 PolarHBondContact O-N 2.96Å
59	R	96.4	Very high	97	Very high	140 Å²	140	52.3 Å²	52.3	53%	0.528	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-43.2	173.8	-175	-164.3	70.4	-176.3	-0.1	110.9	W56 R57 V61 Q62 A63	W56-R59 VanDerWaalsContact CE3-NH2 3.34Å; W56-R59 CarbonylContact O-C 3.57Å; W56-R59 WeakPolarHBondContact O-CA 3.31Å; W56-R59 VanDerWaalsContact O-CB 3.31Å; W56-R59 WeakPolarHBondContact O-CB 3.41Å; W56-R59 PolarHBondContact O-N 3.5Å; R57-R59 VanDerWaalsContact C-N 3.33Å; R57-R59 PolarHBondContact O-N 3.3Å; R59-V61 VanDerWaalsContact C-N 3.35Å; R59-Q62 WeakPolarHBondContact O-CB 3.47Å; R59-Q62 PolarHBondContact O-N 3.29Å; R59-A63 PolarHBondContact O-N 2.84Å
60	D	97.9	Very high	96.9	Very high	5 Å²	5	57.7 Å²	57.7	3%	0.027	27%	0.27	C	S	.	.	H	α-helix	trans	-71	-34.5	-178	-58.5	-16.5	0	0	0	110.8	W56 R57 A63 L64 F93 Y95	W56-D60 WeakPolarHBondContact CB-OD2 3.27Å; W56-D60 PolarHBondContact O-N 2.86Å; R57-D60 PolarHBondContact O-N 2.87Å; D60-A63 PolarHBondContact O-N 2.93Å; D60-L64 PolarHBondContact O-N 2.67Å; D60-L64 VanDerWaalsContact O-N 3.14Å; D60-F93 HydrophobicContact CB-CD1 4.03Å; D60-F93 HydrophobicContact CB-CE1 4.3Å; D60-Y95 HydrophobicContact CB-CE1 3.96Å; D60-Y95 WeakPolarHBondContact CB-OH 3.44Å; D60-Y95 PolarHBondContact OD1-OH 3.31Å
61	V	97.6	Very high	96.9	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.4	-45.6	168	170.7	0	0	0	0	111.6	R57 R59 A63 L64 R65 D81 L84 L85 L88	R57-V61 VanDerWaalsContact O-CG2 3.27Å; R57-V61 WeakPolarHBondContact O-CG2 3.48Å; R57-V61 PolarHBondContact O-N 3.12Å; R59-V61 VanDerWaalsContact C-N 3.35Å; V61-A63 VanDerWaalsContact C-N 3.3Å; V61-A63 PolarHBondContact O-N 3.27Å; V61-L64 PolarHBondContact O-N 3.37Å; V61-R65 WeakPolarHBondContact O-CB 3.35Å; V61-R65 PolarHBondContact O-N 3.2Å; V61-D81 HydrophobicContact CG1-CB 4.14Å; V61-D81 VanDerWaalsContact CG1-OD1 3.24Å; V61-D81 WeakPolarHBondContact CG1-OD1 3.22Å; V61-L84 HydrophobicContact CG1-CB 4.17Å; V61-L84 HydrophobicContact CG1-CD1 4.1Å; V61-L85 HydrophobicContact CG2-CD1 4.33Å; V61-L85 HydrophobicContact CG2-CD2 3.51Å; V61-L85 HydrophobicContact CG2-CG 3.57Å; V61-L88 HydrophobicContact CB-CD1 4.43Å; V61-L88 HydrophobicContact CG2-CD1 3.76Å
62	Q	97.6	Very high	96.7	Very high	79 Å²	79	59.5 Å²	59.5	37%	0.369	28%	0.278	S	S	.	.	H	α-helix	trans	-61.1	-40.4	176.4	-174.3	61.3	44.6	0	0	111.5	L58 R59 L64 R65 D66	L58-Q62 WeakPolarHBondContact O-CB 3.4Å; L58-Q62 PolarHBondContact O-N 2.96Å; R59-Q62 WeakPolarHBondContact O-CB 3.47Å; R59-Q62 PolarHBondContact O-N 3.29Å; Q62-L64 PolarHBondContact O-N 2.93Å; Q62-R65 WeakPolarHBondContact O-CB 3.48Å; Q62-R65 PolarHBondContact O-N 3.47Å; Q62-D66 PolarHBondContact NE2-OD1 3.33Å; Q62-D66 VanDerWaalsContact O-CG 3.22Å; Q62-D66 PolarHBondContact O-N 2.88Å
63	A	98.2	Very high	96.4	Very high	30 Å²	30	63.1 Å²	63.1	25%	0.248	30%	0.301	C	S	.	.	H	α-helix	trans	-60.2	-46.8	176.4	0	0	0	0	0	112	R59 D60 V61 R65 D66 M67 Y95	R59-A63 PolarHBondContact O-N 2.84Å; D60-A63 PolarHBondContact O-N 2.93Å; V61-A63 VanDerWaalsContact C-N 3.3Å; V61-A63 PolarHBondContact O-N 3.27Å; A63-R65 VanDerWaalsContact C-N 3.34Å; A63-R65 PolarHBondContact O-N 3.3Å; A63-D66 PolarHBondContact O-N 3.3Å; A63-M67 WeakPolarHBondContact O-CG 3.36Å; A63-M67 PolarHBondContact O-N 3.43Å; A63-Y95 HydrophobicContact CB-CE2 4.29Å
64	L	98.3	Very high	96.1	Very high	0 Å²	0	66 Å²	66	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.9	-41.2	175.9	179.6	60.1	0	0	0	111.7	D60 V61 Q62 D66 M67 I68 L84 L88 A98 L99	D60-L64 PolarHBondContact O-N 2.67Å; D60-L64 VanDerWaalsContact O-N 3.14Å; V61-L64 PolarHBondContact O-N 3.37Å; Q62-L64 PolarHBondContact O-N 2.93Å; L64-D66 VanDerWaalsContact C-N 3.35Å; L64-D66 PolarHBondContact O-N 2.9Å; L64-M67 PolarHBondContact O-N 3.43Å; L64-I68 HydrophobicContact CD1-CD1 4.32Å; L64-I68 HydrophobicContact CD1-CG1 4.45Å; L64-I68 HydrophobicContact CG-CD1 4.03Å; L64-I68 WeakPolarHBondContact O-CD1 3.4Å; L64-I68 VanDerWaalsContact O-CG1 3.26Å; L64-I68 WeakPolarHBondContact O-CG1 3.43Å; L64-I68 PolarHBondContact O-N 3.5Å; L64-L84 HydrophobicContact CD2-CB 4.37Å; L64-L84 HydrophobicContact CD2-CD2 4.35Å; L64-L88 HydrophobicContact CB-CD2 4.31Å; L64-L88 HydrophobicContact CD2-CD1 4.34Å; L64-L88 HydrophobicContact CD2-CD2 3.94Å; L64-L88 HydrophobicContact CD2-CG 3.78Å; L64-A98 HydrophobicContact CD1-CB 4.42Å; L64-A98 HydrophobicContact CD2-CB 4.18Å; L64-L99 HydrophobicContact CD1-CB 3.97Å
65	R	98	Very high	95.9	Very high	34 Å²	34	65.6 Å²	65.6	13%	0.128	32%	0.316	C	S	.	.	H	α-helix	trans	-58.4	-46.6	175.5	-177.6	-178	-64	111.5	6.3	111.6	V61 Q62 A63 I68 L69 L79 D81 L84	V61-R65 WeakPolarHBondContact O-CB 3.35Å; V61-R65 PolarHBondContact O-N 3.2Å; Q62-R65 WeakPolarHBondContact O-CB 3.48Å; Q62-R65 PolarHBondContact O-N 3.47Å; A63-R65 VanDerWaalsContact C-N 3.34Å; A63-R65 PolarHBondContact O-N 3.3Å; R65-I68 PolarHBondContact O-N 2.99Å; R65-L69 HydrophobicContact CG-CD1 4.14Å; R65-L69 WeakPolarHBondContact O-CG 3.09Å; R65-L69 PolarHBondContact O-N 2.81Å; R65-L79 HydrophobicContact CG-CB 4.42Å; R65-L79 HydrophobicContact CG-CD2 4.41Å; R65-L79 VanDerWaalsContact CZ-O 3.31Å; R65-L79 PolarHBondContact NE-O 3.12Å; R65-L79 PolarHBondContact NH2-O 3.04Å; R65-D81 IonicContact CZ-OD1 2.9Å; R65-D81 IonicContact NH1-OD1 3.2Å; R65-D81 IonicContact NH2-OD1 2.82Å; R65-D81 PolarHBondContact NH2-OD1 3.28Å; R65-L84 HydrophobicContact CB-CD1 3.84Å; R65-L84 HydrophobicContact CG-CD1 4.45Å
66	D	97.6	Very high	95.5	Very high	80 Å²	80	65.6 Å²	65.6	43%	0.428	31%	0.311	S	S	.	.	H	α-helix	trans	-64.7	-40.7	179.7	-68.1	-21.1	0	0	0	111.6	Q62 A63 L64 L69 K70	Q62-D66 PolarHBondContact NE2-OD1 3.33Å; Q62-D66 VanDerWaalsContact O-CG 3.22Å; Q62-D66 PolarHBondContact O-N 2.88Å; A63-D66 PolarHBondContact O-N 3.3Å; L64-D66 VanDerWaalsContact C-N 3.35Å; L64-D66 PolarHBondContact O-N 2.9Å; D66-L69 PolarHBondContact O-N 3.47Å; D66-K70 VanDerWaalsContact O-CB 3.22Å; D66-K70 WeakPolarHBondContact O-CB 3.48Å; D66-K70 PolarHBondContact O-N 3.35Å
67	M	98.1	Very high	95.2	Very high	31 Å²	31	61.4 Å²	61.4	15%	0.153	30%	0.296	C	S	.	.	H	α-helix	trans	-58.9	-47	173.7	-70.3	172.2	71.5	0	0	111.5	A63 L64 L69 K70 E71 Y95 D96 L99	A63-M67 WeakPolarHBondContact O-CG 3.36Å; A63-M67 PolarHBondContact O-N 3.43Å; L64-M67 PolarHBondContact O-N 3.43Å; M67-L69 PolarHBondContact O-N 2.92Å; M67-K70 PolarHBondContact O-N 2.94Å; M67-E71 WeakPolarHBondContact O-CB 3.34Å; M67-E71 PolarHBondContact O-N 2.95Å; M67-Y95 HydrophobicContact SD-CG 4.49Å; M67-D96 WeakPolarHBondContact CE-OD1 3.47Å; M67-L99 HydrophobicContact CB-CD2 4.35Å; M67-L99 HydrophobicContact CE-CD2 3.97Å
68	I	97	Very high	95	Very high	2 Å²	2	65 Å²	65	1%	0.01	31%	0.31	C	S	.	.	H	α-helix	trans	-59.3	-49.3	178.1	-65.7	159.1	0	0	0	110.6	L64 R65 K70 H72 L75 T77 L79 L84 L99 L102	L64-I68 HydrophobicContact CD1-CD1 4.32Å; L64-I68 HydrophobicContact CD1-CG1 4.45Å; L64-I68 HydrophobicContact CG-CD1 4.03Å; L64-I68 WeakPolarHBondContact O-CD1 3.4Å; L64-I68 VanDerWaalsContact O-CG1 3.26Å; L64-I68 WeakPolarHBondContact O-CG1 3.43Å; L64-I68 PolarHBondContact O-N 3.5Å; R65-I68 PolarHBondContact O-N 2.99Å; I68-K70 VanDerWaalsContact C-N 3.32Å; I68-K70 PolarHBondContact O-N 3.24Å; I68-H72 CarbonylContact O-C 3.12Å; I68-H72 VanDerWaalsContact O-CA 3.28Å; I68-H72 WeakPolarHBondContact O-CA 3.41Å; I68-H72 PolarHBondContact O-N 3.38Å; I68-L75 HydrophobicContact CG2-CD2 4.19Å; I68-T77 HydrophobicContact CG2-CG2 4.07Å; I68-L79 HydrophobicContact CB-CD2 4.34Å; I68-L79 HydrophobicContact CD1-CD2 4.02Å; I68-L79 HydrophobicContact CG2-CD2 3.97Å; I68-L84 HydrophobicContact CD1-CD2 3.67Å; I68-L99 HydrophobicContact CG1-CD1 3.66Å; I68-L102 HydrophobicContact CD1-CD2 3.32Å; I68-L102 HydrophobicContact CG1-CD2 3.83Å
69	L	95.6	Very high	94.9	Very high	81 Å²	81	63.8 Å²	63.8	42%	0.424	30%	0.303	S	S	.	.	H	α-helix	trans	-66.5	-34.3	-176.9	-71.4	174.6	0	0	0	112.8	R65 D66 M67 L79	R65-L69 HydrophobicContact CG-CD1 4.14Å; R65-L69 WeakPolarHBondContact O-CG 3.09Å; R65-L69 PolarHBondContact O-N 2.81Å; D66-L69 PolarHBondContact O-N 3.47Å; M67-L69 PolarHBondContact O-N 2.92Å; L69-L79 HydrophobicContact CD1-CD1 4.48Å; L69-L79 HydrophobicContact CD2-CD1 3.7Å; L69-L79 HydrophobicContact CG-CD1 4.17Å
70	K	96.4	Very high	94.7	Very high	174 Å²	174	59.9 Å²	59.9	76%	0.757	29%	0.293	S	S	*	.	H	α-helix	trans	-79.6	-47.7	-178.9	-176.6	-177	175.9	-172.3	0	112.4	D66 M67 I68	D66-K70 VanDerWaalsContact O-CB 3.22Å; D66-K70 WeakPolarHBondContact O-CB 3.48Å; D66-K70 PolarHBondContact O-N 3.35Å; M67-K70 PolarHBondContact O-N 2.94Å; I68-K70 VanDerWaalsContact C-N 3.32Å; I68-K70 PolarHBondContact O-N 3.24Å
71	E	97	Very high	94.6	Very high	105 Å²	105	61.5 Å²	61.5	49%	0.491	30%	0.302	S	S	.	.	H	α-helix	trans	-91	-26.8	-171.1	-61.8	177.1	-152.7	0	0	112.3	M67 P73	M67-E71 WeakPolarHBondContact O-CB 3.34Å; M67-E71 PolarHBondContact O-N 2.95Å; E71-P73 VanDerWaalsContact C-CD 3.5Å
72	H	95.1	Very high	94.5	Very high	62 Å²	62	63.5 Å²	63.5	29%	0.287	32%	0.318	S	S	.	.			trans	-133.9	58.3	-177.1	-57.3	-72.5	0	0	0	112.4	I68 N74 L75 L103	I68-H72 CarbonylContact O-C 3.12Å; I68-H72 VanDerWaalsContact O-CA 3.28Å; I68-H72 WeakPolarHBondContact O-CA 3.41Å; I68-H72 PolarHBondContact O-N 3.38Å; H72-N74 PolarHBondContact O-N 3.31Å; H72-L75 HydrophobicContact CB-CB 3.9Å; H72-L75 WeakPolarHBondContact O-CB 3.27Å; H72-L75 PolarHBondContact O-N 3.43Å; H72-L103 WeakPolarHBondContact NE2-CD1 3.1Å
73	P	91.3	Very high	94.5	Very high	77 Å²	77	59.8 Å²	59.8	50%	0.5	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.1	-174.7	25.2	-36	0	0	0	114.5	E71	E71-P73 VanDerWaalsContact C-CD 3.5Å
74	N	90.1	Very high	94.4	Very high	133 Å²	133	58.4 Å²	58.4	71%	0.711	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-0.1	178.9	-62.6	-36.5	0	0	0	113.3	H72 R76	H72-N74 PolarHBondContact O-N 3.31Å; N74-R76 PolarHBondContact O-N 2.9Å
75	L	90	Very high	94.4	Very high	34 Å²	34	58.4 Å²	58.4	18%	0.178	29%	0.289	C	S	.	.			trans	-72.4	113.5	174.8	-178.7	67.3	0	0	0	109.2	I68 H72 T77 L102 L103 H106	I68-L75 HydrophobicContact CG2-CD2 4.19Å; H72-L75 HydrophobicContact CB-CB 3.9Å; H72-L75 WeakPolarHBondContact O-CB 3.27Å; H72-L75 PolarHBondContact O-N 3.43Å; L75-T77 HydrophobicContact CD2-CG2 3.94Å; L75-T77 HydrophobicContact CG-CG2 4.04Å; L75-T77 PolarHBondContact O-N 2.82Å; L75-L102 HydrophobicContact CD2-CD2 4.23Å; L75-L102 HydrophobicContact CD2-CG 4.37Å; L75-L103 HydrophobicContact CD2-CD2 3.93Å; L75-H106 HydrophobicContact CD1-CB 3.96Å
76	R	86.8	Confident	94.5	Very high	110 Å²	110	58 Å²	58	42%	0.415	29%	0.288	S	S	.	.			trans	-81.5	102.7	174	-57.8	-172.6	-175.1	-166.8	16.7	109	N74 H106 D308	N74-R76 PolarHBondContact O-N 2.9Å; R76-H106 PolarHBondContact O-CE1 3.15Å; R76-D308 IonicContact CZ-OD1 2.68Å; R76-D308 IonicContact CZ-OD2 2.77Å; R76-D308 IonicContact NE-OD2 3.5Å; R76-D308 IonicContact NH1-OD1 3.15Å; R76-D308 PolarHBondContact NH1-OD1 3.4Å; R76-D308 IonicContact NH1-OD2 2.9Å; R76-D308 PolarHBondContact NH1-OD2 3.47Å; R76-D308 IonicContact NH2-OD1 3.53Å; R76-D308 PolarHBondContact NH2-OD1 2.79Å; R76-D308 IonicContact NH2-OD2 3.84Å; R76-D308 PolarHBondContact NH2-OD2 3.44Å
77	T	90.1	Very high	94.5	Very high	12 Å²	12	54.1 Å²	54.1	7%	0.074	27%	0.267	C	S	.	.			trans	-148.4	153.6	-178.6	-172.3	0	0	0	0	110	I68 L75 L79 F83 L102 H106	I68-T77 HydrophobicContact CG2-CG2 4.07Å; L75-T77 HydrophobicContact CD2-CG2 3.94Å; L75-T77 HydrophobicContact CG-CG2 4.04Å; L75-T77 PolarHBondContact O-N 2.82Å; T77-L79 HydrophobicContact CG2-CD2 3.89Å; T77-L79 HydrophobicContact CG2-CG 4.47Å; T77-F83 WeakPolarHBondContact OG1-CE1 3.47Å; T77-L102 HydrophobicContact CG2-CD2 4.38Å; T77-H106 WeakPolarHBondContact CB-NE2 3.28Å; T77-H106 PolarHBondContact OG1-NE2 3.22Å
78	R	91	Very high	94.6	Very high	96 Å²	96	52.7 Å²	52.7	36%	0.362	26%	0.26	S	S	.	.			trans	-61.2	141.5	165	-71.1	174	56.2	160.9	4.2	110.2	D80 F83	R78-D80 IonicContact CZ-OD2 3.96Å; R78-D80 VanDerWaalsContact CZ-OD2 3.3Å; R78-D80 IonicContact NE-OD2 2.8Å; R78-D80 PolarHBondContact NE-OD2 3.41Å; R78-D80 VanDerWaalsContact NH2-CG 3.35Å; R78-D80 IonicContact NH2-OD1 2.63Å; R78-D80 PolarHBondContact NH2-OD1 3.33Å; R78-D80 IonicContact NH2-OD2 2.85Å; R78-D80 PolarHBondContact NH2-OD2 3.46Å; R78-F83 HydrophobicContact CB-CB 4.12Å; R78-F83 HydrophobicContact CB-CD1 3.61Å; R78-F83 HydrophobicContact CB-CD2 4.11Å; R78-F83 HydrophobicContact CB-CE1 3.99Å; R78-F83 HydrophobicContact CB-CE2 4.43Å; R78-F83 HydrophobicContact CB-CG 3.68Å; R78-F83 HydrophobicContact CB-CZ 4.37Å; R78-F83 WeakPolarHBondContact O-CD1 3.36Å; R78-F83 WeakPolarHBondContact O-CE1 3.43Å
79	L	92.5	Very high	94.6	Very high	54 Å²	54	52.6 Å²	52.6	28%	0.283	26%	0.26	S	S	.	.			trans	-123.4	9.3	179.8	-63.9	176	0	0	0	112.2	R65 I68 L69 T77	R65-L79 HydrophobicContact CG-CB 4.42Å; R65-L79 HydrophobicContact CG-CD2 4.41Å; R65-L79 VanDerWaalsContact CZ-O 3.31Å; R65-L79 PolarHBondContact NE-O 3.12Å; R65-L79 PolarHBondContact NH2-O 3.04Å; I68-L79 HydrophobicContact CB-CD2 4.34Å; I68-L79 HydrophobicContact CD1-CD2 4.02Å; I68-L79 HydrophobicContact CG2-CD2 3.97Å; L69-L79 HydrophobicContact CD1-CD1 4.48Å; L69-L79 HydrophobicContact CD2-CD1 3.7Å; L69-L79 HydrophobicContact CG-CD1 4.17Å; T77-L79 HydrophobicContact CG2-CD2 3.89Å; T77-L79 HydrophobicContact CG2-CG 4.47Å
80	D	93.5	Very high	94.8	Very high	59 Å²	59	49.3 Å²	49.3	32%	0.316	24%	0.244	S	C	.	.			trans	-67.2	152.3	174.4	67.3	92.5	0	0	0	111.6	R78 A82 F83 L84	R78-D80 IonicContact CZ-OD2 3.96Å; R78-D80 VanDerWaalsContact CZ-OD2 3.3Å; R78-D80 IonicContact NE-OD2 2.8Å; R78-D80 PolarHBondContact NE-OD2 3.41Å; R78-D80 VanDerWaalsContact NH2-CG 3.35Å; R78-D80 IonicContact NH2-OD1 2.63Å; R78-D80 PolarHBondContact NH2-OD1 3.33Å; R78-D80 IonicContact NH2-OD2 2.85Å; R78-D80 PolarHBondContact NH2-OD2 3.46Å; D80-A82 VanDerWaalsContact C-N 3.35Å; D80-A82 PolarHBondContact O-N 3.46Å; D80-A82 PolarHBondContact OD1-N 2.92Å; D80-F83 PolarHBondContact O-N 2.9Å; D80-F83 WeakPolarHBondContact OD1-CB 3.47Å; D80-F83 PolarHBondContact OD1-N 2.82Å; D80-F83 WeakPolarHBondContact OD2-CB 3.4Å; D80-L84 WeakPolarHBondContact O-CG 3.3Å; D80-L84 PolarHBondContact O-N 2.76Å; D80-L84 VanDerWaalsContact O-N 3.09Å
81	D	95.6	Very high	94.8	Very high	38 Å²	38	42.6 Å²	42.6	20%	0.203	21%	0.214	C	C	.	.	H	α-helix	trans	-59.6	-44.5	-173.2	-66.1	-22.3	0	0	0	112.3	Y34 V61 R65 F83 L84 L85	Y34-D81 WeakPolarHBondContact CB-OD2 3.37Å; Y34-D81 HydrophobicContact CD2-CB 4.26Å; Y34-D81 HydrophobicContact CG-CB 3.95Å; V61-D81 HydrophobicContact CG1-CB 4.14Å; V61-D81 VanDerWaalsContact CG1-OD1 3.24Å; V61-D81 WeakPolarHBondContact CG1-OD1 3.22Å; R65-D81 IonicContact CZ-OD1 2.9Å; R65-D81 IonicContact NH1-OD1 3.2Å; R65-D81 IonicContact NH2-OD1 2.82Å; R65-D81 PolarHBondContact NH2-OD1 3.28Å; D81-F83 VanDerWaalsContact C-N 3.34Å; D81-F83 PolarHBondContact O-N 3.2Å; D81-L84 PolarHBondContact O-N 3.17Å; D81-L85 WeakPolarHBondContact O-CB 3.31Å; D81-L85 VanDerWaalsContact O-CG 3.23Å; D81-L85 WeakPolarHBondContact O-CG 3.49Å; D81-L85 PolarHBondContact O-N 3.14Å
82	A	95.1	Very high	94.9	Very high	42 Å²	42	42 Å²	42	35%	0.347	21%	0.209	S	C	.	.	H	α-helix	trans	-63.6	-39.8	-177.2	0	0	0	0	0	111.8	Y34 D80	Y34-A82 HydrophobicContact CD2-CB 4.37Å; D80-A82 VanDerWaalsContact C-N 3.35Å; D80-A82 PolarHBondContact O-N 3.46Å; D80-A82 PolarHBondContact OD1-N 2.92Å
83	F	96.3	Very high	95	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.009	20%	0.199	C	C	.	.	H	α-helix	trans	-65.6	-50.6	174.8	177.9	-98	0	0	0	112	T77 R78 D80 D81 L85 R86 F87 L102 Y105	T77-F83 WeakPolarHBondContact OG1-CE1 3.47Å; R78-F83 HydrophobicContact CB-CB 4.12Å; R78-F83 HydrophobicContact CB-CD1 3.61Å; R78-F83 HydrophobicContact CB-CD2 4.11Å; R78-F83 HydrophobicContact CB-CE1 3.99Å; R78-F83 HydrophobicContact CB-CE2 4.43Å; R78-F83 HydrophobicContact CB-CG 3.68Å; R78-F83 HydrophobicContact CB-CZ 4.37Å; R78-F83 WeakPolarHBondContact O-CD1 3.36Å; R78-F83 WeakPolarHBondContact O-CE1 3.43Å; D80-F83 PolarHBondContact O-N 2.9Å; D80-F83 WeakPolarHBondContact OD1-CB 3.47Å; D80-F83 PolarHBondContact OD1-N 2.82Å; D80-F83 WeakPolarHBondContact OD2-CB 3.4Å; D81-F83 VanDerWaalsContact C-N 3.34Å; D81-F83 PolarHBondContact O-N 3.2Å; F83-L85 VanDerWaalsContact C-N 3.29Å; F83-L85 PolarHBondContact O-N 3.09Å; F83-R86 VanDerWaalsContact O-CB 3.3Å; F83-R86 WeakPolarHBondContact O-CB 3.48Å; F83-R86 WeakPolarHBondContact O-CG 3.28Å; F83-R86 PolarHBondContact O-N 2.87Å; F83-R86 VanDerWaalsContact O-N 3.16Å; F83-F87 HydrophobicContact CD1-CE2 4.13Å; F83-F87 HydrophobicContact CD2-CE2 4.37Å; F83-F87 HydrophobicContact CE1-CD2 4.32Å; F83-F87 AromaticContact CE1-CE2 3.58Å; F83-F87 HydrophobicContact CE1-CE2 3.58Å; F83-F87 HydrophobicContact CE1-CZ 4.3Å; F83-F87 AromaticContact CE2-CE2 3.86Å; F83-F87 HydrophobicContact CE2-CE2 3.86Å; F83-F87 HydrophobicContact CE2-CZ 4.33Å; F83-F87 HydrophobicContact CG-CE2 4.49Å; F83-F87 AromaticContact CZ-CE2 3.44Å; F83-F87 HydrophobicContact CZ-CE2 3.44Å; F83-F87 VanDerWaalsContact CZ-CE2 3.44Å; F83-F87 AromaticContact CZ-CZ 3.83Å; F83-F87 HydrophobicContact CZ-CZ 3.83Å; F83-F87 WeakPolarHBondContact O-CD2 3.23Å; F83-L102 HydrophobicContact CE1-CD1 3.78Å; F83-L102 HydrophobicContact CZ-CD1 3.97Å; F83-Y105 HydrophobicContact CE2-CE1 4.29Å; F83-Y105 HydrophobicContact CZ-CE1 4.08Å
84	L	98	Very high	95.4	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-64.6	-33.7	-178	-66.8	-178.5	0	0	0	112.5	V61 L64 R65 I68 D80 D81 R86 F87 L88	V61-L84 HydrophobicContact CG1-CB 4.17Å; V61-L84 HydrophobicContact CG1-CD1 4.1Å; L64-L84 HydrophobicContact CD2-CB 4.37Å; L64-L84 HydrophobicContact CD2-CD2 4.35Å; R65-L84 HydrophobicContact CB-CD1 3.84Å; R65-L84 HydrophobicContact CG-CD1 4.45Å; I68-L84 HydrophobicContact CD1-CD2 3.67Å; D80-L84 WeakPolarHBondContact O-CG 3.3Å; D80-L84 PolarHBondContact O-N 2.76Å; D80-L84 VanDerWaalsContact O-N 3.09Å; D81-L84 PolarHBondContact O-N 3.17Å; L84-R86 PolarHBondContact O-N 3.31Å; L84-F87 PolarHBondContact O-N 3.48Å; L84-F87 VanDerWaalsContact O-N 3.12Å; L84-L88 PolarHBondContact O-N 2.94Å
85	L	98.3	Very high	95.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.7	-30.1	175.7	-80.7	168	0	0	0	113.5	Y34 R57 V61 D81 F83 F87 L88 R89 F93	Y34-L85 HydrophobicContact CD1-CD1 4.3Å; Y34-L85 HydrophobicContact CD2-CD1 3.92Å; Y34-L85 HydrophobicContact CE1-CD1 3.78Å; Y34-L85 HydrophobicContact CE2-CD1 3.36Å; Y34-L85 HydrophobicContact CG-CD1 4.36Å; R57-L85 HydrophobicContact CG-CD1 4.33Å; R57-L85 HydrophobicContact CG-CD2 3.64Å; V61-L85 HydrophobicContact CG2-CD1 4.33Å; V61-L85 HydrophobicContact CG2-CD2 3.51Å; V61-L85 HydrophobicContact CG2-CG 3.57Å; D81-L85 WeakPolarHBondContact O-CB 3.31Å; D81-L85 VanDerWaalsContact O-CG 3.23Å; D81-L85 WeakPolarHBondContact O-CG 3.49Å; D81-L85 PolarHBondContact O-N 3.14Å; F83-L85 VanDerWaalsContact C-N 3.29Å; F83-L85 PolarHBondContact O-N 3.09Å; L85-F87 VanDerWaalsContact C-N 3.27Å; L85-F87 PolarHBondContact O-N 3.02Å; L85-L88 HydrophobicContact CD2-CD1 4.4Å; L85-L88 PolarHBondContact O-N 2.77Å; L85-R89 VanDerWaalsContact O-CB 3.28Å; L85-R89 WeakPolarHBondContact O-CB 3.25Å; L85-R89 WeakPolarHBondContact O-CG 3.46Å; L85-R89 PolarHBondContact O-N 3.23Å; L85-F93 HydrophobicContact CD2-CE1 4.34Å; L85-F93 HydrophobicContact CD2-CZ 3.98Å
86	R	98.4	Very high	96.1	Very high	25 Å²	25	40.3 Å²	40.3	9%	0.094	19%	0.193	C	C	.	.	H	α-helix	trans	-57.1	-45.2	175.6	-59.6	168.7	-172.3	-180	1.9	110.5	F83 L84 A90 I176 P220	F83-R86 VanDerWaalsContact O-CB 3.3Å; F83-R86 WeakPolarHBondContact O-CB 3.48Å; F83-R86 WeakPolarHBondContact O-CG 3.28Å; F83-R86 PolarHBondContact O-N 2.87Å; F83-R86 VanDerWaalsContact O-N 3.16Å; L84-R86 PolarHBondContact O-N 3.31Å; R86-A90 WeakPolarHBondContact O-CB 3.47Å; R86-A90 PolarHBondContact O-N 3.03Å; R86-I176 HydrophobicContact CB-CG1 4.3Å; R86-I176 HydrophobicContact CG-CG1 4.09Å; R86-P220 HydrophobicContact CB-CB 3.97Å; R86-P220 HydrophobicContact CB-CG 4.03Å
87	F	98.8	Very high	96.7	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-72.4	-44.5	-177.8	-63.7	-90.7	0	0	0	111.8	F83 L84 L85 A90 R91 A98 L101 L102 Y105 P220	F83-F87 HydrophobicContact CD1-CE2 4.13Å; F83-F87 HydrophobicContact CD2-CE2 4.37Å; F83-F87 HydrophobicContact CE1-CD2 4.32Å; F83-F87 AromaticContact CE1-CE2 3.58Å; F83-F87 HydrophobicContact CE1-CE2 3.58Å; F83-F87 HydrophobicContact CE1-CZ 4.3Å; F83-F87 AromaticContact CE2-CE2 3.86Å; F83-F87 HydrophobicContact CE2-CE2 3.86Å; F83-F87 HydrophobicContact CE2-CZ 4.33Å; F83-F87 HydrophobicContact CG-CE2 4.49Å; F83-F87 AromaticContact CZ-CE2 3.44Å; F83-F87 HydrophobicContact CZ-CE2 3.44Å; F83-F87 VanDerWaalsContact CZ-CE2 3.44Å; F83-F87 AromaticContact CZ-CZ 3.83Å; F83-F87 HydrophobicContact CZ-CZ 3.83Å; F83-F87 WeakPolarHBondContact O-CD2 3.23Å; L84-F87 PolarHBondContact O-N 3.48Å; L84-F87 VanDerWaalsContact O-N 3.12Å; L85-F87 VanDerWaalsContact C-N 3.27Å; L85-F87 PolarHBondContact O-N 3.02Å; F87-A90 PolarHBondContact O-N 3.12Å; F87-R91 PolarHBondContact O-N 3.05Å; F87-R91 VanDerWaalsContact O-N 3.11Å; F87-A98 HydrophobicContact CB-CB 4.32Å; F87-L101 HydrophobicContact CD1-CB 4.24Å; F87-L101 HydrophobicContact CD1-CD2 4Å; F87-L101 HydrophobicContact CD1-CG 3.78Å; F87-L101 HydrophobicContact CE1-CG 4.23Å; F87-L102 HydrophobicContact CD1-CB 3.76Å; F87-L102 HydrophobicContact CD1-CD1 4.17Å; F87-L102 HydrophobicContact CD2-CD1 4.18Å; F87-L102 VanDerWaalsContact CE1-CA 3.48Å; F87-L102 HydrophobicContact CE1-CB 3.92Å; F87-L102 HydrophobicContact CE1-CD1 3.7Å; F87-L102 HydrophobicContact CE1-CG 4.44Å; F87-L102 HydrophobicContact CE2-CD1 3.7Å; F87-L102 HydrophobicContact CG-CB 4.27Å; F87-L102 HydrophobicContact CG-CD1 4.42Å; F87-L102 HydrophobicContact CZ-CD1 3.44Å; F87-L102 VanDerWaalsContact CZ-CD1 3.44Å; F87-Y105 HydrophobicContact CE1-CD1 4.42Å; F87-Y105 HydrophobicContact CE1-CG 4.16Å; F87-Y105 AromaticContact CZ-CD1 3.97Å; F87-Y105 HydrophobicContact CZ-CD1 3.97Å; F87-Y105 HydrophobicContact CZ-CD2 4.47Å; F87-Y105 HydrophobicContact CZ-CE1 4.16Å; F87-Y105 HydrophobicContact CZ-CG 4.07Å; F87-P220 HydrophobicContact CD1-CB 4.06Å; F87-P220 HydrophobicContact CD1-CG 4.43Å; F87-P220 HydrophobicContact CE1-CB 4.1Å; F87-P220 HydrophobicContact CE1-CG 3.99Å; F87-P220 HydrophobicContact CE2-CG 4.25Å; F87-P220 HydrophobicContact CG-CB 4.29Å; F87-P220 HydrophobicContact CZ-CB 4.39Å; F87-P220 HydrophobicContact CZ-CG 3.9Å
88	L	98.8	Very high	97.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.6	-51.2	175.4	-71.5	171.2	0	0	0	111	V61 L64 L84 L85 A90 R91 K92 F93 Y95 A98	V61-L88 HydrophobicContact CB-CD1 4.43Å; V61-L88 HydrophobicContact CG2-CD1 3.76Å; L64-L88 HydrophobicContact CB-CD2 4.31Å; L64-L88 HydrophobicContact CD2-CD1 4.34Å; L64-L88 HydrophobicContact CD2-CD2 3.94Å; L64-L88 HydrophobicContact CD2-CG 3.78Å; L84-L88 PolarHBondContact O-N 2.94Å; L85-L88 HydrophobicContact CD2-CD1 4.4Å; L85-L88 PolarHBondContact O-N 2.77Å; L88-A90 PolarHBondContact O-N 2.99Å; L88-R91 CarbonylContact O-C 2.98Å; L88-R91 VanDerWaalsContact O-C 3.3Å; L88-R91 PolarHBondContact O-N 3.27Å; L88-K92 PolarHBondContact O-N 3.49Å; L88-F93 HydrophobicContact CB-CD1 4.2Å; L88-F93 HydrophobicContact CB-CD2 4.36Å; L88-F93 HydrophobicContact CB-CE1 4.11Å; L88-F93 HydrophobicContact CB-CE2 4.26Å; L88-F93 HydrophobicContact CB-CG 4.31Å; L88-F93 HydrophobicContact CB-CZ 4.12Å; L88-F93 HydrophobicContact CD1-CD1 4.42Å; L88-F93 HydrophobicContact CD1-CE1 4.17Å; L88-F93 PolarHBondContact O-N 3.3Å; L88-Y95 HydrophobicContact CD2-CD1 3.77Å; L88-Y95 HydrophobicContact CD2-CE1 4.16Å; L88-A98 HydrophobicContact CD2-CB 3.99Å
89	R	98.6	Very high	97.5	Very high	1 Å²	1	37 Å²	37	0%	0.004	18%	0.18	C	C	.	.	H	α-helix	trans	-61.3	-42.2	178.2	-74.9	171.2	171.2	164.2	-0.6	112.5	Y34 L50 E52 L85 R91 K92 F93 E179 Q182	Y34-R89 PolarHBondContact OH-NH2 3.27Å; L50-R89 HydrophobicContact CD1-CB 4.02Å; L50-R89 HydrophobicContact CD1-CG 4.1Å; E52-R89 IonicContact OE1-CZ 3.19Å; E52-R89 IonicContact OE1-NE 2.89Å; E52-R89 PolarHBondContact OE1-NE 2.97Å; E52-R89 IonicContact OE1-NH2 3.62Å; E52-R89 PolarHBondContact OE1-NH2 3.41Å; E52-R89 WeakPolarHBondContact OE2-CG 3.23Å; E52-R89 IonicContact OE2-CZ 3.23Å; E52-R89 IonicContact OE2-NE 2.82Å; E52-R89 PolarHBondContact OE2-NE 2.87Å; E52-R89 IonicContact OE2-NH2 3.98Å; L85-R89 VanDerWaalsContact O-CB 3.28Å; L85-R89 WeakPolarHBondContact O-CB 3.25Å; L85-R89 WeakPolarHBondContact O-CG 3.46Å; L85-R89 PolarHBondContact O-N 3.23Å; R89-R91 PolarHBondContact O-N 2.56Å; R89-K92 PolarHBondContact O-N 3.23Å; R89-F93 HydrophobicContact CG-CE2 3.79Å; R89-F93 HydrophobicContact CG-CZ 4.28Å; R89-E179 IonicContact CZ-OE2 3.53Å; R89-E179 VanDerWaalsContact NH1-CG 3.3Å; R89-E179 IonicContact NH1-OE2 3.59Å; R89-E179 PolarHBondContact NH1-OE2 3.42Å; R89-E179 IonicContact NH2-OE2 2.78Å; R89-E179 PolarHBondContact NH2-OE2 2.83Å; R89-Q182 HydrophobicContact CB-CB 4.37Å; R89-Q182 VanDerWaalsContact CD-OE1 3.25Å
90	A	98.1	Very high	97.7	Very high	11 Å²	11	39.3 Å²	39.3	9%	0.091	19%	0.189	C	C	.	.	H	α-helix	trans	-63.2	-21.5	177	0	0	0	0	0	113.4	R86 F87 L88 L101 P220	R86-A90 WeakPolarHBondContact O-CB 3.47Å; R86-A90 PolarHBondContact O-N 3.03Å; F87-A90 PolarHBondContact O-N 3.12Å; L88-A90 PolarHBondContact O-N 2.99Å; A90-L101 HydrophobicContact CB-CD2 3.74Å; A90-P220 HydrophobicContact CB-CB 4.02Å
91	R	98.2	Very high	98	Very high	33 Å²	33	36.6 Å²	36.6	13%	0.125	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	18.7	-179.5	-64.2	-63.4	-177.6	-99.5	11.8	114.1	F87 L88 R89 F93 D94 R97 A98 L101 Q216 D217	F87-R91 PolarHBondContact O-N 3.05Å; F87-R91 VanDerWaalsContact O-N 3.11Å; L88-R91 CarbonylContact O-C 2.98Å; L88-R91 VanDerWaalsContact O-C 3.3Å; L88-R91 PolarHBondContact O-N 3.27Å; R89-R91 PolarHBondContact O-N 2.56Å; R91-F93 VanDerWaalsContact C-N 3.25Å; R91-F93 PolarHBondContact O-N 2.85Å; R91-D94 VanDerWaalsContact O-CB 3.29Å; R91-D94 WeakPolarHBondContact O-CB 3.4Å; R91-D94 PolarHBondContact O-N 3.23Å; R91-R97 HydrophobicContact CB-CB 3.99Å; R91-R97 HydrophobicContact CG-CB 4.06Å; R91-A98 HydrophobicContact CB-CB 4.22Å; R91-L101 HydrophobicContact CG-CB 4.25Å; R91-L101 HydrophobicContact CG-CD2 3.8Å; R91-Q216 PolarHBondContact NH2-O 3.06Å; R91-D217 IonicContact NH2-OD1 2.81Å; R91-D217 PolarHBondContact NH2-OD1 3.46Å
92	K	98	Very high	98.1	Very high	92 Å²	92	34.8 Å²	34.8	40%	0.4	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	41.2	175.8	-50.6	-176.9	172.8	-173.9	0	113.1	E49 L50 Q51 L88 R89 D94	E49-K92 WeakPolarHBondContact O-CD 3.19Å; E49-K92 WeakPolarHBondContact O-CE 3.27Å; L50-K92 HydrophobicContact CD2-CG 4.48Å; L50-K92 CarbonylContact O-C 3.52Å; L50-K92 WeakPolarHBondContact O-CA 3.37Å; L50-K92 WeakPolarHBondContact O-CB 3.44Å; Q51-K92 PolarHBondContact OE1-O 2.75Å; L88-K92 PolarHBondContact O-N 3.49Å; R89-K92 PolarHBondContact O-N 3.23Å; K92-D94 PolarHBondContact O-N 2.72Å; K92-D94 VanDerWaalsContact O-N 3.1Å
93	F	98.2	Very high	98.2	Very high	17 Å²	17	34.6 Å²	34.6	8%	0.075	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	60	20.3	179.9	-72.6	-108.5	0	0	0	114.3	L50 E52 D60 L85 L88 R89 R91 Y95	L50-F93 WeakPolarHBondContact O-CD2 3.37Å; E52-F93 HydrophobicContact CB-CD2 3.87Å; E52-F93 HydrophobicContact CB-CE2 3.34Å; E52-F93 HydrophobicContact CB-CZ 3.73Å; E52-F93 HydrophobicContact CG-CD2 4.43Å; E52-F93 HydrophobicContact CG-CE1 4.13Å; E52-F93 HydrophobicContact CG-CE2 3.53Å; E52-F93 HydrophobicContact CG-CZ 3.35Å; E52-F93 WeakPolarHBondContact OE2-CE2 3.49Å; D60-F93 HydrophobicContact CB-CD1 4.03Å; D60-F93 HydrophobicContact CB-CE1 4.3Å; L85-F93 HydrophobicContact CD2-CE1 4.34Å; L85-F93 HydrophobicContact CD2-CZ 3.98Å; L88-F93 HydrophobicContact CB-CD1 4.2Å; L88-F93 HydrophobicContact CB-CD2 4.36Å; L88-F93 HydrophobicContact CB-CE1 4.11Å; L88-F93 HydrophobicContact CB-CE2 4.26Å; L88-F93 HydrophobicContact CB-CG 4.31Å; L88-F93 HydrophobicContact CB-CZ 4.12Å; L88-F93 HydrophobicContact CD1-CD1 4.42Å; L88-F93 HydrophobicContact CD1-CE1 4.17Å; L88-F93 PolarHBondContact O-N 3.3Å; R89-F93 HydrophobicContact CG-CE2 3.79Å; R89-F93 HydrophobicContact CG-CZ 4.28Å; R91-F93 VanDerWaalsContact C-N 3.25Å; R91-F93 PolarHBondContact O-N 2.85Å; F93-Y95 VanDerWaalsContact O-CD1 3.3Å; F93-Y95 WeakPolarHBondContact O-CD1 3.47Å; F93-Y95 VanDerWaalsContact O-CE1 3.28Å; F93-Y95 WeakPolarHBondContact O-CE1 3.1Å; F93-Y95 PolarHBondContact O-N 3.31Å
94	D	98.4	Very high	98.3	Very high	63 Å²	63	37 Å²	37	34%	0.337	17%	0.171	S	C	.	.			trans	-78.7	112	164.2	-177.7	-50.6	0	0	0	108.9	R91 K92 D96 R97 A98	R91-D94 VanDerWaalsContact O-CB 3.29Å; R91-D94 WeakPolarHBondContact O-CB 3.4Å; R91-D94 PolarHBondContact O-N 3.23Å; K92-D94 PolarHBondContact O-N 2.72Å; K92-D94 VanDerWaalsContact O-N 3.1Å; D94-D96 PolarHBondContact OD1-N 2.88Å; D94-R97 HydrophobicContact CB-CB 4.08Å; D94-R97 HydrophobicContact CB-CG 4.3Å; D94-R97 VanDerWaalsContact CG-CD 3.43Å; D94-R97 VanDerWaalsContact CG-CG 3.49Å; D94-R97 VanDerWaalsContact OD1-CB 3.3Å; D94-R97 WeakPolarHBondContact OD1-CB 3.16Å; D94-R97 WeakPolarHBondContact OD1-CG 3.28Å; D94-R97 PolarHBondContact OD1-N 2.85Å; D94-R97 WeakPolarHBondContact OD2-CD 3.37Å; D94-A98 VanDerWaalsContact O-CB 3.25Å; D94-A98 WeakPolarHBondContact O-CB 3.32Å; D94-A98 PolarHBondContact O-N 2.89Å
95	Y	98.1	Very high	98.2	Very high	74 Å²	74	37.2 Å²	37.2	29%	0.29	17%	0.171	S	C	.	.	H	α-helix	trans	-67.9	-45.3	-170.1	-54.1	-27.2	0	0	0	112.8	D60 A63 M67 L88 F93 R97 A98 L99	D60-Y95 HydrophobicContact CB-CE1 3.96Å; D60-Y95 WeakPolarHBondContact CB-OH 3.44Å; D60-Y95 PolarHBondContact OD1-OH 3.31Å; A63-Y95 HydrophobicContact CB-CE2 4.29Å; M67-Y95 HydrophobicContact SD-CG 4.49Å; L88-Y95 HydrophobicContact CD2-CD1 3.77Å; L88-Y95 HydrophobicContact CD2-CE1 4.16Å; F93-Y95 VanDerWaalsContact O-CD1 3.3Å; F93-Y95 WeakPolarHBondContact O-CD1 3.47Å; F93-Y95 VanDerWaalsContact O-CE1 3.28Å; F93-Y95 WeakPolarHBondContact O-CE1 3.1Å; F93-Y95 PolarHBondContact O-N 3.31Å; Y95-R97 VanDerWaalsContact C-N 3.31Å; Y95-R97 PolarHBondContact O-N 2.96Å; Y95-A98 PolarHBondContact O-N 3.13Å; Y95-L99 WeakPolarHBondContact O-CB 3.34Å; Y95-L99 PolarHBondContact O-N 2.63Å
96	D	98.3	Very high	98.1	Very high	117 Å²	117	38.1 Å²	38.1	63%	0.626	18%	0.176	S	C	*	.	H	α-helix	trans	-62.9	-42.4	179.8	-62.7	-32.3	0	0	0	110.4	M67 D94 L99 Q100	M67-D96 WeakPolarHBondContact CE-OD1 3.47Å; D94-D96 PolarHBondContact OD1-N 2.88Å; D96-L99 PolarHBondContact O-N 3.16Å; D96-Q100 WeakPolarHBondContact O-CB 3.34Å; D96-Q100 PolarHBondContact O-N 2.84Å
97	R	98.4	Very high	97.9	Very high	142 Å²	142	39.2 Å²	39.2	54%	0.536	19%	0.19	S	C	.	.	H	α-helix	trans	-69.8	-35.4	177.1	-66.7	179.2	70.7	144.5	5.5	112.5	R91 D94 Y95 L101	R91-R97 HydrophobicContact CB-CB 3.99Å; R91-R97 HydrophobicContact CG-CB 4.06Å; D94-R97 HydrophobicContact CB-CB 4.08Å; D94-R97 HydrophobicContact CB-CG 4.3Å; D94-R97 VanDerWaalsContact CG-CD 3.43Å; D94-R97 VanDerWaalsContact CG-CG 3.49Å; D94-R97 VanDerWaalsContact OD1-CB 3.3Å; D94-R97 WeakPolarHBondContact OD1-CB 3.16Å; D94-R97 WeakPolarHBondContact OD1-CG 3.28Å; D94-R97 PolarHBondContact OD1-N 2.85Å; D94-R97 WeakPolarHBondContact OD2-CD 3.37Å; Y95-R97 VanDerWaalsContact C-N 3.31Å; Y95-R97 PolarHBondContact O-N 2.96Å; R97-L101 WeakPolarHBondContact O-CB 3.34Å; R97-L101 PolarHBondContact O-N 2.86Å
98	A	98.6	Very high	97.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-66.5	-45.1	175.5	0	0	0	0	0	111.1	L64 F87 L88 R91 D94 Y95 L101 L102	L64-A98 HydrophobicContact CD1-CB 4.42Å; L64-A98 HydrophobicContact CD2-CB 4.18Å; F87-A98 HydrophobicContact CB-CB 4.32Å; L88-A98 HydrophobicContact CD2-CB 3.99Å; R91-A98 HydrophobicContact CB-CB 4.22Å; D94-A98 VanDerWaalsContact O-CB 3.25Å; D94-A98 WeakPolarHBondContact O-CB 3.32Å; D94-A98 PolarHBondContact O-N 2.89Å; Y95-A98 PolarHBondContact O-N 3.13Å; A98-L101 WeakPolarHBondContact O-CB 3.5Å; A98-L101 PolarHBondContact O-N 2.98Å; A98-L102 PolarHBondContact O-N 3.45Å
99	L	98.5	Very high	97.2	Very high	8 Å²	8	42.1 Å²	42.1	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-59.5	-49.4	173.4	178.8	59.1	0	0	0	110.7	L64 M67 I68 Y95 D96 L101 L102 L103	L64-L99 HydrophobicContact CD1-CB 3.97Å; M67-L99 HydrophobicContact CB-CD2 4.35Å; M67-L99 HydrophobicContact CE-CD2 3.97Å; I68-L99 HydrophobicContact CG1-CD1 3.66Å; Y95-L99 WeakPolarHBondContact O-CB 3.34Å; Y95-L99 PolarHBondContact O-N 2.63Å; D96-L99 PolarHBondContact O-N 3.16Å; L99-L101 VanDerWaalsContact C-N 3.28Å; L99-L101 PolarHBondContact O-N 3.2Å; L99-L102 WeakPolarHBondContact O-CB 3.42Å; L99-L102 PolarHBondContact O-N 2.95Å; L99-L103 HydrophobicContact CD1-CG 4.36Å; L99-L103 HydrophobicContact CG-CD1 4.29Å; L99-L103 WeakPolarHBondContact O-CG 3.28Å; L99-L103 PolarHBondContact O-N 2.9Å
100	Q	98.5	Very high	96.9	Very high	102 Å²	102	49.6 Å²	49.6	48%	0.477	24%	0.242	S	C	.	.	H	α-helix	trans	-59.6	-38.2	178.1	-173.9	61.5	65.6	0	0	112.6	D96 L103 N104	D96-Q100 WeakPolarHBondContact O-CB 3.34Å; D96-Q100 PolarHBondContact O-N 2.84Å; Q100-L103 PolarHBondContact O-N 3.16Å; Q100-N104 PolarHBondContact NE2-OD1 3.23Å; Q100-N104 WeakPolarHBondContact O-CB 3.39Å; Q100-N104 PolarHBondContact O-N 3.15Å; Q100-N104 PolarHBondContact O-ND2 2.68Å; Q100-N104 PolarHBondContact O-OD1 2.81Å
101	L	98.6	Very high	96.6	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	27%	0.265	C	S	.	.	H	α-helix	trans	-64.5	-41.3	174.7	176.8	60.9	0	0	0	111.9	F87 A90 R91 R97 A98 L99 N104 Y105 D217 P220	F87-L101 HydrophobicContact CD1-CB 4.24Å; F87-L101 HydrophobicContact CD1-CD2 4Å; F87-L101 HydrophobicContact CD1-CG 3.78Å; F87-L101 HydrophobicContact CE1-CG 4.23Å; A90-L101 HydrophobicContact CB-CD2 3.74Å; R91-L101 HydrophobicContact CG-CB 4.25Å; R91-L101 HydrophobicContact CG-CD2 3.8Å; R97-L101 WeakPolarHBondContact O-CB 3.34Å; R97-L101 PolarHBondContact O-N 2.86Å; A98-L101 WeakPolarHBondContact O-CB 3.5Å; A98-L101 PolarHBondContact O-N 2.98Å; L99-L101 VanDerWaalsContact C-N 3.28Å; L99-L101 PolarHBondContact O-N 3.2Å; L101-N104 PolarHBondContact O-N 3.46Å; L101-Y105 WeakPolarHBondContact O-CB 3.4Å; L101-Y105 PolarHBondContact O-N 3.35Å; L101-D217 VanDerWaalsContact CD1-C 3.41Å; L101-D217 WeakPolarHBondContact CD1-O 3.3Å; L101-P220 HydrophobicContact CD2-CB 4.15Å
102	L	98.4	Very high	96.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-63.2	-43	175.4	179.1	66.3	0	0	0	111.8	I68 L75 T77 F83 F87 A98 L99 N104 Y105 H106	I68-L102 HydrophobicContact CD1-CD2 3.32Å; I68-L102 HydrophobicContact CG1-CD2 3.83Å; L75-L102 HydrophobicContact CD2-CD2 4.23Å; L75-L102 HydrophobicContact CD2-CG 4.37Å; T77-L102 HydrophobicContact CG2-CD2 4.38Å; F83-L102 HydrophobicContact CE1-CD1 3.78Å; F83-L102 HydrophobicContact CZ-CD1 3.97Å; F87-L102 HydrophobicContact CD1-CB 3.76Å; F87-L102 HydrophobicContact CD1-CD1 4.17Å; F87-L102 HydrophobicContact CD2-CD1 4.18Å; F87-L102 VanDerWaalsContact CE1-CA 3.48Å; F87-L102 HydrophobicContact CE1-CB 3.92Å; F87-L102 HydrophobicContact CE1-CD1 3.7Å; F87-L102 HydrophobicContact CE1-CG 4.44Å; F87-L102 HydrophobicContact CE2-CD1 3.7Å; F87-L102 HydrophobicContact CG-CB 4.27Å; F87-L102 HydrophobicContact CG-CD1 4.42Å; F87-L102 HydrophobicContact CZ-CD1 3.44Å; F87-L102 VanDerWaalsContact CZ-CD1 3.44Å; A98-L102 PolarHBondContact O-N 3.45Å; L99-L102 WeakPolarHBondContact O-CB 3.42Å; L99-L102 PolarHBondContact O-N 2.95Å; L102-N104 VanDerWaalsContact C-N 3.35Å; L102-N104 PolarHBondContact O-N 3.35Å; L102-Y105 WeakPolarHBondContact O-CB 3.43Å; L102-Y105 PolarHBondContact O-N 3.24Å; L102-H106 PolarHBondContact O-CD2 3.33Å; L102-H106 VanDerWaalsContact O-CD2 3.29Å; L102-H106 PolarHBondContact O-N 3.27Å; L102-H106 VanDerWaalsContact O-N 3.15Å
103	L	97.8	Very high	96.1	Very high	37 Å²	37	51.5 Å²	51.5	19%	0.194	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-44.3	175.5	-64.7	174.6	0	0	0	111.4	H72 L75 L99 Q100 Y105 H106 A107	H72-L103 WeakPolarHBondContact NE2-CD1 3.1Å; L75-L103 HydrophobicContact CD2-CD2 3.93Å; L99-L103 HydrophobicContact CD1-CG 4.36Å; L99-L103 HydrophobicContact CG-CD1 4.29Å; L99-L103 WeakPolarHBondContact O-CG 3.28Å; L99-L103 PolarHBondContact O-N 2.9Å; Q100-L103 PolarHBondContact O-N 3.16Å; L103-Y105 VanDerWaalsContact C-N 3.34Å; L103-Y105 PolarHBondContact O-N 3.06Å; L103-H106 PolarHBondContact O-N 3.32Å; L103-A107 VanDerWaalsContact O-CB 3.26Å; L103-A107 WeakPolarHBondContact O-CB 3.34Å; L103-A107 PolarHBondContact O-N 2.97Å
104	N	97.6	Very high	95.9	Very high	54 Å²	54	56 Å²	56	29%	0.289	28%	0.284	S	S	.	.	H	α-helix	trans	-64.3	-38	177.2	-69.3	-10	0	0	0	112.5	Q100 L101 L102 A107 G108 D217	Q100-N104 PolarHBondContact NE2-OD1 3.23Å; Q100-N104 WeakPolarHBondContact O-CB 3.39Å; Q100-N104 PolarHBondContact O-N 3.15Å; Q100-N104 PolarHBondContact O-ND2 2.68Å; Q100-N104 PolarHBondContact O-OD1 2.81Å; L101-N104 PolarHBondContact O-N 3.46Å; L102-N104 VanDerWaalsContact C-N 3.35Å; L102-N104 PolarHBondContact O-N 3.35Å; N104-A107 PolarHBondContact O-N 3.02Å; N104-G108 PolarHBondContact O-N 3.08Å; N104-D217 WeakPolarHBondContact CB-O 3.24Å; N104-D217 PolarHBondContact ND2-O 2.89Å
105	Y	96.8	Very high	95.8	Very high	3 Å²	3	53 Å²	53	1%	0.012	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-48	175.7	173	-101.3	0	0	0	111.4	F83 F87 L101 L102 L103 R109 Y169 E173 G218 F219	F83-Y105 HydrophobicContact CE2-CE1 4.29Å; F83-Y105 HydrophobicContact CZ-CE1 4.08Å; F87-Y105 HydrophobicContact CE1-CD1 4.42Å; F87-Y105 HydrophobicContact CE1-CG 4.16Å; F87-Y105 AromaticContact CZ-CD1 3.97Å; F87-Y105 HydrophobicContact CZ-CD1 3.97Å; F87-Y105 HydrophobicContact CZ-CD2 4.47Å; F87-Y105 HydrophobicContact CZ-CE1 4.16Å; F87-Y105 HydrophobicContact CZ-CG 4.07Å; L101-Y105 WeakPolarHBondContact O-CB 3.4Å; L101-Y105 PolarHBondContact O-N 3.35Å; L102-Y105 WeakPolarHBondContact O-CB 3.43Å; L102-Y105 PolarHBondContact O-N 3.24Å; L103-Y105 VanDerWaalsContact C-N 3.34Å; L103-Y105 PolarHBondContact O-N 3.06Å; Y105-R109 WeakPolarHBondContact O-CG 3.36Å; Y105-R109 PolarHBondContact O-N 2.78Å; Y105-R109 PolarHBondContact OH-NH2 3.49Å; Y105-Y169 WeakPolarHBondContact CD2-OH 3.49Å; Y105-Y169 WeakPolarHBondContact CE2-OH 3.3Å; Y105-E173 VanDerWaalsContact CE2-OE1 3.32Å; Y105-E173 WeakPolarHBondContact CE2-OE1 3.45Å; Y105-E173 PolarHBondContact OH-OE1 2.88Å; Y105-E173 PolarHBondContact OH-OE2 3.1Å; Y105-G218 WeakPolarHBondContact CA-O 3.49Å; Y105-G218 WeakPolarHBondContact CD2-O 3.46Å; Y105-F219 HydrophobicContact CD2-CD2 4.2Å; Y105-F219 AromaticContact CE2-CD2 3.92Å; Y105-F219 HydrophobicContact CE2-CD2 3.92Å; Y105-F219 AromaticContact CE2-CE2 3.93Å; Y105-F219 HydrophobicContact CE2-CE2 3.93Å
106	H	94.8	Very high	95.6	Very high	20 Å²	20	50.2 Å²	50.2	9%	0.093	26%	0.257	C	S	.	.	H	α-helix	trans	-72.4	-38.2	176.6	-74.3	-64.4	0	0	0	113.5	L75 R76 T77 L102 L103 G108 R109 K110	L75-H106 HydrophobicContact CD1-CB 3.96Å; R76-H106 PolarHBondContact O-CE1 3.15Å; T77-H106 WeakPolarHBondContact CB-NE2 3.28Å; T77-H106 PolarHBondContact OG1-NE2 3.22Å; L102-H106 PolarHBondContact O-CD2 3.33Å; L102-H106 VanDerWaalsContact O-CD2 3.29Å; L102-H106 PolarHBondContact O-N 3.27Å; L102-H106 VanDerWaalsContact O-N 3.15Å; L103-H106 PolarHBondContact O-N 3.32Å; H106-G108 VanDerWaalsContact C-N 3.34Å; H106-G108 PolarHBondContact O-N 3.39Å; H106-R109 PolarHBondContact O-N 3.1Å; H106-K110 WeakPolarHBondContact O-CG 3.39Å; H106-K110 PolarHBondContact O-N 2.78Å; H106-K110 VanDerWaalsContact O-N 3.1Å
107	A	94.3	Very high	95.3	Very high	47 Å²	47	51.6 Å²	51.6	39%	0.388	26%	0.26	S	S	.	.	H	α-helix	trans	-63.9	-39.7	175.8	0	0	0	0	0	111.7	L103 N104 R109 K110 T111	L103-A107 VanDerWaalsContact O-CB 3.26Å; L103-A107 WeakPolarHBondContact O-CB 3.34Å; L103-A107 PolarHBondContact O-N 2.97Å; N104-A107 PolarHBondContact O-N 3.02Å; A107-R109 VanDerWaalsContact C-N 3.32Å; A107-R109 PolarHBondContact O-N 3.37Å; A107-K110 PolarHBondContact O-N 3.17Å; A107-T111 WeakPolarHBondContact O-CB 3.47Å; A107-T111 VanDerWaalsContact O-CG2 3.28Å; A107-T111 WeakPolarHBondContact O-CG2 3.36Å; A107-T111 PolarHBondContact O-N 2.99Å; A107-T111 PolarHBondContact O-OG1 3.5Å
108	G	91.9	Very high	95	Very high	26 Å²	26	48.1 Å²	48.1	27%	0.268	25%	0.252	S	S	.	.	H	α-helix	trans	-59.7	-43.5	174.3	0	0	0	0	0	111.8	N104 H106 K110 T111 W112 F116	N104-G108 PolarHBondContact O-N 3.08Å; H106-G108 VanDerWaalsContact C-N 3.34Å; H106-G108 PolarHBondContact O-N 3.39Å; G108-K110 PolarHBondContact O-N 3.2Å; G108-T111 PolarHBondContact O-N 3.1Å; G108-T111 PolarHBondContact O-OG1 3.44Å; G108-W112 PolarHBondContact O-N 3.48Å; G108-F116 WeakPolarHBondContact O-CE2 3.34Å
109	R	91.9	Very high	95	Very high	35 Å²	35	48.1 Å²	48.1	13%	0.132	25%	0.252	C	S	.	.	H	α-helix	trans	-58.9	-45.6	175.8	-71.2	169.2	173.7	-153	-10.3	112.6	Y105 H106 A107 F116 Y169 E173 E303 F304	Y105-R109 WeakPolarHBondContact O-CG 3.36Å; Y105-R109 PolarHBondContact O-N 2.78Å; Y105-R109 PolarHBondContact OH-NH2 3.49Å; H106-R109 PolarHBondContact O-N 3.1Å; A107-R109 VanDerWaalsContact C-N 3.32Å; A107-R109 PolarHBondContact O-N 3.37Å; R109-F116 HydrophobicContact CB-CD1 4.45Å; R109-F116 HydrophobicContact CB-CD2 4.26Å; R109-F116 HydrophobicContact CB-CG 4.15Å; R109-F116 HydrophobicContact CG-CD1 3.83Å; R109-F116 HydrophobicContact CG-CD2 4.36Å; R109-F116 HydrophobicContact CG-CE1 3.97Å; R109-F116 HydrophobicContact CG-CE2 4.45Å; R109-F116 HydrophobicContact CG-CG 4.03Å; R109-F116 HydrophobicContact CG-CZ 4.27Å; R109-F116 WeakPolarHBondContact O-CD2 3.33Å; R109-Y169 PolarHBondContact NE-OH 3.46Å; R109-E173 IonicContact CZ-OE1 3.46Å; R109-E173 IonicContact NH2-OE1 3.78Å; R109-E173 PolarHBondContact NH2-OE1 2.83Å; R109-E303 IonicContact CZ-OE1 3.07Å; R109-E303 IonicContact NH1-OE1 2.74Å; R109-E303 PolarHBondContact NH1-OE1 3.02Å; R109-E303 IonicContact NH2-OE1 2.62Å; R109-E303 PolarHBondContact NH2-OE1 3.34Å; R109-F304 VanDerWaalsContact CZ-CE1 3.49Å
110	K	90.8	Very high	94.9	Very high	159 Å²	159	49.8 Å²	49.8	69%	0.691	26%	0.259	S	S	*	.	H	α-helix	trans	-70.7	-35	179.8	-67.8	178.7	-178.5	-175.2	0	114	H106 A107 G108 W112	H106-K110 WeakPolarHBondContact O-CG 3.39Å; H106-K110 PolarHBondContact O-N 2.78Å; H106-K110 VanDerWaalsContact O-N 3.1Å; A107-K110 PolarHBondContact O-N 3.17Å; G108-K110 PolarHBondContact O-N 3.2Å; K110-W112 VanDerWaalsContact C-N 3.33Å
111	T	92.1	Very high	94.9	Very high	94 Å²	94	44.9 Å²	44.9	58%	0.577	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	3.6	-173.3	56.9	0	0	0	0	113.9	A107 G108 K210	A107-T111 WeakPolarHBondContact O-CB 3.47Å; A107-T111 VanDerWaalsContact O-CG2 3.28Å; A107-T111 WeakPolarHBondContact O-CG2 3.36Å; A107-T111 PolarHBondContact O-N 2.99Å; A107-T111 PolarHBondContact O-OG1 3.5Å; G108-T111 PolarHBondContact O-N 3.1Å; G108-T111 PolarHBondContact O-OG1 3.44Å; T111-K210 PolarHBondContact O-NZ 3.05Å
112	W	94	Very high	94.8	Very high	19 Å²	19	47.1 Å²	47.1	7%	0.072	25%	0.252	C	S	.	.			trans	-143.1	59.9	179.3	-157.2	-3.4	0	0	0	112.6	G108 K110 E114 V115 F116 V162 V165 L207 K210 I211 I214	G108-W112 PolarHBondContact O-N 3.48Å; K110-W112 VanDerWaalsContact C-N 3.33Å; W112-E114 VanDerWaalsContact CD1-OE2 3.28Å; W112-E114 PolarHBondContact O-N 2.89Å; W112-E114 VanDerWaalsContact O-N 3.09Å; W112-V115 HydrophobicContact CD2-CB 4.16Å; W112-V115 HydrophobicContact CD2-CG2 3.45Å; W112-V115 VanDerWaalsContact CD2-CG2 3.45Å; W112-V115 HydrophobicContact CE3-CG2 3.92Å; W112-V115 HydrophobicContact CG-CB 4.2Å; W112-V115 HydrophobicContact CG-CG2 3.87Å; W112-V115 HydrophobicContact CH2-CG2 4.08Å; W112-V115 HydrophobicContact CZ2-CG2 3.61Å; W112-V115 HydrophobicContact CZ3-CG2 4.22Å; W112-V115 PolarHBondContact O-N 2.63Å; W112-F116 HydrophobicContact CB-CD2 4.1Å; W112-F116 HydrophobicContact CB-CE2 4.02Å; W112-F116 WeakPolarHBondContact O-CD2 3.32Å; W112-F116 PolarHBondContact O-N 2.85Å; W112-V162 HydrophobicContact CZ2-CG2 4.23Å; W112-V165 HydrophobicContact CH2-CB 4.23Å; W112-V165 HydrophobicContact CH2-CG1 3.67Å; W112-V165 HydrophobicContact CH2-CG2 4Å; W112-V165 HydrophobicContact CZ2-CG1 4.36Å; W112-V165 HydrophobicContact CZ2-CG2 4.41Å; W112-V165 HydrophobicContact CZ3-CG1 3.89Å; W112-L207 HydrophobicContact CH2-CD1 3.31Å; W112-L207 HydrophobicContact CZ2-CD1 3.18Å; W112-K210 HydrophobicContact CD2-CD 3.72Å; W112-K210 HydrophobicContact CE3-CB 3.93Å; W112-K210 HydrophobicContact CE3-CD 3.82Å; W112-K210 HydrophobicContact CE3-CG 4.38Å; W112-K210 HydrophobicContact CG-CD 4.23Å; W112-K210 HydrophobicContact CH2-CB 3.86Å; W112-K210 HydrophobicContact CH2-CD 4.29Å; W112-K210 HydrophobicContact CZ2-CD 4.24Å; W112-K210 HydrophobicContact CZ3-CB 3.49Å; W112-K210 VanDerWaalsContact CZ3-CB 3.49Å; W112-K210 HydrophobicContact CZ3-CD 4.09Å; W112-K210 HydrophobicContact CZ3-CG 4.38Å; W112-I211 HydrophobicContact CH2-CG1 4.24Å; W112-I214 HydrophobicContact CE3-CD1 4.16Å; W112-I214 HydrophobicContact CZ3-CD1 3.69Å
113	P	92.9	Very high	94.8	Very high	62 Å²	62	49 Å²	49	40%	0.403	26%	0.263	S	S	.	.	H	α-helix	trans	-55.5	-30.6	-176.4	23.9	-34.6	0	0	0	113.2	V115 F116 Q117	P113-V115 PolarHBondContact O-N 3.33Å; P113-V115 VanDerWaalsContact O-N 3.13Å; P113-F116 PolarHBondContact O-N 3.34Å; P113-F116 VanDerWaalsContact O-N 3.11Å; P113-Q117 WeakPolarHBondContact O-CB 3.19Å; P113-Q117 PolarHBondContact O-N 3.5Å
114	E	93.9	Very high	94.8	Very high	112 Å²	112	47.2 Å²	47.2	52%	0.523	25%	0.254	S	S	.	.	H	α-helix	trans	-58.5	-28.2	176.5	-55.4	95.2	137.6	0	0	112.8	W112 V162 R166	W112-E114 VanDerWaalsContact CD1-OE2 3.28Å; W112-E114 PolarHBondContact O-N 2.89Å; W112-E114 VanDerWaalsContact O-N 3.09Å; E114-V162 HydrophobicContact CB-CG2 4.07Å; E114-R166 PolarHBondContact O-NH1 2.77Å; E114-R166 VanDerWaalsContact O-NH1 3.09Å
115	V	94.9	Very high	94.8	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-87.8	-40.6	173.1	174.2	0	0	0	0	111.9	W112 P113 L119 V162 V165 R166	W112-V115 HydrophobicContact CD2-CB 4.16Å; W112-V115 HydrophobicContact CD2-CG2 3.45Å; W112-V115 VanDerWaalsContact CD2-CG2 3.45Å; W112-V115 HydrophobicContact CE3-CG2 3.92Å; W112-V115 HydrophobicContact CG-CB 4.2Å; W112-V115 HydrophobicContact CG-CG2 3.87Å; W112-V115 HydrophobicContact CH2-CG2 4.08Å; W112-V115 HydrophobicContact CZ2-CG2 3.61Å; W112-V115 HydrophobicContact CZ3-CG2 4.22Å; W112-V115 PolarHBondContact O-N 2.63Å; P113-V115 PolarHBondContact O-N 3.33Å; P113-V115 VanDerWaalsContact O-N 3.13Å; V115-L119 WeakPolarHBondContact O-CD1 3.26Å; V115-V162 HydrophobicContact CB-CG2 4.46Å; V115-V162 HydrophobicContact CG2-CG2 3.34Å; V115-V165 HydrophobicContact CG1-CG1 4.28Å; V115-V165 HydrophobicContact CG2-CB 4.2Å; V115-V165 HydrophobicContact CG2-CG1 3.95Å; V115-R166 HydrophobicContact CB-CG 4.33Å; V115-R166 HydrophobicContact CG1-CG 4.11Å; V115-R166 HydrophobicContact CG2-CG 4.48Å; V115-R166 WeakPolarHBondContact O-CG 3.2Å; V115-R166 PolarHBondContact O-NH1 2.82Å
116	F	93.9	Very high	94.8	Very high	16 Å²	16	51.9 Å²	51.9	7%	0.07	27%	0.273	C	S	.	.	H	α-helix	trans	-102.2	-17.5	-162.9	-62.3	-70.8	0	0	0	115	G108 R109 W112 P113 L119 Y169 F304	G108-F116 WeakPolarHBondContact O-CE2 3.34Å; R109-F116 HydrophobicContact CB-CD1 4.45Å; R109-F116 HydrophobicContact CB-CD2 4.26Å; R109-F116 HydrophobicContact CB-CG 4.15Å; R109-F116 HydrophobicContact CG-CD1 3.83Å; R109-F116 HydrophobicContact CG-CD2 4.36Å; R109-F116 HydrophobicContact CG-CE1 3.97Å; R109-F116 HydrophobicContact CG-CE2 4.45Å; R109-F116 HydrophobicContact CG-CG 4.03Å; R109-F116 HydrophobicContact CG-CZ 4.27Å; R109-F116 WeakPolarHBondContact O-CD2 3.33Å; W112-F116 HydrophobicContact CB-CD2 4.1Å; W112-F116 HydrophobicContact CB-CE2 4.02Å; W112-F116 WeakPolarHBondContact O-CD2 3.32Å; W112-F116 PolarHBondContact O-N 2.85Å; P113-F116 PolarHBondContact O-N 3.34Å; P113-F116 VanDerWaalsContact O-N 3.11Å; F116-L119 HydrophobicContact CD1-CD2 3.75Å; F116-L119 HydrophobicContact CE1-CD2 4.22Å; F116-L119 WeakPolarHBondContact O-CB 3.43Å; F116-Y169 HydrophobicContact CD1-CD1 4.46Å; F116-Y169 HydrophobicContact CD1-CE1 4.29Å; F116-Y169 AromaticContact CE1-CD1 3.72Å; F116-Y169 HydrophobicContact CE1-CD1 3.72Å; F116-Y169 AromaticContact CE1-CD2 3.61Å; F116-Y169 HydrophobicContact CE1-CD2 3.61Å; F116-Y169 AromaticContact CE1-CE1 3.55Å; F116-Y169 HydrophobicContact CE1-CE1 3.55Å; F116-Y169 AromaticContact CE1-CE2 3.45Å; F116-Y169 HydrophobicContact CE1-CE2 3.45Å; F116-Y169 VanDerWaalsContact CE1-CE2 3.45Å; F116-Y169 AromaticContact CE1-CG 3.73Å; F116-Y169 HydrophobicContact CE1-CG 3.73Å; F116-Y169 AromaticContact CE1-CZ 3.4Å; F116-Y169 AromaticContact CZ-CD2 3.8Å; F116-Y169 HydrophobicContact CZ-CD2 3.8Å; F116-Y169 HydrophobicContact CZ-CE1 4.49Å; F116-Y169 AromaticContact CZ-CE2 3.57Å; F116-Y169 HydrophobicContact CZ-CE2 3.57Å; F116-Y169 HydrophobicContact CZ-CG 4.34Å; F116-Y169 AromaticContact CZ-CZ 3.94Å; F116-F304 HydrophobicContact CD1-CE1 4.44Å
117	Q	92.1	Very high	94.9	Very high	145 Å²	145	51 Å²	51	68%	0.678	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	131.1	174.3	-170.7	175.1	15.6	0	0	110.2	P113 L119 R166	P113-Q117 WeakPolarHBondContact O-CB 3.19Å; P113-Q117 PolarHBondContact O-N 3.5Å; Q117-L119 PolarHBondContact O-N 2.92Å; Q117-R166 PolarHBondContact O-NH1 3.33Å; Q117-R166 PolarHBondContact O-NH2 3.5Å
118	D	93.6	Very high	95	Very high	70 Å²	70	48.8 Å²	48.8	37%	0.374	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	49	40.5	-177.5	-167	37	0	0	0	112.3	K120 T123 R166 C305	D118-K120 PolarHBondContact O-N 3.49Å; D118-K120 WeakPolarHBondContact OD1-CE 3.33Å; D118-K120 IonicContact OD1-NZ 3.48Å; D118-K120 PolarHBondContact OD1-NZ 3.36Å; D118-K120 IonicContact OD2-NZ 3.1Å; D118-K120 PolarHBondContact OD2-NZ 2.98Å; D118-T123 WeakPolarHBondContact O-CG2 3.22Å; D118-R166 PolarHBondContact O-NH2 2.75Å; D118-C305 PolarHBondContact OD1-SG 2.96Å
119	L	96.8	Very high	95.2	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	26%	0.263	C	S	.	.			trans	-77.9	94.4	-174.3	-179.7	58.8	0	0	0	111.7	V115 F116 Q117 R166 Y169 L170 F304	V115-L119 WeakPolarHBondContact O-CD1 3.26Å; F116-L119 HydrophobicContact CD1-CD2 3.75Å; F116-L119 HydrophobicContact CE1-CD2 4.22Å; F116-L119 WeakPolarHBondContact O-CB 3.43Å; Q117-L119 PolarHBondContact O-N 2.92Å; L119-R166 HydrophobicContact CD1-CB 3.64Å; L119-R166 HydrophobicContact CD1-CG 4Å; L119-Y169 HydrophobicContact CD2-CD1 3.95Å; L119-Y169 HydrophobicContact CD2-CG 4.49Å; L119-L170 HydrophobicContact CD1-CD1 3.92Å; L119-L170 HydrophobicContact CD1-CD2 4.06Å; L119-L170 HydrophobicContact CD1-CG 3.77Å; L119-L170 HydrophobicContact CD2-CD2 4.49Å; L119-L170 HydrophobicContact CG-CD2 3.82Å; L119-L170 HydrophobicContact CG-CG 4.05Å; L119-F304 HydrophobicContact CB-CB 3.88Å; L119-F304 HydrophobicContact CB-CD1 4.33Å; L119-F304 HydrophobicContact CB-CG 4.03Å; L119-F304 HydrophobicContact CD2-CD1 4.17Å; L119-F304 HydrophobicContact CD2-CE1 4.19Å; L119-F304 HydrophobicContact CD2-CG 4.38Å; L119-F304 HydrophobicContact CD2-CZ 4.44Å; L119-F304 HydrophobicContact CG-CG 4.42Å; L119-F304 WeakPolarHBondContact O-CB 3.45Å
120	K	97.4	Very high	95.4	Very high	42 Å²	42	53.5 Å²	53.5	18%	0.183	27%	0.271	C	S	.	.			trans	-141.6	157.2	177	65	-172.1	179.6	-136.6	0	113	D118 S122 T123 E297 F300 V301	D118-K120 PolarHBondContact O-N 3.49Å; D118-K120 WeakPolarHBondContact OD1-CE 3.33Å; D118-K120 IonicContact OD1-NZ 3.48Å; D118-K120 PolarHBondContact OD1-NZ 3.36Å; D118-K120 IonicContact OD2-NZ 3.1Å; D118-K120 PolarHBondContact OD2-NZ 2.98Å; K120-S122 WeakPolarHBondContact CE-OG 3.27Å; K120-S122 PolarHBondContact O-N 3.16Å; K120-T123 HydrophobicContact CD-CG2 4.38Å; K120-T123 HydrophobicContact CG-CG2 3.67Å; K120-T123 PolarHBondContact O-N 3.36Å; K120-T123 VanDerWaalsContact O-N 3.07Å; K120-T123 PolarHBondContact O-OG1 3.44Å; K120-E297 HydrophobicContact CB-CG 4.46Å; K120-F300 HydrophobicContact CB-CB 4.26Å; K120-V301 HydrophobicContact CB-CG2 4.24Å; K120-V301 HydrophobicContact CD-CG2 3.77Å
121	P	98	Very high	95.6	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-50.4	-46.3	-176.8	-31.5	37.4	0	0	0	115.4	T123 V124 K125 L293 L294 E297 F300	P121-T123 PolarHBondContact O-N 3.29Å; P121-V124 CarbonylContact O-C 3.56Å; P121-V124 VanDerWaalsContact O-CG2 3.27Å; P121-V124 WeakPolarHBondContact O-CG2 3.43Å; P121-V124 PolarHBondContact O-N 2.94Å; P121-K125 PolarHBondContact O-N 3.35Å; P121-L293 HydrophobicContact CB-CB 4.35Å; P121-L293 WeakPolarHBondContact CB-O 3.42Å; P121-L293 HydrophobicContact CG-CB 4.39Å; P121-L293 WeakPolarHBondContact CG-O 3.24Å; P121-L294 HydrophobicContact CB-CD2 3.98Å; P121-L294 HydrophobicContact CB-CG 4.49Å; P121-E297 HydrophobicContact CG-CB 4.45Å; P121-F300 VanDerWaalsContact CD-CD2 3.47Å; P121-F300 HydrophobicContact CG-CD2 3.41Å; P121-F300 VanDerWaalsContact CG-CD2 3.41Å; P121-F300 HydrophobicContact CG-CE2 3.77Å; P121-F300 HydrophobicContact CG-CG 4.22Å
122	S	97.8	Very high	95.9	Very high	49 Å²	49	42 Å²	42	34%	0.343	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-55	-35	177.7	54.8	0	0	0	0	113.9	K120 V124 K125 E297	K120-S122 WeakPolarHBondContact CE-OG 3.27Å; K120-S122 PolarHBondContact O-N 3.16Å; S122-V124 PolarHBondContact O-N 3.25Å; S122-K125 WeakPolarHBondContact O-CB 3.22Å; S122-K125 PolarHBondContact O-N 3.36Å; S122-E297 VanDerWaalsContact CB-OE1 3.23Å; S122-E297 WeakPolarHBondContact CB-OE1 3.47Å; S122-E297 WeakPolarHBondContact CB-OE2 3.21Å; S122-E297 PolarHBondContact N-OE2 3.21Å; S122-E297 VanDerWaalsContact OG-CD 3.26Å; S122-E297 PolarHBondContact OG-OE1 3.12Å; S122-E297 PolarHBondContact OG-OE2 3.27Å
123	T	97.6	Very high	96.1	Very high	38 Å²	38	41.1 Å²	41.1	23%	0.233	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-68.6	-20.5	-179.8	66.9	0	0	0	0	113.5	D118 K120 P121 R166	D118-T123 WeakPolarHBondContact O-CG2 3.22Å; K120-T123 HydrophobicContact CD-CG2 4.38Å; K120-T123 HydrophobicContact CG-CG2 3.67Å; K120-T123 PolarHBondContact O-N 3.36Å; K120-T123 VanDerWaalsContact O-N 3.07Å; K120-T123 PolarHBondContact O-OG1 3.44Å; P121-T123 PolarHBondContact O-N 3.29Å; T123-R166 PolarHBondContact OG1-NH2 3.24Å
124	V	97.8	Very high	96.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-114.7	14.4	178.8	-61.2	0	0	0	0	112.6	P121 S122 H126 V127 L128 R166 A167 L170	P121-V124 CarbonylContact O-C 3.56Å; P121-V124 VanDerWaalsContact O-CG2 3.27Å; P121-V124 WeakPolarHBondContact O-CG2 3.43Å; P121-V124 PolarHBondContact O-N 2.94Å; S122-V124 PolarHBondContact O-N 3.25Å; V124-H126 PolarHBondContact O-N 3.42Å; V124-H126 VanDerWaalsContact O-N 3.14Å; V124-V127 HydrophobicContact CB-CB 4.45Å; V124-V127 HydrophobicContact CB-CG2 4.29Å; V124-V127 WeakPolarHBondContact O-CA 3.28Å; V124-V127 VanDerWaalsContact O-CB 3.31Å; V124-V127 WeakPolarHBondContact O-CB 3.34Å; V124-V127 PolarHBondContact O-N 3.14Å; V124-L128 HydrophobicContact CG2-CD1 4.34Å; V124-L128 HydrophobicContact CG2-CG 4.38Å; V124-L128 PolarHBondContact O-N 3.02Å; V124-L128 VanDerWaalsContact O-N 3.15Å; V124-R166 HydrophobicContact CG1-CB 3.46Å; V124-R166 VanDerWaalsContact CG1-CB 3.46Å; V124-A167 HydrophobicContact CB-CB 4.14Å; V124-A167 HydrophobicContact CG1-CB 4.48Å; V124-A167 HydrophobicContact CG2-CB 4.1Å; V124-L170 HydrophobicContact CG2-CD1 3.57Å
125	K	97.2	Very high	96.6	Very high	90 Å²	90	33.4 Å²	33.4	39%	0.391	17%	0.17	S	C	.	.	H	α-helix	trans	-53.7	-38.6	-178.7	-169.9	-170	-177.8	-52.2	0	112.3	P121 S122 V127 L128 D129 L294	P121-K125 PolarHBondContact O-N 3.35Å; S122-K125 WeakPolarHBondContact O-CB 3.22Å; S122-K125 PolarHBondContact O-N 3.36Å; K125-V127 VanDerWaalsContact C-N 3.31Å; K125-V127 PolarHBondContact O-N 3.49Å; K125-L128 WeakPolarHBondContact O-CB 3.39Å; K125-L128 PolarHBondContact O-N 3.41Å; K125-L128 VanDerWaalsContact O-N 3.16Å; K125-D129 IonicContact NZ-OD1 3.28Å; K125-D129 PolarHBondContact NZ-OD1 2.67Å; K125-D129 IonicContact NZ-OD2 3.61Å; K125-D129 PolarHBondContact NZ-OD2 3.12Å; K125-D129 WeakPolarHBondContact O-CB 3.17Å; K125-D129 PolarHBondContact O-N 2.68Å; K125-L294 HydrophobicContact CG-CD1 4.47Å; K125-L294 HydrophobicContact CG-CD2 4.47Å
126	H	96.8	Very high	96.7	Very high	66 Å²	66	33.5 Å²	33.5	31%	0.306	17%	0.17	S	C	.	.	H	α-helix	trans	-60.3	-37.7	176.9	66.1	-87	0	0	0	112.8	V124 L130 Y159 D163	V124-H126 PolarHBondContact O-N 3.42Å; V124-H126 VanDerWaalsContact O-N 3.14Å; H126-L130 WeakPolarHBondContact O-CB 3.35Å; H126-L130 WeakPolarHBondContact O-CD1 3.48Å; H126-L130 VanDerWaalsContact O-CG 3.24Å; H126-L130 WeakPolarHBondContact O-CG 3.45Å; H126-L130 PolarHBondContact O-N 3.47Å; H126-L130 VanDerWaalsContact O-N 3.11Å; H126-Y159 AromaticContact CD2-CD1 3.68Å; H126-Y159 AromaticContact CD2-CD2 3.92Å; H126-Y159 AromaticContact CD2-CG 3.62Å; H126-Y159 AromaticContact NE2-CD2 3.46Å; H126-Y159 WeakPolarHBondContact NE2-CD2 3.36Å; H126-Y159 AromaticContact NE2-CE2 3.94Å; H126-Y159 AromaticContact NE2-CG 3.51Å; H126-D163 IonicContact CE1-OD2 2.73Å; H126-D163 PolarHBondContact CE1-OD2 3.2Å; H126-D163 VanDerWaalsContact CE1-OD2 3.28Å; H126-D163 IonicContact NE2-OD2 2.66Å; H126-D163 PolarHBondContact NE2-OD2 2.88Å; H126-D163 VanDerWaalsContact NE2-OD2 3.1Å
127	V	97.6	Very high	96.7	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.3	-43.6	174.6	-176.6	0	0	0	0	111.1	V124 K125 G131 F132 Y159 D163 N164 A167	V124-V127 HydrophobicContact CB-CB 4.45Å; V124-V127 HydrophobicContact CB-CG2 4.29Å; V124-V127 WeakPolarHBondContact O-CA 3.28Å; V124-V127 VanDerWaalsContact O-CB 3.31Å; V124-V127 WeakPolarHBondContact O-CB 3.34Å; V124-V127 PolarHBondContact O-N 3.14Å; K125-V127 VanDerWaalsContact C-N 3.31Å; K125-V127 PolarHBondContact O-N 3.49Å; V127-G131 PolarHBondContact O-N 3.02Å; V127-F132 HydrophobicContact CG1-CB 3.62Å; V127-F132 HydrophobicContact CG1-CD1 4.28Å; V127-F132 HydrophobicContact CG1-CG 4.14Å; V127-F132 PolarHBondContact O-N 3Å; V127-Y159 HydrophobicContact CG2-CD2 4.31Å; V127-Y159 HydrophobicContact CG2-CE2 3.66Å; V127-D163 HydrophobicContact CG2-CB 3.66Å; V127-N164 WeakPolarHBondContact CG1-OD1 3.25Å; V127-A167 HydrophobicContact CB-CB 4.23Å; V127-A167 HydrophobicContact CG1-CB 3.8Å
128	L	96.6	Very high	96.8	Very high	2 Å²	2	37 Å²	37	1%	0.01	19%	0.191	C	C	.	.	H	α-helix	trans	-65	-42.9	179.3	-65.1	-178.3	0	0	0	111.5	V124 K125 G131 L133 L293	V124-L128 HydrophobicContact CG2-CD1 4.34Å; V124-L128 HydrophobicContact CG2-CG 4.38Å; V124-L128 PolarHBondContact O-N 3.02Å; V124-L128 VanDerWaalsContact O-N 3.15Å; K125-L128 WeakPolarHBondContact O-CB 3.39Å; K125-L128 PolarHBondContact O-N 3.41Å; K125-L128 VanDerWaalsContact O-N 3.16Å; L128-G131 WeakPolarHBondContact O-CA 3.34Å; L128-G131 PolarHBondContact O-N 3.43Å; L128-L133 HydrophobicContact CD2-CD1 4.08Å; L128-L293 HydrophobicContact CD1-CD1 4.39Å; L128-L293 HydrophobicContact CD2-CD1 4.07Å
129	D	95.8	Very high	96.9	Very high	102 Å²	102	36 Å²	36	55%	0.545	19%	0.189	S	C	.	.	H	α-helix	trans	-67	-38.4	178.4	-69.2	-18.8	0	0	0	111.9	K125 G131	K125-D129 IonicContact NZ-OD1 3.28Å; K125-D129 PolarHBondContact NZ-OD1 2.67Å; K125-D129 IonicContact NZ-OD2 3.61Å; K125-D129 PolarHBondContact NZ-OD2 3.12Å; K125-D129 WeakPolarHBondContact O-CB 3.17Å; K125-D129 PolarHBondContact O-N 2.68Å; D129-G131 PolarHBondContact O-N 2.85Å
130	L	95.9	Very high	96.9	Very high	57 Å²	57	36.3 Å²	36.3	30%	0.298	19%	0.19	S	C	.	.	H	α-helix	trans	-67.4	-16.4	172.4	-72.6	170.8	0	0	0	112.5	H126 Y159	H126-L130 WeakPolarHBondContact O-CB 3.35Å; H126-L130 WeakPolarHBondContact O-CD1 3.48Å; H126-L130 VanDerWaalsContact O-CG 3.24Å; H126-L130 WeakPolarHBondContact O-CG 3.45Å; H126-L130 PolarHBondContact O-N 3.47Å; H126-L130 VanDerWaalsContact O-N 3.11Å; L130-Y159 HydrophobicContact CD1-CD1 4.23Å; L130-Y159 HydrophobicContact CD1-CE1 3.41Å; L130-Y159 VanDerWaalsContact CD1-CE1 3.41Å
131	G	95.6	Very high	96.8	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.01	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	65.3	43.1	-179.9	0	0	0	0	0	112	V127 L128 D129 L133 R150 M286	V127-G131 PolarHBondContact O-N 3.02Å; L128-G131 WeakPolarHBondContact O-CA 3.34Å; L128-G131 PolarHBondContact O-N 3.43Å; D129-G131 PolarHBondContact O-N 2.85Å; G131-L133 PolarHBondContact O-N 3.35Å; G131-R150 VanDerWaalsContact O-CZ 3.26Å; G131-R150 PolarHBondContact O-NE 3.42Å; G131-R150 PolarHBondContact O-NH2 3.18Å; G131-M286 WeakPolarHBondContact O-CE 3.39Å
132	F	97.4	Very high	96.8	Very high	12 Å²	12	43.4 Å²	43.4	5%	0.053	24%	0.236	C	C	.	.	S	Bend	trans	-60.8	-34.7	171.3	178.1	-90.7	0	0	0	111.6	V127 L149 R150 P151 W154 N164	V127-F132 HydrophobicContact CG1-CB 3.62Å; V127-F132 HydrophobicContact CG1-CD1 4.28Å; V127-F132 HydrophobicContact CG1-CG 4.14Å; V127-F132 PolarHBondContact O-N 3Å; F132-L149 HydrophobicContact CE1-CD2 4.48Å; F132-L149 CarbonylContact O-C 3.5Å; F132-R150 PolarHBondContact O-N 3.07Å; F132-P151 HydrophobicContact CE2-CB 4.45Å; F132-W154 HydrophobicContact CD2-CB 3.82Å; F132-W154 HydrophobicContact CE2-CB 3.89Å; F132-N164 HydrophobicContact CD1-CB 3.97Å; F132-N164 HydrophobicContact CD2-CB 4.42Å; F132-N164 VanDerWaalsContact CD2-OD1 3.23Å; F132-N164 WeakPolarHBondContact CD2-OD1 3.4Å; F132-N164 HydrophobicContact CE1-CB 3.62Å; F132-N164 HydrophobicContact CE2-CB 4.06Å; F132-N164 HydrophobicContact CG-CB 4.37Å; F132-N164 VanDerWaalsContact CG-OD1 3.24Å; F132-N164 WeakPolarHBondContact CG-OD1 3.28Å; F132-N164 HydrophobicContact CZ-CB 3.65Å
133	L	98.1	Very high	96.7	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	160.3	176.5	63.6	79.6	0	0	0	112.3	L128 G131 F148 L149 A167 L168 T171 M286	L128-L133 HydrophobicContact CD2-CD1 4.08Å; G131-L133 PolarHBondContact O-N 3.35Å; L133-F148 CarbonylContact C-O 3.52Å; L133-F148 WeakPolarHBondContact CA-O 3.29Å; L133-L149 HydrophobicContact CB-CD2 3.59Å; L133-L149 HydrophobicContact CD2-CD2 4.44Å; L133-A167 HydrophobicContact CD2-CB 3.81Å; L133-L168 HydrophobicContact CD2-CB 4.31Å; L133-T171 WeakPolarHBondContact CD1-OG1 3.38Å; L133-M286 WeakPolarHBondContact O-CE 3.27Å
134	T	98.2	Very high	96.7	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	174.2	165.1	-170.8	0	0	0	0	108.9	F148 L284 M286 W289	T134-F148 HydrophobicContact CG2-CB 4.08Å; T134-F148 HydrophobicContact CG2-CD1 4.08Å; T134-F148 PolarHBondContact N-O 2.8Å; T134-F148 PolarHBondContact O-N 2.66Å; T134-L284 HydrophobicContact CG2-CD1 4.09Å; T134-M286 HydrophobicContact CG2-CE 3.65Å; T134-M286 HydrophobicContact CG2-SD 3.61Å; T134-W289 WeakPolarHBondContact OG1-CB 3.35Å
135	V	98.4	Very high	96.7	Very high	10 Å²	10	45.9 Å²	45.9	6%	0.061	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.9	168.5	177.6	0	0	0	0	108.1	Y145 I146 L147 T171 L175 W289	V135-Y145 HydrophobicContact CG1-CD1 4.01Å; V135-Y145 HydrophobicContact CG1-CG 4.48Å; V135-I146 WeakPolarHBondContact CA-O 3.38Å; V135-L147 HydrophobicContact CG2-CD1 4.33Å; V135-T171 HydrophobicContact CG2-CG2 3.77Å; V135-L175 HydrophobicContact CG1-CD2 4.08Å; V135-L175 HydrophobicContact CG2-CD1 3.86Å; V135-L175 HydrophobicContact CG2-CD2 4.21Å; V135-L175 HydrophobicContact CG2-CG 4.31Å; V135-W289 HydrophobicContact CB-CD2 3.63Å; V135-W289 HydrophobicContact CB-CE3 3.63Å; V135-W289 HydrophobicContact CB-CG 4.1Å; V135-W289 HydrophobicContact CB-CH2 4.38Å; V135-W289 HydrophobicContact CB-CZ2 4.4Å; V135-W289 HydrophobicContact CB-CZ3 4.01Å; V135-W289 HydrophobicContact CG1-CE3 4.36Å; V135-W289 HydrophobicContact CG1-CZ3 4.33Å; V135-W289 HydrophobicContact CG2-CD2 3.54Å; V135-W289 HydrophobicContact CG2-CE3 3.92Å; V135-W289 HydrophobicContact CG2-CG 4.07Å; V135-W289 HydrophobicContact CG2-CH2 3.97Å; V135-W289 HydrophobicContact CG2-CZ2 3.62Å; V135-W289 HydrophobicContact CG2-CZ3 4.11Å
136	L	97.6	Very high	96.8	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.016	22%	0.222	C	C	.	.			trans	-65.9	138.9	175.9	-58.7	-172.7	0	0	0	109.8	R138 I146 F148 V272 L273 P274 L284	L136-R138 PolarHBondContact O-N 3.19Å; L136-R138 VanDerWaalsContact O-N 3.08Å; L136-I146 HydrophobicContact CB-CB 4.21Å; L136-I146 HydrophobicContact CD1-CB 3.91Å; L136-I146 HydrophobicContact CD1-CD1 3.93Å; L136-I146 HydrophobicContact CD1-CG2 3.74Å; L136-I146 HydrophobicContact CG-CB 4.07Å; L136-I146 HydrophobicContact CG-CG2 4.1Å; L136-I146 PolarHBondContact N-O 2.63Å; L136-F148 HydrophobicContact CD2-CB 4.29Å; L136-F148 HydrophobicContact CD2-CD1 4.49Å; L136-F148 HydrophobicContact CG-CB 4.45Å; L136-V272 WeakPolarHBondContact CD1-O 3.25Å; L136-L273 HydrophobicContact CD1-CD2 4.14Å; L136-P274 HydrophobicContact CD2-CG 3.98Å; L136-L284 HydrophobicContact CD2-CD1 4.13Å
137	P	93.8	Very high	96.9	Very high	110 Å²	110	38.5 Å²	38.5	71%	0.714	21%	0.208	S	C	*	.	S	Bend	trans	-67.6	-17.6	-166.2	26.3	-36.3	0	0	0	113.8
138	R	94.2	Very high	96.9	Very high	124 Å²	124	38.5 Å²	38.5	47%	0.468	21%	0.208	S	C	.	.	S	Bend	trans	-121.8	138	179.4	-64.3	-169.8	-67.2	-168	-4.3	110.4	L136 S271 V272	L136-R138 PolarHBondContact O-N 3.19Å; L136-R138 VanDerWaalsContact O-N 3.08Å; R138-S271 PolarHBondContact NH2-O 3.04Å; R138-V272 HydrophobicContact CB-CG1 4.5Å
139	P	96.7	Very high	97	Very high	50 Å²	50	39.6 Å²	39.6	33%	0.325	21%	0.214	S	C	.	.			trans	-67	159.9	168.8	31.4	-35.1	0	0	0	110.3	R144 Y145 V272	P139-R144 CarbonylContact C-O 3.46Å; P139-R144 VanDerWaalsContact CA-O 3.29Å; P139-R144 WeakPolarHBondContact CA-O 3.34Å; P139-Y145 HydrophobicContact CB-CD1 4.44Å; P139-V272 WeakPolarHBondContact O-CG1 3.48Å
140	D	96.7	Very high	97.1	Very high	6 Å²	6	36.5 Å²	36.5	3%	0.032	19%	0.194	C	C	.	.			trans	-67.8	173.2	170.3	83.4	-6.5	0	0	0	112.2	N142 G143 R144 I146 V272	D140-N142 PolarHBondContact O-N 3.46Å; D140-N142 WeakPolarHBondContact OD1-CA 3.1Å; D140-N142 WeakPolarHBondContact OD1-CB 3.39Å; D140-N142 PolarHBondContact OD1-N 2.89Å; D140-G143 PolarHBondContact O-N 2.94Å; D140-G143 PolarHBondContact OD1-N 3.46Å; D140-R144 PolarHBondContact N-O 3.19Å; D140-R144 WeakPolarHBondContact OD1-CB 3.35Å; D140-R144 PolarHBondContact OD1-N 3.23Å; D140-R144 IonicContact OD1-NE 2.78Å; D140-R144 PolarHBondContact OD1-NE 2.82Å; D140-R144 IonicContact OD2-CZ 2.78Å; D140-R144 IonicContact OD2-NE 3.17Å; D140-R144 PolarHBondContact OD2-NE 2.91Å; D140-R144 IonicContact OD2-NH2 3.2Å; D140-R144 PolarHBondContact OD2-NH2 3.38Å; D140-I146 HydrophobicContact CB-CD1 4.36Å; D140-V272 HydrophobicContact CB-CG2 4.44Å
141	P	96	Very high	97.2	Very high	101 Å²	101	34.7 Å²	34.7	66%	0.656	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-13.8	179.8	-27.3	36.4	0	0	0	115.5	G143 P269	P141-G143 VanDerWaalsContact C-N 3.33Å; P141-P269 HydrophobicContact CG-CG 3.67Å
142	N	96.3	Very high	97.2	Very high	90 Å²	90	35.7 Å²	35.7	48%	0.481	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	7.9	175.1	-61.6	-68.1	0	0	0	112.4	K45 D140 R144 N184	K45-N142 PolarHBondContact NZ-O 3.43Å; D140-N142 PolarHBondContact O-N 3.46Å; D140-N142 WeakPolarHBondContact OD1-CA 3.1Å; D140-N142 WeakPolarHBondContact OD1-CB 3.39Å; D140-N142 PolarHBondContact OD1-N 2.89Å; N142-R144 VanDerWaalsContact C-N 3.35Å; N142-R144 HydrophobicContact CB-CG 4.15Å; N142-R144 PolarHBondContact ND2-NH2 2.89Å; N142-N184 PolarHBondContact O-OD1 3.37Å
143	G	97	Very high	97.2	Very high	23 Å²	23	39.6 Å²	39.6	24%	0.237	21%	0.213	C	C	.	.	S	Bend	trans	75.2	20	-178.9	0	0	0	0	0	113.8	D140 P141 N184	D140-G143 PolarHBondContact O-N 2.94Å; D140-G143 PolarHBondContact OD1-N 3.46Å; P141-G143 VanDerWaalsContact C-N 3.33Å; G143-N184 VanDerWaalsContact O-CB 3.28Å; G143-N184 WeakPolarHBondContact O-CB 3.32Å; G143-N184 PolarHBondContact O-ND2 2.87Å
144	R	98	Very high	97.1	Very high	37 Å²	37	39.8 Å²	39.8	14%	0.14	21%	0.214	C	C	.	.			trans	-96.2	123.7	-177.6	-53.8	176	-66.9	-171.9	2.7	110.1	P139 D140 N142 N184 G185 V187	P139-R144 CarbonylContact C-O 3.46Å; P139-R144 VanDerWaalsContact CA-O 3.29Å; P139-R144 WeakPolarHBondContact CA-O 3.34Å; D140-R144 PolarHBondContact N-O 3.19Å; D140-R144 WeakPolarHBondContact OD1-CB 3.35Å; D140-R144 PolarHBondContact OD1-N 3.23Å; D140-R144 IonicContact OD1-NE 2.78Å; D140-R144 PolarHBondContact OD1-NE 2.82Å; D140-R144 IonicContact OD2-CZ 2.78Å; D140-R144 IonicContact OD2-NE 3.17Å; D140-R144 PolarHBondContact OD2-NE 2.91Å; D140-R144 IonicContact OD2-NH2 3.2Å; D140-R144 PolarHBondContact OD2-NH2 3.38Å; N142-R144 VanDerWaalsContact C-N 3.35Å; N142-R144 HydrophobicContact CB-CG 4.15Å; N142-R144 PolarHBondContact ND2-NH2 2.89Å; R144-N184 HydrophobicContact CG-CB 4.09Å; R144-N184 WeakPolarHBondContact CG-O 3.22Å; R144-G185 WeakPolarHBondContact CA-O 3.46Å; R144-G185 WeakPolarHBondContact CB-O 3.4Å; R144-V187 HydrophobicContact CB-CG2 4.11Å
145	Y	97.7	Very high	96.8	Very high	79 Å²	79	44.9 Å²	44.9	31%	0.31	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	146.1	169.5	-78.5	-75	0	0	0	111.2	V135 P139 L175 V187	V135-Y145 HydrophobicContact CG1-CD1 4.01Å; V135-Y145 HydrophobicContact CG1-CG 4.48Å; P139-Y145 HydrophobicContact CB-CD1 4.44Å; Y145-L175 HydrophobicContact CD2-CD2 4.37Å; Y145-L175 HydrophobicContact CG-CD2 4.19Å; Y145-V187 PolarHBondContact O-N 3.07Å
146	I	98.6	Very high	96.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	106.6	-179.5	-58.6	154.6	0	0	0	108.1	V135 L136 D140 F148 V187 L189 I268 V272	V135-I146 WeakPolarHBondContact CA-O 3.38Å; L136-I146 HydrophobicContact CB-CB 4.21Å; L136-I146 HydrophobicContact CD1-CB 3.91Å; L136-I146 HydrophobicContact CD1-CD1 3.93Å; L136-I146 HydrophobicContact CD1-CG2 3.74Å; L136-I146 HydrophobicContact CG-CB 4.07Å; L136-I146 HydrophobicContact CG-CG2 4.1Å; L136-I146 PolarHBondContact N-O 2.63Å; D140-I146 HydrophobicContact CB-CD1 4.36Å; I146-F148 PolarHBondContact O-N 3.27Å; I146-V187 CarbonylContact C-O 3.52Å; I146-V187 WeakPolarHBondContact CA-O 3.41Å; I146-V187 HydrophobicContact CG1-CB 4.28Å; I146-L189 HydrophobicContact CG2-CB 3.86Å; I146-I268 HydrophobicContact CD1-CG2 3.59Å; I146-I268 HydrophobicContact CG2-CD1 4.28Å; I146-V272 HydrophobicContact CD1-CB 4.31Å; I146-V272 HydrophobicContact CD1-CG2 3.55Å
147	L	98.6	Very high	96.3	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	115.4	168.6	171.1	58.5	0	0	0	108.1	V135 L149 L168 T171 L172 V187 I188 L189	V135-L147 HydrophobicContact CG2-CD1 4.33Å; L147-L149 HydrophobicContact CD1-CD2 4.04Å; L147-L149 HydrophobicContact CD2-CD2 4.4Å; L147-L149 HydrophobicContact CG-CD2 4.06Å; L147-L149 HydrophobicContact CG-CG 4.36Å; L147-L168 HydrophobicContact CD2-CD1 3.45Å; L147-L168 VanDerWaalsContact CD2-CD1 3.45Å; L147-T171 HydrophobicContact CD1-CG2 3.73Å; L147-L172 HydrophobicContact CD2-CD2 4.4Å; L147-V187 PolarHBondContact N-O 2.91Å; L147-I188 HydrophobicContact CD2-CG1 4.42Å; L147-I188 WeakPolarHBondContact O-CA 3.43Å; L147-L189 PolarHBondContact O-N 3.31Å
148	F	98.6	Very high	96.4	Very high	1 Å²	1	52.8 Å²	52.8	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	120.6	-177.3	-174.7	-139.7	0	0	0	111.3	L133 T134 L136 I146 R150 L189 D191 Y277 L284	L133-F148 CarbonylContact C-O 3.52Å; L133-F148 WeakPolarHBondContact CA-O 3.29Å; T134-F148 HydrophobicContact CG2-CB 4.08Å; T134-F148 HydrophobicContact CG2-CD1 4.08Å; T134-F148 PolarHBondContact N-O 2.8Å; T134-F148 PolarHBondContact O-N 2.66Å; L136-F148 HydrophobicContact CD2-CB 4.29Å; L136-F148 HydrophobicContact CD2-CD1 4.49Å; L136-F148 HydrophobicContact CG-CB 4.45Å; I146-F148 PolarHBondContact O-N 3.27Å; F148-R150 HydrophobicContact CD1-CG 4.48Å; F148-R150 HydrophobicContact CE1-CG 3.86Å; F148-R150 HydrophobicContact CE2-CG 4.3Å; F148-R150 HydrophobicContact CZ-CG 3.73Å; F148-L189 CarbonylContact C-O 3.3Å; F148-L189 WeakPolarHBondContact CA-O 3.47Å; F148-L189 HydrophobicContact CD2-CB 3.82Å; F148-L189 HydrophobicContact CD2-CD2 3.72Å; F148-L189 HydrophobicContact CD2-CG 3.54Å; F148-L189 VanDerWaalsContact CD2-O 3.32Å; F148-L189 WeakPolarHBondContact CD2-O 3.45Å; F148-L189 HydrophobicContact CE2-CB 4.47Å; F148-L189 HydrophobicContact CE2-CD2 3.9Å; F148-L189 HydrophobicContact CE2-CG 3.73Å; F148-D191 HydrophobicContact CE2-CB 3.79Å; F148-D191 HydrophobicContact CZ-CB 3.78Å; F148-Y277 HydrophobicContact CE1-CD2 4.41Å; F148-Y277 AromaticContact CE1-CE2 3.6Å; F148-Y277 HydrophobicContact CE1-CE2 3.6Å; F148-Y277 AromaticContact CE1-CZ 3.84Å; F148-Y277 HydrophobicContact CZ-CD2 4.33Å; F148-Y277 AromaticContact CZ-CE1 3.99Å; F148-Y277 HydrophobicContact CZ-CE1 3.99Å; F148-Y277 AromaticContact CZ-CE2 3.55Å; F148-Y277 HydrophobicContact CZ-CE2 3.55Å; F148-Y277 AromaticContact CZ-CZ 3.35Å; F148-Y277 WeakPolarHBondContact CZ-OH 3.47Å; F148-L284 HydrophobicContact CD1-CD1 4.08Å; F148-L284 HydrophobicContact CD1-CD2 4.3Å; F148-L284 HydrophobicContact CE1-CD1 4.32Å; F148-L284 HydrophobicContact CE1-CD2 3.79Å
149	L	98.4	Very high	96.4	Very high	25 Å²	25	47.8 Å²	47.8	13%	0.131	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	142.1	-178.1	-55.9	179.1	0	0	0	110.6	F132 L133 L147 I188 L189 A190 D191	F132-L149 HydrophobicContact CE1-CD2 4.48Å; F132-L149 CarbonylContact O-C 3.5Å; L133-L149 HydrophobicContact CB-CD2 3.59Å; L133-L149 HydrophobicContact CD2-CD2 4.44Å; L147-L149 HydrophobicContact CD1-CD2 4.04Å; L147-L149 HydrophobicContact CD2-CD2 4.4Å; L147-L149 HydrophobicContact CG-CD2 4.06Å; L147-L149 HydrophobicContact CG-CG 4.36Å; L149-I188 HydrophobicContact CD1-CG2 3.89Å; L149-I188 HydrophobicContact CG-CG2 4.32Å; L149-L189 PolarHBondContact N-O 3.16Å; L149-A190 HydrophobicContact CB-CB 4.24Å; L149-A190 CarbonylContact O-C 3.51Å; L149-A190 VanDerWaalsContact O-CA 3.3Å; L149-A190 WeakPolarHBondContact O-CA 3.47Å; L149-D191 PolarHBondContact O-N 3.36Å
150	R	97.9	Very high	96.4	Very high	36 Å²	36	48.9 Å²	48.9	14%	0.136	26%	0.262	C	S	.	.			trans	-130.6	76.9	176.2	-58.7	-170.7	-59.9	-177.9	3	110.1	G131 F132 F148 G152 K153 D191 M286	G131-R150 VanDerWaalsContact O-CZ 3.26Å; G131-R150 PolarHBondContact O-NE 3.42Å; G131-R150 PolarHBondContact O-NH2 3.18Å; F132-R150 PolarHBondContact O-N 3.07Å; F148-R150 HydrophobicContact CD1-CG 4.48Å; F148-R150 HydrophobicContact CE1-CG 3.86Å; F148-R150 HydrophobicContact CE2-CG 4.3Å; F148-R150 HydrophobicContact CZ-CG 3.73Å; R150-G152 PolarHBondContact O-N 2.83Å; R150-K153 HydrophobicContact CB-CG 3.8Å; R150-K153 WeakPolarHBondContact O-CB 3.49Å; R150-K153 PolarHBondContact O-N 3.24Å; R150-D191 HydrophobicContact CG-CB 4.38Å; R150-M286 VanDerWaalsContact CZ-SD 3.55Å
151	P	96.9	Very high	96.3	Very high	20 Å²	20	50.3 Å²	50.3	13%	0.13	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-57.2	-26.1	-174.6	-27.1	36.6	0	0	0	114.7	F132 K153 W154 D191 Y192 V195	F132-P151 HydrophobicContact CE2-CB 4.45Å; P151-K153 PolarHBondContact O-N 3.24Å; P151-W154 PolarHBondContact O-N 2.92Å; P151-D191 VanDerWaalsContact CD-O 3.28Å; P151-D191 WeakPolarHBondContact CD-O 3.17Å; P151-Y192 HydrophobicContact CG-CD2 4.4Å; P151-Y192 HydrophobicContact CG-CE1 4.37Å; P151-Y192 HydrophobicContact CG-CE2 4.1Å; P151-V195 HydrophobicContact CB-CG2 3.85Å
152	G	96.3	Very high	96.3	Very high	21 Å²	21	46.7 Å²	46.7	22%	0.216	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-68.2	-10.5	175	0	0	0	0	0	114.9	R150 T193	R150-G152 PolarHBondContact O-N 2.83Å; G152-T193 WeakPolarHBondContact CA-O 3.29Å
153	K	96.3	Very high	96.3	Very high	95 Å²	95	43.7 Å²	43.7	41%	0.413	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-79.3	-19.8	172.6	-63.7	-62.3	-177.2	-178	0	113.2	R150 P151	R150-K153 HydrophobicContact CB-CG 3.8Å; R150-K153 WeakPolarHBondContact O-CB 3.49Å; R150-K153 PolarHBondContact O-N 3.24Å; P151-K153 PolarHBondContact O-N 3.24Å
154	W	96.7	Very high	96.4	Very high	3 Å²	3	42.7 Å²	42.7	1%	0.011	22%	0.217	C	C	.	.			trans	-74.3	131.9	174.8	170.7	53.1	0	0	0	111	F132 P151 P156 Y159 F161 N164 Q199 N202 P203	F132-W154 HydrophobicContact CD2-CB 3.82Å; F132-W154 HydrophobicContact CE2-CB 3.89Å; P151-W154 PolarHBondContact O-N 2.92Å; W154-P156 HydrophobicContact CD2-CG 4.12Å; W154-P156 HydrophobicContact CE3-CG 4.07Å; W154-P156 HydrophobicContact CH2-CB 4.11Å; W154-P156 HydrophobicContact CH2-CG 3.8Å; W154-P156 HydrophobicContact CZ2-CB 3.73Å; W154-P156 HydrophobicContact CZ2-CG 3.75Å; W154-P156 HydrophobicContact CZ3-CG 3.93Å; W154-Y159 AromaticContact CD1-CE1 3.81Å; W154-Y159 AromaticContact CD1-CE2 3.62Å; W154-Y159 AromaticContact CD1-CZ 3.4Å; W154-Y159 PolarHBondContact NE1-O 2.98Å; W154-F161 AromaticContact CD2-CD2 3.73Å; W154-F161 HydrophobicContact CD2-CD2 3.73Å; W154-F161 HydrophobicContact CD2-CE2 4.36Å; W154-F161 AromaticContact CE2-CD2 3.85Å; W154-F161 AromaticContact CE3-CD2 3.54Å; W154-F161 HydrophobicContact CE3-CD2 3.54Å; W154-F161 AromaticContact CE3-CE2 3.93Å; W154-F161 HydrophobicContact CE3-CE2 3.93Å; W154-F161 HydrophobicContact CH2-CB 3.78Å; W154-F161 AromaticContact CH2-CD2 3.49Å; W154-F161 HydrophobicContact CH2-CD2 3.49Å; W154-F161 VanDerWaalsContact CH2-CD2 3.49Å; W154-F161 HydrophobicContact CH2-CE2 4.47Å; W154-F161 HydrophobicContact CH2-CG 4.05Å; W154-F161 HydrophobicContact CZ2-CB 3.58Å; W154-F161 AromaticContact CZ2-CD2 3.77Å; W154-F161 HydrophobicContact CZ2-CD2 3.77Å; W154-F161 HydrophobicContact CZ2-CG 4.18Å; W154-F161 AromaticContact CZ3-CD2 3.4Å; W154-F161 HydrophobicContact CZ3-CD2 3.4Å; W154-F161 AromaticContact CZ3-CE2 3.98Å; W154-F161 HydrophobicContact CZ3-CE2 3.98Å; W154-F161 HydrophobicContact CZ3-CG 4.37Å; W154-N164 VanDerWaalsContact CD1-ND2 3.34Å; W154-Q199 HydrophobicContact CE3-CB 4.07Å; W154-Q199 HydrophobicContact CE3-CG 3.89Å; W154-Q199 HydrophobicContact CZ3-CB 4.15Å; W154-Q199 HydrophobicContact CZ3-CG 4.38Å; W154-Q199 WeakPolarHBondContact CZ3-O 3.33Å; W154-Q199 PolarHBondContact O-NE2 3.28Å; W154-Q199 VanDerWaalsContact O-NE2 3.11Å; W154-N202 HydrophobicContact CH2-CB 3.65Å; W154-N202 WeakPolarHBondContact CH2-OD1 3.28Å; W154-N202 HydrophobicContact CZ3-CB 4.37Å; W154-P203 HydrophobicContact CH2-CG 4.32Å; W154-P203 HydrophobicContact CZ3-CG 4.23Å
155	K	92.9	Very high	96.3	Very high	108 Å²	108	41.1 Å²	41.1	47%	0.47	21%	0.212	S	C	.	.			trans	-114	105.5	176.1	-67.8	172	176.3	-179.5	0	108.3	N157 D158	K155-N157 PolarHBondContact O-N 2.98Å; K155-D158 HydrophobicContact CB-CB 4.04Å; K155-D158 WeakPolarHBondContact CB-OD2 3.49Å; K155-D158 WeakPolarHBondContact CD-OD2 3.04Å; K155-D158 IonicContact NZ-OD2 3.3Å; K155-D158 PolarHBondContact O-N 3.29Å
156	P	93	Very high	96.4	Very high	28 Å²	28	38.3 Å²	38.3	18%	0.182	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-23.2	-175	-26.5	33.3	0	0	0	115.5	W154 Q199	W154-P156 HydrophobicContact CD2-CG 4.12Å; W154-P156 HydrophobicContact CE3-CG 4.07Å; W154-P156 HydrophobicContact CH2-CB 4.11Å; W154-P156 HydrophobicContact CH2-CG 3.8Å; W154-P156 HydrophobicContact CZ2-CB 3.73Å; W154-P156 HydrophobicContact CZ2-CG 3.75Å; W154-P156 HydrophobicContact CZ3-CG 3.93Å; P156-Q199 HydrophobicContact CG-CG 4.35Å
157	N	92.6	Very high	96.4	Very high	160 Å²	160	38.3 Å²	38.3	86%	0.856	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	-17.4	178.6	-65.9	-12.6	0	0	0	113.3	K155	K155-N157 PolarHBondContact O-N 2.98Å
158	D	94.8	Very high	96.3	Very high	101 Å²	101	39.4 Å²	39.4	54%	0.54	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-40.5	-175.7	-65.4	9.1	0	0	0	110.4	K155	K155-D158 HydrophobicContact CB-CB 4.04Å; K155-D158 WeakPolarHBondContact CB-OD2 3.49Å; K155-D158 WeakPolarHBondContact CD-OD2 3.04Å; K155-D158 IonicContact NZ-OD2 3.3Å; K155-D158 PolarHBondContact O-N 3.29Å
159	Y	95.4	Very high	96.3	Very high	19 Å²	19	39.5 Å²	39.5	8%	0.075	21%	0.206	C	C	.	.	S	Bend	trans	-161.4	155.6	-179.3	68.9	-87.4	0	0	0	111.8	H126 V127 L130 W154 D163 N164	H126-Y159 AromaticContact CD2-CD1 3.68Å; H126-Y159 AromaticContact CD2-CD2 3.92Å; H126-Y159 AromaticContact CD2-CG 3.62Å; H126-Y159 AromaticContact NE2-CD2 3.46Å; H126-Y159 WeakPolarHBondContact NE2-CD2 3.36Å; H126-Y159 AromaticContact NE2-CE2 3.94Å; H126-Y159 AromaticContact NE2-CG 3.51Å; V127-Y159 HydrophobicContact CG2-CD2 4.31Å; V127-Y159 HydrophobicContact CG2-CE2 3.66Å; L130-Y159 HydrophobicContact CD1-CD1 4.23Å; L130-Y159 HydrophobicContact CD1-CE1 3.41Å; L130-Y159 VanDerWaalsContact CD1-CE1 3.41Å; W154-Y159 AromaticContact CD1-CE1 3.81Å; W154-Y159 AromaticContact CD1-CE2 3.62Å; W154-Y159 AromaticContact CD1-CZ 3.4Å; W154-Y159 PolarHBondContact NE1-O 2.98Å; Y159-D163 HydrophobicContact CD2-CB 3.69Å; Y159-D163 HydrophobicContact CE2-CB 3.96Å; Y159-N164 WeakPolarHBondContact CE2-OD1 3.5Å; Y159-N164 PolarHBondContact OH-OD1 2.99Å
160	P	94.7	Very high	96.3	Very high	74 Å²	74	38.3 Å²	38.3	48%	0.481	20%	0.2	S	C	.	.			trans	-68.4	151.4	-177.5	29.3	-36.7	0	0	0	112.6	V162 D163	P160-V162 HydrophobicContact CB-CG1 3.96Å; P160-V162 HydrophobicContact CG-CG1 3.79Å; P160-V162 PolarHBondContact O-N 3.28Å; P160-D163 PolarHBondContact O-N 3.09Å
161	F	95	Very high	96.3	Very high	35 Å²	35	36.6 Å²	36.6	15%	0.154	19%	0.194	C	C	.	.	H	α-helix	trans	-57.7	-26.7	-179.8	-168.6	-94.1	0	0	0	113.5	W154 D163 N164 V165 P203 L207 I211	W154-F161 AromaticContact CD2-CD2 3.73Å; W154-F161 HydrophobicContact CD2-CD2 3.73Å; W154-F161 HydrophobicContact CD2-CE2 4.36Å; W154-F161 AromaticContact CE2-CD2 3.85Å; W154-F161 AromaticContact CE3-CD2 3.54Å; W154-F161 HydrophobicContact CE3-CD2 3.54Å; W154-F161 AromaticContact CE3-CE2 3.93Å; W154-F161 HydrophobicContact CE3-CE2 3.93Å; W154-F161 HydrophobicContact CH2-CB 3.78Å; W154-F161 AromaticContact CH2-CD2 3.49Å; W154-F161 HydrophobicContact CH2-CD2 3.49Å; W154-F161 VanDerWaalsContact CH2-CD2 3.49Å; W154-F161 HydrophobicContact CH2-CE2 4.47Å; W154-F161 HydrophobicContact CH2-CG 4.05Å; W154-F161 HydrophobicContact CZ2-CB 3.58Å; W154-F161 AromaticContact CZ2-CD2 3.77Å; W154-F161 HydrophobicContact CZ2-CD2 3.77Å; W154-F161 HydrophobicContact CZ2-CG 4.18Å; W154-F161 AromaticContact CZ3-CD2 3.4Å; W154-F161 HydrophobicContact CZ3-CD2 3.4Å; W154-F161 AromaticContact CZ3-CE2 3.98Å; W154-F161 HydrophobicContact CZ3-CE2 3.98Å; W154-F161 HydrophobicContact CZ3-CG 4.37Å; F161-D163 PolarHBondContact O-N 3.18Å; F161-N164 VanDerWaalsContact O-CB 3.3Å; F161-N164 WeakPolarHBondContact O-CB 3.18Å; F161-N164 PolarHBondContact O-N 3.25Å; F161-N164 PolarHBondContact O-ND2 3.42Å; F161-V165 HydrophobicContact CD1-CG2 3.94Å; F161-V165 HydrophobicContact CE1-CG2 3.88Å; F161-V165 PolarHBondContact O-N 3.43Å; F161-P203 HydrophobicContact CD2-CG 4.03Å; F161-P203 HydrophobicContact CE2-CG 4.18Å; F161-P203 HydrophobicContact CG-CG 4.17Å; F161-P203 HydrophobicContact CZ-CG 4.48Å; F161-L207 HydrophobicContact CB-CD2 3.99Å; F161-L207 HydrophobicContact CD1-CD2 3.44Å; F161-L207 VanDerWaalsContact CD1-CD2 3.44Å; F161-L207 HydrophobicContact CD1-CG 4.19Å; F161-L207 HydrophobicContact CE1-CD2 4.3Å; F161-L207 HydrophobicContact CG-CD2 4Å; F161-I211 HydrophobicContact CD1-CD1 4.37Å; F161-I211 HydrophobicContact CE1-CD1 3.6Å; F161-I211 HydrophobicContact CZ-CD1 4.45Å
162	V	95.8	Very high	96.4	Very high	26 Å²	26	35.7 Å²	35.7	16%	0.158	19%	0.188	C	C	.	.	H	α-helix	trans	-56.4	-31.3	-178.8	72.5	0	0	0	0	112.4	W112 E114 V115 P160 N164 V165 R166	W112-V162 HydrophobicContact CZ2-CG2 4.23Å; E114-V162 HydrophobicContact CB-CG2 4.07Å; V115-V162 HydrophobicContact CB-CG2 4.46Å; V115-V162 HydrophobicContact CG2-CG2 3.34Å; P160-V162 HydrophobicContact CB-CG1 3.96Å; P160-V162 HydrophobicContact CG-CG1 3.79Å; P160-V162 PolarHBondContact O-N 3.28Å; V162-N164 VanDerWaalsContact C-N 3.27Å; V162-N164 PolarHBondContact O-N 2.86Å; V162-V165 CarbonylContact O-C 3.55Å; V162-V165 WeakPolarHBondContact O-CA 3.3Å; V162-V165 WeakPolarHBondContact O-CB 3.1Å; V162-V165 PolarHBondContact O-N 2.9Å; V162-R166 WeakPolarHBondContact O-CG 3.36Å; V162-R166 PolarHBondContact O-N 3.46Å
163	D	97.6	Very high	96.5	Very high	27 Å²	27	35.2 Å²	35.2	14%	0.144	18%	0.18	C	C	.	.	H	α-helix	trans	-68.4	-30	179.1	-57.4	-12.9	0	0	0	111.8	H126 V127 Y159 P160 F161 V165 R166 A167	H126-D163 IonicContact CE1-OD2 2.73Å; H126-D163 PolarHBondContact CE1-OD2 3.2Å; H126-D163 VanDerWaalsContact CE1-OD2 3.28Å; H126-D163 IonicContact NE2-OD2 2.66Å; H126-D163 PolarHBondContact NE2-OD2 2.88Å; H126-D163 VanDerWaalsContact NE2-OD2 3.1Å; V127-D163 HydrophobicContact CG2-CB 3.66Å; Y159-D163 HydrophobicContact CD2-CB 3.69Å; Y159-D163 HydrophobicContact CE2-CB 3.96Å; P160-D163 PolarHBondContact O-N 3.09Å; F161-D163 PolarHBondContact O-N 3.18Å; D163-V165 VanDerWaalsContact C-N 3.3Å; D163-V165 PolarHBondContact O-N 2.98Å; D163-R166 WeakPolarHBondContact O-CB 3.3Å; D163-R166 PolarHBondContact O-N 2.93Å; D163-A167 PolarHBondContact O-N 3.11Å
164	N	97.8	Very high	96.5	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.011	17%	0.167	C	C	.	.	H	α-helix	trans	-66.4	-35.1	170.9	-58.1	-59	0	0	0	111.6	V127 F132 W154 Y159 F161 V162 L168	V127-N164 WeakPolarHBondContact CG1-OD1 3.25Å; F132-N164 HydrophobicContact CD1-CB 3.97Å; F132-N164 HydrophobicContact CD2-CB 4.42Å; F132-N164 VanDerWaalsContact CD2-OD1 3.23Å; F132-N164 WeakPolarHBondContact CD2-OD1 3.4Å; F132-N164 HydrophobicContact CE1-CB 3.62Å; F132-N164 HydrophobicContact CE2-CB 4.06Å; F132-N164 HydrophobicContact CG-CB 4.37Å; F132-N164 VanDerWaalsContact CG-OD1 3.24Å; F132-N164 WeakPolarHBondContact CG-OD1 3.28Å; F132-N164 HydrophobicContact CZ-CB 3.65Å; W154-N164 VanDerWaalsContact CD1-ND2 3.34Å; Y159-N164 WeakPolarHBondContact CE2-OD1 3.5Å; Y159-N164 PolarHBondContact OH-OD1 2.99Å; F161-N164 VanDerWaalsContact O-CB 3.3Å; F161-N164 WeakPolarHBondContact O-CB 3.18Å; F161-N164 PolarHBondContact O-N 3.25Å; F161-N164 PolarHBondContact O-ND2 3.42Å; V162-N164 VanDerWaalsContact C-N 3.27Å; V162-N164 PolarHBondContact O-N 2.86Å; N164-L168 VanDerWaalsContact O-CB 3.31Å; N164-L168 WeakPolarHBondContact O-CB 3.34Å; N164-L168 PolarHBondContact O-N 2.9Å
165	V	97.5	Very high	96.6	Very high	4 Å²	4	32.4 Å²	32.4	2%	0.024	17%	0.168	C	C	.	.	H	α-helix	trans	-69.7	-40.4	175.3	-176.2	0	0	0	0	110.5	W112 V115 F161 V162 D163 L168 Y169 I211 I214	W112-V165 HydrophobicContact CH2-CB 4.23Å; W112-V165 HydrophobicContact CH2-CG1 3.67Å; W112-V165 HydrophobicContact CH2-CG2 4Å; W112-V165 HydrophobicContact CZ2-CG1 4.36Å; W112-V165 HydrophobicContact CZ2-CG2 4.41Å; W112-V165 HydrophobicContact CZ3-CG1 3.89Å; V115-V165 HydrophobicContact CG1-CG1 4.28Å; V115-V165 HydrophobicContact CG2-CB 4.2Å; V115-V165 HydrophobicContact CG2-CG1 3.95Å; F161-V165 HydrophobicContact CD1-CG2 3.94Å; F161-V165 HydrophobicContact CE1-CG2 3.88Å; F161-V165 PolarHBondContact O-N 3.43Å; V162-V165 CarbonylContact O-C 3.55Å; V162-V165 WeakPolarHBondContact O-CA 3.3Å; V162-V165 WeakPolarHBondContact O-CB 3.1Å; V162-V165 PolarHBondContact O-N 2.9Å; D163-V165 VanDerWaalsContact C-N 3.3Å; D163-V165 PolarHBondContact O-N 2.98Å; V165-L168 WeakPolarHBondContact O-CB 3.27Å; V165-L168 PolarHBondContact O-N 2.84Å; V165-Y169 WeakPolarHBondContact O-CB 3.36Å; V165-Y169 PolarHBondContact O-N 3.15Å; V165-I211 HydrophobicContact CG2-CD1 4.07Å; V165-I211 HydrophobicContact CG2-CG1 4.04Å; V165-I214 HydrophobicContact CG1-CD1 4.15Å
166	R	98.2	Very high	96.8	Very high	20 Å²	20	27.3 Å²	27.3	8%	0.075	15%	0.146	C	C	.	.	H	α-helix	trans	-57.1	-51.4	173.2	-67.1	174	64.6	92.9	0.8	111.1	E114 V115 Q117 D118 L119 T123 V124 V162 D163 L168 Y169 L170	E114-R166 PolarHBondContact O-NH1 2.77Å; E114-R166 VanDerWaalsContact O-NH1 3.09Å; V115-R166 HydrophobicContact CB-CG 4.33Å; V115-R166 HydrophobicContact CG1-CG 4.11Å; V115-R166 HydrophobicContact CG2-CG 4.48Å; V115-R166 WeakPolarHBondContact O-CG 3.2Å; V115-R166 PolarHBondContact O-NH1 2.82Å; Q117-R166 PolarHBondContact O-NH1 3.33Å; Q117-R166 PolarHBondContact O-NH2 3.5Å; D118-R166 PolarHBondContact O-NH2 2.75Å; L119-R166 HydrophobicContact CD1-CB 3.64Å; L119-R166 HydrophobicContact CD1-CG 4Å; T123-R166 PolarHBondContact OG1-NH2 3.24Å; V124-R166 HydrophobicContact CG1-CB 3.46Å; V124-R166 VanDerWaalsContact CG1-CB 3.46Å; V162-R166 WeakPolarHBondContact O-CG 3.36Å; V162-R166 PolarHBondContact O-N 3.46Å; D163-R166 WeakPolarHBondContact O-CB 3.3Å; D163-R166 PolarHBondContact O-N 2.93Å; R166-L168 VanDerWaalsContact C-N 3.33Å; R166-L168 PolarHBondContact O-N 2.64Å; R166-Y169 PolarHBondContact O-N 2.92Å; R166-L170 WeakPolarHBondContact O-CG 3.07Å; R166-L170 PolarHBondContact O-N 3Å
167	A	98.4	Very high	96.9	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.6	-40	177.7	0	0	0	0	0	112.7	V124 V127 L133 D163 T171	V124-A167 HydrophobicContact CB-CB 4.14Å; V124-A167 HydrophobicContact CG1-CB 4.48Å; V124-A167 HydrophobicContact CG2-CB 4.1Å; V127-A167 HydrophobicContact CB-CB 4.23Å; V127-A167 HydrophobicContact CG1-CB 3.8Å; L133-A167 HydrophobicContact CD2-CB 3.81Å; D163-A167 PolarHBondContact O-N 3.11Å; A167-T171 WeakPolarHBondContact O-CB 3.2Å; A167-T171 PolarHBondContact O-N 2.94Å; A167-T171 PolarHBondContact O-OG1 3.3Å
168	L	98.3	Very high	97.1	Very high	22 Å²	22	24.2 Å²	24.2	12%	0.115	13%	0.128	C	C	.	.	H	α-helix	trans	-61.4	-46	174.6	173.6	62.7	0	0	0	111	L133 L147 N164 V165 R166 T171 L172	L133-L168 HydrophobicContact CD2-CB 4.31Å; L147-L168 HydrophobicContact CD2-CD1 3.45Å; L147-L168 VanDerWaalsContact CD2-CD1 3.45Å; N164-L168 VanDerWaalsContact O-CB 3.31Å; N164-L168 WeakPolarHBondContact O-CB 3.34Å; N164-L168 PolarHBondContact O-N 2.9Å; V165-L168 WeakPolarHBondContact O-CB 3.27Å; V165-L168 PolarHBondContact O-N 2.84Å; R166-L168 VanDerWaalsContact C-N 3.33Å; R166-L168 PolarHBondContact O-N 2.64Å; L168-T171 WeakPolarHBondContact O-CB 3.25Å; L168-T171 PolarHBondContact O-N 3Å; L168-L172 HydrophobicContact CD1-CD1 4.35Å; L168-L172 HydrophobicContact CD1-CG 4.27Å; L168-L172 HydrophobicContact CG-CD1 4.26Å; L168-L172 WeakPolarHBondContact O-CG 3.42Å; L168-L172 PolarHBondContact O-N 2.91Å
169	Y	98	Very high	97.3	Very high	4 Å²	4	20.1 Å²	20.1	2%	0.016	11%	0.106	C	C	.	.	H	α-helix	trans	-65.9	-44.9	-178	-159.4	-83.5	0	0	0	111.9	Y105 R109 F116 L119 V165 R166 T171 L172 E173 I214 F219 F304	Y105-Y169 WeakPolarHBondContact CD2-OH 3.49Å; Y105-Y169 WeakPolarHBondContact CE2-OH 3.3Å; R109-Y169 PolarHBondContact NE-OH 3.46Å; F116-Y169 HydrophobicContact CD1-CD1 4.46Å; F116-Y169 HydrophobicContact CD1-CE1 4.29Å; F116-Y169 AromaticContact CE1-CD1 3.72Å; F116-Y169 HydrophobicContact CE1-CD1 3.72Å; F116-Y169 AromaticContact CE1-CD2 3.61Å; F116-Y169 HydrophobicContact CE1-CD2 3.61Å; F116-Y169 AromaticContact CE1-CE1 3.55Å; F116-Y169 HydrophobicContact CE1-CE1 3.55Å; F116-Y169 AromaticContact CE1-CE2 3.45Å; F116-Y169 HydrophobicContact CE1-CE2 3.45Å; F116-Y169 VanDerWaalsContact CE1-CE2 3.45Å; F116-Y169 AromaticContact CE1-CG 3.73Å; F116-Y169 HydrophobicContact CE1-CG 3.73Å; F116-Y169 AromaticContact CE1-CZ 3.4Å; F116-Y169 AromaticContact CZ-CD2 3.8Å; F116-Y169 HydrophobicContact CZ-CD2 3.8Å; F116-Y169 HydrophobicContact CZ-CE1 4.49Å; F116-Y169 AromaticContact CZ-CE2 3.57Å; F116-Y169 HydrophobicContact CZ-CE2 3.57Å; F116-Y169 HydrophobicContact CZ-CG 4.34Å; F116-Y169 AromaticContact CZ-CZ 3.94Å; L119-Y169 HydrophobicContact CD2-CD1 3.95Å; L119-Y169 HydrophobicContact CD2-CG 4.49Å; V165-Y169 WeakPolarHBondContact O-CB 3.36Å; V165-Y169 PolarHBondContact O-N 3.15Å; R166-Y169 PolarHBondContact O-N 2.92Å; Y169-T171 VanDerWaalsContact C-N 3.25Å; Y169-T171 PolarHBondContact O-N 3.36Å; Y169-L172 PolarHBondContact O-N 3.18Å; Y169-L172 VanDerWaalsContact O-N 3.1Å; Y169-E173 HydrophobicContact CD1-CG 3.71Å; Y169-E173 HydrophobicContact CE1-CG 3.6Å; Y169-E173 WeakPolarHBondContact CE1-OE1 3.37Å; Y169-E173 WeakPolarHBondContact O-CG 3.4Å; Y169-E173 PolarHBondContact O-N 3.11Å; Y169-I214 HydrophobicContact CD2-CD1 4.33Å; Y169-I214 HydrophobicContact CD2-CG2 4.08Å; Y169-I214 HydrophobicContact CE2-CG2 4.17Å; Y169-F219 HydrophobicContact CD1-CE2 4.44Å; Y169-F219 HydrophobicContact CD2-CD2 4.29Å; Y169-F219 HydrophobicContact CE1-CD2 4.32Å; Y169-F219 AromaticContact CE1-CE2 3.92Å; Y169-F219 HydrophobicContact CE1-CE2 3.92Å; Y169-F219 AromaticContact CE2-CD2 3.63Å; Y169-F219 HydrophobicContact CE2-CD2 3.63Å; Y169-F219 HydrophobicContact CE2-CE2 4.04Å; Y169-F219 AromaticContact CZ-CD2 3.66Å; Y169-F219 AromaticContact CZ-CE2 3.72Å; Y169-F304 HydrophobicContact CD1-CZ 4.29Å; Y169-F304 HydrophobicContact CE1-CE1 4.06Å; Y169-F304 AromaticContact CE1-CZ 3.87Å; Y169-F304 HydrophobicContact CE1-CZ 3.87Å
170	L	98.4	Very high	97.4	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-55.7	-42.5	172.9	-70.3	169	0	0	0	111.6	L119 V124 R166 E173 K174 F300	L119-L170 HydrophobicContact CD1-CD1 3.92Å; L119-L170 HydrophobicContact CD1-CD2 4.06Å; L119-L170 HydrophobicContact CD1-CG 3.77Å; L119-L170 HydrophobicContact CD2-CD2 4.49Å; L119-L170 HydrophobicContact CG-CD2 3.82Å; L119-L170 HydrophobicContact CG-CG 4.05Å; V124-L170 HydrophobicContact CG2-CD1 3.57Å; R166-L170 WeakPolarHBondContact O-CG 3.07Å; R166-L170 PolarHBondContact O-N 3Å; L170-E173 PolarHBondContact O-N 3.46Å; L170-K174 PolarHBondContact O-N 3.18Å; L170-F300 HydrophobicContact CB-CE1 4.21Å; L170-F300 HydrophobicContact CB-CZ 4.35Å; L170-F300 HydrophobicContact CD2-CB 4.13Å; L170-F300 HydrophobicContact CD2-CD1 3.18Å; L170-F300 HydrophobicContact CD2-CD2 4.23Å; L170-F300 HydrophobicContact CD2-CE1 3.46Å; L170-F300 VanDerWaalsContact CD2-CE1 3.46Å; L170-F300 HydrophobicContact CD2-CE2 4.46Å; L170-F300 HydrophobicContact CD2-CG 3.59Å; L170-F300 HydrophobicContact CD2-CZ 4.1Å; L170-F300 HydrophobicContact CG-CE1 4.46Å
171	T	98.6	Very high	97.6	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-63.6	-42.6	176.3	-64.1	0	0	0	0	111.9	L133 V135 L147 A167 L168 Y169 K174 L175 W289	L133-T171 WeakPolarHBondContact CD1-OG1 3.38Å; V135-T171 HydrophobicContact CG2-CG2 3.77Å; L147-T171 HydrophobicContact CD1-CG2 3.73Å; A167-T171 WeakPolarHBondContact O-CB 3.2Å; A167-T171 PolarHBondContact O-N 2.94Å; A167-T171 PolarHBondContact O-OG1 3.3Å; L168-T171 WeakPolarHBondContact O-CB 3.25Å; L168-T171 PolarHBondContact O-N 3Å; Y169-T171 VanDerWaalsContact C-N 3.25Å; Y169-T171 PolarHBondContact O-N 3.36Å; T171-K174 PolarHBondContact O-N 3.41Å; T171-L175 HydrophobicContact CG2-CD1 3.81Å; T171-L175 HydrophobicContact CG2-CG 4.37Å; T171-L175 WeakPolarHBondContact O-CB 3.35Å; T171-L175 VanDerWaalsContact O-CG 3.27Å; T171-L175 WeakPolarHBondContact O-CG 3.36Å; T171-L175 PolarHBondContact O-N 3.23Å; T171-W289 HydrophobicContact CG2-CZ2 3.82Å; T171-W289 PolarHBondContact OG1-NE1 2.87Å
172	L	98.3	Very high	97.7	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-66.2	-40.8	177.1	-68.3	176.1	0	0	0	112.2	L147 L168 Y169 K174 L175 I176 L186 I214 L215 F219 I221	L147-L172 HydrophobicContact CD2-CD2 4.4Å; L168-L172 HydrophobicContact CD1-CD1 4.35Å; L168-L172 HydrophobicContact CD1-CG 4.27Å; L168-L172 HydrophobicContact CG-CD1 4.26Å; L168-L172 WeakPolarHBondContact O-CG 3.42Å; L168-L172 PolarHBondContact O-N 2.91Å; Y169-L172 PolarHBondContact O-N 3.18Å; Y169-L172 VanDerWaalsContact O-N 3.1Å; L172-K174 VanDerWaalsContact C-N 3.32Å; L172-K174 PolarHBondContact O-N 3.06Å; L172-L175 PolarHBondContact O-N 3.47Å; L172-I176 WeakPolarHBondContact O-CB 3.4Å; L172-I176 WeakPolarHBondContact O-CG2 3.49Å; L172-I176 PolarHBondContact O-N 3.39Å; L172-L186 HydrophobicContact CD2-CD1 3.82Å; L172-I214 HydrophobicContact CD1-CG2 4.42Å; L172-L215 HydrophobicContact CD1-CD2 3.98Å; L172-F219 VanDerWaalsContact C-CZ 3.45Å; L172-F219 HydrophobicContact CB-CD1 4.23Å; L172-F219 HydrophobicContact CB-CE1 3.73Å; L172-F219 HydrophobicContact CB-CE2 4.07Å; L172-F219 HydrophobicContact CB-CZ 3.65Å; L172-I221 HydrophobicContact CD2-CG2 4.43Å
173	E	97.6	Very high	97.9	Very high	12 Å²	12	16.6 Å²	16.6	6%	0.056	8%	0.083	C	C	.	.	H	α-helix	trans	-61.8	-37.7	175.1	-74.2	-69.7	180	0	0	112.1	Y105 R109 Y169 L170 I176 Q177 F219 F300 F304	Y105-E173 VanDerWaalsContact CE2-OE1 3.32Å; Y105-E173 WeakPolarHBondContact CE2-OE1 3.45Å; Y105-E173 PolarHBondContact OH-OE1 2.88Å; Y105-E173 PolarHBondContact OH-OE2 3.1Å; R109-E173 IonicContact CZ-OE1 3.46Å; R109-E173 IonicContact NH2-OE1 3.78Å; R109-E173 PolarHBondContact NH2-OE1 2.83Å; Y169-E173 HydrophobicContact CD1-CG 3.71Å; Y169-E173 HydrophobicContact CE1-CG 3.6Å; Y169-E173 WeakPolarHBondContact CE1-OE1 3.37Å; Y169-E173 WeakPolarHBondContact O-CG 3.4Å; Y169-E173 PolarHBondContact O-N 3.11Å; L170-E173 PolarHBondContact O-N 3.46Å; E173-I176 WeakPolarHBondContact O-CG2 3.36Å; E173-Q177 WeakPolarHBondContact O-CG 3.42Å; E173-F219 HydrophobicContact CG-CE2 3.83Å; E173-F219 HydrophobicContact CG-CZ 4.01Å; E173-F219 WeakPolarHBondContact OE1-CE2 3.42Å; E173-F300 HydrophobicContact CB-CE1 3.93Å; E173-F304 HydrophobicContact CG-CE2 4.19Å; E173-F304 HydrophobicContact CG-CZ 3.85Å
174	K	97.8	Very high	97.9	Very high	32 Å²	32	15.7 Å²	15.7	14%	0.139	8%	0.078	C	C	.	.	H	α-helix	trans	-71.4	-43.7	173.4	-164.7	53.4	169.3	178	0	112.1	L170 T171 L172 I176 Q177 W289 L292 L293 C296 E299 F300	L170-K174 PolarHBondContact O-N 3.18Å; T171-K174 PolarHBondContact O-N 3.41Å; L172-K174 VanDerWaalsContact C-N 3.32Å; L172-K174 PolarHBondContact O-N 3.06Å; K174-I176 VanDerWaalsContact C-N 3.31Å; K174-I176 PolarHBondContact O-N 2.83Å; K174-Q177 PolarHBondContact O-N 3.45Å; K174-W289 HydrophobicContact CB-CH2 4.28Å; K174-W289 HydrophobicContact CB-CZ2 4.16Å; K174-W289 HydrophobicContact CG-CH2 4.06Å; K174-W289 HydrophobicContact CG-CZ2 4.33Å; K174-L292 HydrophobicContact CD-CD2 4.47Å; K174-L292 HydrophobicContact CG-CD2 3.84Å; K174-L293 HydrophobicContact CB-CD2 4.02Å; K174-L293 HydrophobicContact CG-CD2 4.34Å; K174-C296 WeakPolarHBondContact CE-SG 3.42Å; K174-C296 PolarHBondContact NZ-SG 3.35Å; K174-E299 VanDerWaalsContact NZ-CD 3.27Å; K174-E299 IonicContact NZ-OE1 3.86Å; K174-E299 PolarHBondContact NZ-OE1 3.09Å; K174-E299 IonicContact NZ-OE2 3.7Å; K174-E299 PolarHBondContact NZ-OE2 2.94Å; K174-F300 HydrophobicContact CB-CZ 4.31Å
175	L	98	Very high	97.9	Very high	6 Å²	6	15.6 Å²	15.6	3%	0.031	8%	0.077	C	C	.	.	H	α-helix	trans	-67.5	-26.3	-177.1	-77.2	174.2	0	0	0	114	V135 Y145 T171 L172 Q177 P178 T181 L186 W289	V135-L175 HydrophobicContact CG1-CD2 4.08Å; V135-L175 HydrophobicContact CG2-CD1 3.86Å; V135-L175 HydrophobicContact CG2-CD2 4.21Å; V135-L175 HydrophobicContact CG2-CG 4.31Å; Y145-L175 HydrophobicContact CD2-CD2 4.37Å; Y145-L175 HydrophobicContact CG-CD2 4.19Å; T171-L175 HydrophobicContact CG2-CD1 3.81Å; T171-L175 HydrophobicContact CG2-CG 4.37Å; T171-L175 WeakPolarHBondContact O-CB 3.35Å; T171-L175 VanDerWaalsContact O-CG 3.27Å; T171-L175 WeakPolarHBondContact O-CG 3.36Å; T171-L175 PolarHBondContact O-N 3.23Å; L172-L175 PolarHBondContact O-N 3.47Å; L175-Q177 VanDerWaalsContact C-N 3.32Å; L175-P178 WeakPolarHBondContact O-CD 3.49Å; L175-T181 WeakPolarHBondContact O-CB 3.09Å; L175-T181 WeakPolarHBondContact O-CG2 3.4Å; L175-T181 PolarHBondContact O-OG1 3.07Å; L175-L186 HydrophobicContact CB-CD1 4.35Å; L175-L186 HydrophobicContact CB-CD2 4.48Å; L175-L186 HydrophobicContact CD1-CD1 3.8Å; L175-L186 HydrophobicContact CD1-CD2 4.07Å; L175-W289 HydrophobicContact CD2-CH2 3.77Å; L175-W289 HydrophobicContact CD2-CZ2 4.32Å; L175-W289 HydrophobicContact CD2-CZ3 4.45Å; L175-W289 HydrophobicContact CG-CH2 3.98Å; L175-W289 HydrophobicContact CG-CZ2 4.08Å
176	I	97.6	Very high	97.9	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.005	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-12.6	-179.4	-165.6	62.6	0	0	0	113.5	R86 L172 E173 K174 Q182 F219 P220 I221	R86-I176 HydrophobicContact CB-CG1 4.3Å; R86-I176 HydrophobicContact CG-CG1 4.09Å; L172-I176 WeakPolarHBondContact O-CB 3.4Å; L172-I176 WeakPolarHBondContact O-CG2 3.49Å; L172-I176 PolarHBondContact O-N 3.39Å; E173-I176 WeakPolarHBondContact O-CG2 3.36Å; K174-I176 VanDerWaalsContact C-N 3.31Å; K174-I176 PolarHBondContact O-N 2.83Å; I176-Q182 HydrophobicContact CD1-CB 4.48Å; I176-Q182 HydrophobicContact CD1-CG 3.68Å; I176-Q182 HydrophobicContact CG1-CG 4.3Å; I176-Q182 PolarHBondContact O-NE2 2.88Å; I176-F219 HydrophobicContact CB-CE1 4.04Å; I176-F219 HydrophobicContact CB-CZ 4.47Å; I176-F219 HydrophobicContact CG1-CE1 4.39Å; I176-F219 HydrophobicContact CG2-CE1 4.05Å; I176-F219 HydrophobicContact CG2-CZ 3.99Å; I176-P220 WeakPolarHBondContact CD1-O 3.41Å; I176-P220 HydrophobicContact CG1-CG 4.34Å; I176-I221 HydrophobicContact CB-CD1 4.46Å; I176-I221 HydrophobicContact CD1-CD1 3.55Å
177	Q	95.4	Very high	98	Very high	73 Å²	73	14.5 Å²	14.5	34%	0.341	7%	0.073	S	C	.	.	S	Bend	trans	-60.6	-48.7	-177.7	-60.7	178.8	-5.8	0	0	112.7	E173 K174 L175 Q182 E299	E173-Q177 WeakPolarHBondContact O-CG 3.42Å; K174-Q177 PolarHBondContact O-N 3.45Å; L175-Q177 VanDerWaalsContact C-N 3.32Å; Q177-Q182 PolarHBondContact O-NE2 3.1Å; Q177-E299 PolarHBondContact NE2-OE2 3.17Å
178	P	96.9	Very high	98	Very high	50 Å²	50	14.9 Å²	14.9	33%	0.325	8%	0.075	S	C	.	.	S	Bend	trans	-68.4	135.6	178.5	-18.2	33.8	0	0	0	112.1	L175 E180 T181 Q182	L175-P178 WeakPolarHBondContact O-CD 3.49Å; P178-E180 WeakPolarHBondContact CB-OE2 3.31Å; P178-E180 PolarHBondContact O-N 3.41Å; P178-T181 PolarHBondContact O-N 3.03Å; P178-Q182 PolarHBondContact O-N 3.33Å
179	E	97.9	Very high	98	Very high	16 Å²	16	13.9 Å²	13.9	8%	0.075	7%	0.069	C	C	.	.	H	α-helix	trans	-63.6	-32.8	-179.4	-66.1	-166.6	-132.2	0	0	112.2	Y34 T37 L38 R89 T181 Q182 V183	Y34-E179 WeakPolarHBondContact CE2-OE1 3.39Å; Y34-E179 VanDerWaalsContact OH-CD 3.29Å; Y34-E179 PolarHBondContact OH-OE1 3.21Å; Y34-E179 PolarHBondContact OH-OE2 2.89Å; T37-E179 PolarHBondContact N-OE1 3.22Å; T37-E179 WeakPolarHBondContact OG1-CB 3.3Å; T37-E179 VanDerWaalsContact OG1-CG 3.23Å; T37-E179 WeakPolarHBondContact OG1-CG 3.33Å; T37-E179 PolarHBondContact OG1-OE1 3.38Å; L38-E179 HydrophobicContact CD2-CB 3.54Å; L38-E179 HydrophobicContact CG-CB 4.01Å; R89-E179 IonicContact CZ-OE2 3.53Å; R89-E179 VanDerWaalsContact NH1-CG 3.3Å; R89-E179 IonicContact NH1-OE2 3.59Å; R89-E179 PolarHBondContact NH1-OE2 3.42Å; R89-E179 IonicContact NH2-OE2 2.78Å; R89-E179 PolarHBondContact NH2-OE2 2.83Å; E179-T181 VanDerWaalsContact C-N 3.28Å; E179-T181 PolarHBondContact O-N 2.91Å; E179-Q182 WeakPolarHBondContact O-CB 3.24Å; E179-Q182 PolarHBondContact O-N 3.26Å; E179-Q182 VanDerWaalsContact O-N 3.1Å; E179-V183 PolarHBondContact O-N 2.93Å; E179-V183 VanDerWaalsContact O-N 3.1Å
180	E	98	Very high	98	Very high	69 Å²	69	13.9 Å²	13.9	32%	0.322	7%	0.07	S	C	.	.	H	α-helix	trans	-61.4	-38.4	177.6	-54.8	89.9	158.8	0	0	111	L38 L42 P178 Q182 V183 N184	L38-E180 HydrophobicContact CD2-CG 4.37Å; L42-E180 HydrophobicContact CD1-CB 3.79Å; L42-E180 HydrophobicContact CD1-CG 3.36Å; P178-E180 WeakPolarHBondContact CB-OE2 3.31Å; P178-E180 PolarHBondContact O-N 3.41Å; E180-Q182 VanDerWaalsContact C-N 3.33Å; E180-Q182 PolarHBondContact O-N 3.26Å; E180-V183 PolarHBondContact O-N 3.11Å; E180-N184 VanDerWaalsContact O-CB 3.27Å; E180-N184 WeakPolarHBondContact O-CB 3.47Å; E180-N184 VanDerWaalsContact O-CG 3.3Å; E180-N184 PolarHBondContact O-N 2.81Å; E180-N184 PolarHBondContact O-ND2 3.19Å
181	T	98.3	Very high	98	Very high	1 Å²	1	14.5 Å²	14.5	1%	0.006	7%	0.073	C	C	.	.	H	α-helix	trans	-66.9	-36.8	175.9	-56.2	0	0	0	0	111.4	L175 P178 E179 V183 G185 L186 I221	L175-T181 WeakPolarHBondContact O-CB 3.09Å; L175-T181 WeakPolarHBondContact O-CG2 3.4Å; L175-T181 PolarHBondContact O-OG1 3.07Å; P178-T181 PolarHBondContact O-N 3.03Å; E179-T181 VanDerWaalsContact C-N 3.28Å; E179-T181 PolarHBondContact O-N 2.91Å; T181-V183 VanDerWaalsContact C-N 3.26Å; T181-V183 PolarHBondContact O-N 3Å; T181-G185 VanDerWaalsContact O-CA 3.3Å; T181-G185 WeakPolarHBondContact O-CA 3.41Å; T181-G185 PolarHBondContact O-N 3.06Å; T181-L186 HydrophobicContact CG2-CD2 3.66Å; T181-L186 HydrophobicContact CG2-CG 4.19Å; T181-I221 HydrophobicContact CG2-CD1 3.94Å
182	Q	98.4	Very high	97.9	Very high	10 Å²	10	16.1 Å²	16.1	5%	0.047	8%	0.08	C	C	.	.	H	α-helix	trans	-62.3	-37.8	176.5	-56.5	166.1	20.5	0	0	110.7	R89 I176 Q177 P178 E179 E180	R89-Q182 HydrophobicContact CB-CB 4.37Å; R89-Q182 VanDerWaalsContact CD-OE1 3.25Å; I176-Q182 HydrophobicContact CD1-CB 4.48Å; I176-Q182 HydrophobicContact CD1-CG 3.68Å; I176-Q182 HydrophobicContact CG1-CG 4.3Å; I176-Q182 PolarHBondContact O-NE2 2.88Å; Q177-Q182 PolarHBondContact O-NE2 3.1Å; P178-Q182 PolarHBondContact O-N 3.33Å; E179-Q182 WeakPolarHBondContact O-CB 3.24Å; E179-Q182 PolarHBondContact O-N 3.26Å; E179-Q182 VanDerWaalsContact O-N 3.1Å; E180-Q182 VanDerWaalsContact C-N 3.33Å; E180-Q182 PolarHBondContact O-N 3.26Å
183	V	98.4	Very high	97.9	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-81.6	-40.7	179.6	178.7	0	0	0	0	113.7	L38 L42 K45 A46 L50 E179 E180 T181 R222	L38-V183 HydrophobicContact CD1-CG2 3.75Å; L38-V183 HydrophobicContact CD2-CG2 3.84Å; L38-V183 HydrophobicContact CG-CG2 4.47Å; L42-V183 HydrophobicContact CD2-CG1 4.29Å; K45-V183 HydrophobicContact CB-CG1 4.35Å; K45-V183 HydrophobicContact CD-CG1 4.14Å; K45-V183 HydrophobicContact CG-CG1 4.13Å; A46-V183 HydrophobicContact CB-CG1 4.1Å; A46-V183 HydrophobicContact CB-CG2 3.98Å; L50-V183 HydrophobicContact CD1-CB 4.47Å; L50-V183 HydrophobicContact CD1-CG1 4.5Å; L50-V183 HydrophobicContact CD1-CG2 4.14Å; E179-V183 PolarHBondContact O-N 2.93Å; E179-V183 VanDerWaalsContact O-N 3.1Å; E180-V183 PolarHBondContact O-N 3.11Å; T181-V183 VanDerWaalsContact C-N 3.26Å; T181-V183 PolarHBondContact O-N 3Å; V183-R222 PolarHBondContact O-NH1 3.45Å
184	N	98.4	Very high	97.7	Very high	8 Å²	8	22.1 Å²	22.1	4%	0.043	13%	0.129	C	C	.	.	H	α-helix	trans	-84.5	-33.8	-176.2	-66.2	-32.4	0	0	0	112.1	L42 K45 N142 G143 R144 E180 K224	L42-N184 VanDerWaalsContact CD2-OD1 3.28Å; L42-N184 WeakPolarHBondContact CD2-OD1 3.47Å; K45-N184 PolarHBondContact NZ-OD1 2.99Å; N142-N184 PolarHBondContact O-OD1 3.37Å; G143-N184 VanDerWaalsContact O-CB 3.28Å; G143-N184 WeakPolarHBondContact O-CB 3.32Å; G143-N184 PolarHBondContact O-ND2 2.87Å; R144-N184 HydrophobicContact CG-CB 4.09Å; R144-N184 WeakPolarHBondContact CG-O 3.22Å; E180-N184 VanDerWaalsContact O-CB 3.27Å; E180-N184 WeakPolarHBondContact O-CB 3.47Å; E180-N184 VanDerWaalsContact O-CG 3.3Å; E180-N184 PolarHBondContact O-N 2.81Å; E180-N184 PolarHBondContact O-ND2 3.19Å; N184-K224 WeakPolarHBondContact O-CG 3.49Å
185	G	97.8	Very high	97.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.127	C	C	.	.			trans	79.5	-173.9	-171.1	0	0	0	0	0	113.1	R144 T181 R222	R144-G185 WeakPolarHBondContact CA-O 3.46Å; R144-G185 WeakPolarHBondContact CB-O 3.4Å; T181-G185 VanDerWaalsContact O-CA 3.3Å; T181-G185 WeakPolarHBondContact O-CA 3.41Å; T181-G185 PolarHBondContact O-N 3.06Å; G185-R222 CarbonylContact C-O 3.54Å; G185-R222 WeakPolarHBondContact CA-O 3.44Å
186	L	97.9	Very high	97.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	155.3	-178.7	-66.3	-178.1	0	0	0	112.3	L172 L175 T181 I221 R222 I223 K224	L172-L186 HydrophobicContact CD2-CD1 3.82Å; L175-L186 HydrophobicContact CB-CD1 4.35Å; L175-L186 HydrophobicContact CB-CD2 4.48Å; L175-L186 HydrophobicContact CD1-CD1 3.8Å; L175-L186 HydrophobicContact CD1-CD2 4.07Å; T181-L186 HydrophobicContact CG2-CD2 3.66Å; T181-L186 HydrophobicContact CG2-CG 4.19Å; L186-I221 HydrophobicContact CB-CG1 4.49Å; L186-I221 HydrophobicContact CD1-CD1 3.75Å; L186-I221 HydrophobicContact CD1-CG1 3.49Å; L186-I221 VanDerWaalsContact CD1-CG1 3.49Å; L186-I221 HydrophobicContact CG-CD1 3.79Å; L186-I221 HydrophobicContact CG-CG1 3.78Å; L186-R222 PolarHBondContact N-O 3.28Å; L186-I223 HydrophobicContact CB-CD1 4.26Å; L186-I223 CarbonylContact O-C 3.57Å; L186-K224 PolarHBondContact O-N 3.29Å
187	V	98.6	Very high	97.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	135.7	163.9	173.3	0	0	0	0	108.3	R144 Y145 I146 L147 A225 N227 I268	R144-V187 HydrophobicContact CB-CG2 4.11Å; Y145-V187 PolarHBondContact O-N 3.07Å; I146-V187 CarbonylContact C-O 3.52Å; I146-V187 WeakPolarHBondContact CA-O 3.41Å; I146-V187 HydrophobicContact CG1-CB 4.28Å; L147-V187 PolarHBondContact N-O 2.91Å; V187-A225 HydrophobicContact CG1-CB 4.28Å; V187-A225 HydrophobicContact CG2-CB 4.4Å; V187-N227 VanDerWaalsContact CG1-ND2 3.31Å; V187-N227 WeakPolarHBondContact CG1-ND2 3.48Å; V187-I268 HydrophobicContact CG1-CD1 3.77Å; V187-I268 HydrophobicContact CG1-CG1 4.16Å
188	I	98.6	Very high	96.8	Very high	8 Å²	8	28.3 Å²	28.3	4%	0.041	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	130.5	169.7	-61.1	175.7	0	0	0	107.6	L147 L149 L215 I223 A225 V226 N227	L147-I188 HydrophobicContact CD2-CG1 4.42Å; L147-I188 WeakPolarHBondContact O-CA 3.43Å; L149-I188 HydrophobicContact CD1-CG2 3.89Å; L149-I188 HydrophobicContact CG-CG2 4.32Å; I188-L215 HydrophobicContact CD1-CD1 4.46Å; I188-I223 HydrophobicContact CD1-CD1 4.07Å; I188-I223 HydrophobicContact CD1-CG2 4.13Å; I188-I223 HydrophobicContact CG1-CD1 4.43Å; I188-I223 HydrophobicContact CG1-CG2 4.36Å; I188-A225 PolarHBondContact N-O 3.5Å; I188-V226 HydrophobicContact CB-CG1 4.23Å; I188-V226 HydrophobicContact CB-CG2 4.31Å; I188-V226 HydrophobicContact CD1-CG2 4.3Å; I188-V226 HydrophobicContact CG2-CG1 4.19Å; I188-V226 WeakPolarHBondContact O-CA 3.49Å; I188-N227 PolarHBondContact O-N 2.89Å
189	L	98.7	Very high	96.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.2	164.7	176.5	60.3	0	0	0	107.5	I146 L147 F148 L149 N227 I229 L264 I268 L273	I146-L189 HydrophobicContact CG2-CB 3.86Å; L147-L189 PolarHBondContact O-N 3.31Å; F148-L189 CarbonylContact C-O 3.3Å; F148-L189 WeakPolarHBondContact CA-O 3.47Å; F148-L189 HydrophobicContact CD2-CB 3.82Å; F148-L189 HydrophobicContact CD2-CD2 3.72Å; F148-L189 HydrophobicContact CD2-CG 3.54Å; F148-L189 VanDerWaalsContact CD2-O 3.32Å; F148-L189 WeakPolarHBondContact CD2-O 3.45Å; F148-L189 HydrophobicContact CE2-CB 4.47Å; F148-L189 HydrophobicContact CE2-CD2 3.9Å; F148-L189 HydrophobicContact CE2-CG 3.73Å; L149-L189 PolarHBondContact N-O 3.16Å; L189-N227 CarbonylContact C-O 3.6Å; L189-N227 WeakPolarHBondContact CA-O 3.35Å; L189-N227 HydrophobicContact CD1-CB 3.98Å; L189-I229 HydrophobicContact CD1-CD1 4.27Å; L189-I229 HydrophobicContact CD1-CG1 4.43Å; L189-I229 HydrophobicContact CD1-CG2 4.17Å; L189-L264 HydrophobicContact CD1-CD1 3.62Å; L189-L264 HydrophobicContact CD1-CD2 4.5Å; L189-I268 HydrophobicContact CB-CD1 4.04Å; L189-I268 HydrophobicContact CD1-CD1 4.28Å; L189-I268 HydrophobicContact CD2-CD1 4.33Å; L189-I268 HydrophobicContact CG-CD1 4.44Å; L189-L273 HydrophobicContact CD2-CD2 3.71Å
190	A	98.4	Very high	96.1	Very high	4 Å²	4	27.4 Å²	27.4	3%	0.033	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	118.1	179.4	0	0	0	0	0	111.2	L149 Y192 N227 I228 I229	L149-A190 HydrophobicContact CB-CB 4.24Å; L149-A190 CarbonylContact O-C 3.51Å; L149-A190 VanDerWaalsContact O-CA 3.3Å; L149-A190 WeakPolarHBondContact O-CA 3.47Å; A190-Y192 HydrophobicContact CB-CD2 4.05Å; A190-Y192 HydrophobicContact CB-CE2 3.69Å; A190-N227 PolarHBondContact N-O 3.15Å; A190-I228 HydrophobicContact CB-CG1 4.45Å; A190-I228 WeakPolarHBondContact O-CA 3.46Å; A190-I229 PolarHBondContact O-N 3.22Å
191	D	98.1	Very high	95.4	Very high	13 Å²	13	28 Å²	28	7%	0.07	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	109	173.9	-179.9	11.6	0	0	0	110.4	F148 L149 R150 P151 T193 I229 N230 Y277	F148-D191 HydrophobicContact CE2-CB 3.79Å; F148-D191 HydrophobicContact CZ-CB 3.78Å; L149-D191 PolarHBondContact O-N 3.36Å; R150-D191 HydrophobicContact CG-CB 4.38Å; P151-D191 VanDerWaalsContact CD-O 3.28Å; P151-D191 WeakPolarHBondContact CD-O 3.17Å; D191-T193 VanDerWaalsContact C-N 3.26Å; D191-T193 PolarHBondContact O-N 2.92Å; D191-T193 VanDerWaalsContact OD1-CB 3.26Å; D191-T193 WeakPolarHBondContact OD1-CB 3.1Å; D191-T193 PolarHBondContact OD1-N 3.14Å; D191-T193 PolarHBondContact OD1-OG1 2.96Å; D191-I229 HydrophobicContact CB-CD1 4.02Å; D191-I229 HydrophobicContact CB-CG1 3.89Å; D191-N230 WeakPolarHBondContact OD1-CB 3.14Å; D191-N230 PolarHBondContact OD1-ND2 3.41Å; D191-Y277 HydrophobicContact CB-CE1 4.11Å; D191-Y277 VanDerWaalsContact OD2-CE1 3.31Å; D191-Y277 WeakPolarHBondContact OD2-CE1 3.42Å; D191-Y277 PolarHBondContact OD2-OH 3.12Å
192	Y	97.5	Very high	94.9	Very high	34 Å²	34	32 Å²	32	13%	0.133	20%	0.204	C	C	.	.			trans	-87.4	9.1	-177.3	-87.6	-106.7	0	0	0	113.4	P151 A190 G194 V195 I228 I229 N230 F235 I238	P151-Y192 HydrophobicContact CG-CD2 4.4Å; P151-Y192 HydrophobicContact CG-CE1 4.37Å; P151-Y192 HydrophobicContact CG-CE2 4.1Å; A190-Y192 HydrophobicContact CB-CD2 4.05Å; A190-Y192 HydrophobicContact CB-CE2 3.69Å; Y192-G194 PolarHBondContact O-N 3.21Å; Y192-V195 HydrophobicContact CD1-CB 4.12Å; Y192-V195 HydrophobicContact CD1-CG1 4.18Å; Y192-V195 HydrophobicContact CD1-CG2 3.74Å; Y192-V195 HydrophobicContact CE1-CG2 4.46Å; Y192-V195 HydrophobicContact CG-CG2 4.26Å; Y192-V195 WeakPolarHBondContact O-CB 3.44Å; Y192-V195 WeakPolarHBondContact O-CG2 3.49Å; Y192-V195 PolarHBondContact O-N 3.28Å; Y192-I228 HydrophobicContact CD2-CG2 3.52Å; Y192-I228 HydrophobicContact CE2-CD1 4.26Å; Y192-I228 HydrophobicContact CE2-CG1 4.45Å; Y192-I228 HydrophobicContact CE2-CG2 3.81Å; Y192-I228 HydrophobicContact CG-CG2 4.28Å; Y192-I229 PolarHBondContact N-O 3.31Å; Y192-N230 CarbonylContact C-O 3.53Å; Y192-F235 AromaticContact CD1-CD2 3.76Å; Y192-F235 HydrophobicContact CD1-CD2 3.76Å; Y192-F235 HydrophobicContact CD1-CE2 4.22Å; Y192-F235 AromaticContact CE1-CD2 3.57Å; Y192-F235 HydrophobicContact CE1-CD2 3.57Å; Y192-F235 AromaticContact CE1-CE2 3.67Å; Y192-F235 HydrophobicContact CE1-CE2 3.67Å; Y192-F235 HydrophobicContact CE2-CD2 4.47Å; Y192-F235 HydrophobicContact CE2-CE2 4.01Å; Y192-F235 HydrophobicContact CG-CD2 4.32Å; Y192-F235 AromaticContact CZ-CD2 3.95Å; Y192-F235 AromaticContact CZ-CE2 3.54Å; Y192-I238 HydrophobicContact CE1-CD1 4.38Å
193	T	96.8	Very high	94.1	Very high	81 Å²	81	33.2 Å²	33.2	50%	0.497	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	128.1	171.1	-59.3	0	0	0	0	110.7	G152 D191 N230	G152-T193 WeakPolarHBondContact CA-O 3.29Å; D191-T193 VanDerWaalsContact C-N 3.26Å; D191-T193 PolarHBondContact O-N 2.92Å; D191-T193 VanDerWaalsContact OD1-CB 3.26Å; D191-T193 WeakPolarHBondContact OD1-CB 3.1Å; D191-T193 PolarHBondContact OD1-N 3.14Å; D191-T193 PolarHBondContact OD1-OG1 2.96Å; T193-N230 WeakPolarHBondContact OG1-CB 3.08Å; T193-N230 PolarHBondContact OG1-ND2 3.05Å
194	G	95.1	Very high	93.6	Very high	58 Å²	58	34.3 Å²	34.3	60%	0.598	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.8	0.7	179.3	0	0	0	0	0	115.2	Y192 G196	Y192-G194 PolarHBondContact O-N 3.21Å; G194-G196 PolarHBondContact O-N 3.37Å
195	V	96.4	Very high	93.3	Very high	14 Å²	14	37.7 Å²	37.7	9%	0.085	25%	0.246	C	C	.	.			trans	-74.7	113.2	173	175.6	0	0	0	0	110.3	P151 Y192 Q199 P232 I238	P151-V195 HydrophobicContact CB-CG2 3.85Å; Y192-V195 HydrophobicContact CD1-CB 4.12Å; Y192-V195 HydrophobicContact CD1-CG1 4.18Å; Y192-V195 HydrophobicContact CD1-CG2 3.74Å; Y192-V195 HydrophobicContact CE1-CG2 4.46Å; Y192-V195 HydrophobicContact CG-CG2 4.26Å; Y192-V195 WeakPolarHBondContact O-CB 3.44Å; Y192-V195 WeakPolarHBondContact O-CG2 3.49Å; Y192-V195 PolarHBondContact O-N 3.28Å; V195-Q199 HydrophobicContact CG1-CB 4.23Å; V195-P232 HydrophobicContact CB-CG 4.25Å; V195-P232 HydrophobicContact CG1-CG 4.42Å; V195-I238 HydrophobicContact CG1-CD1 4.07Å
196	G	93.9	Very high	93	Very high	28 Å²	28	44.6 Å²	44.6	29%	0.289	28%	0.276	S	S	.	.			trans	-109.1	-170	174.1	0	0	0	0	0	113	G194 S198 Q199 A200	G194-G196 PolarHBondContact O-N 3.37Å; G196-S198 VanDerWaalsContact C-N 3.32Å; G196-S198 PolarHBondContact O-N 3.15Å; G196-Q199 PolarHBondContact O-N 3.26Å; G196-A200 WeakPolarHBondContact O-CB 3.31Å; G196-A200 PolarHBondContact O-N 3.29Å; G196-A200 VanDerWaalsContact O-N 3.08Å
197	M	90.3	Very high	92.8	Very high	132 Å²	132	45.8 Å²	45.8	65%	0.65	28%	0.282	S	S	*	.	H	α-helix	trans	-59.9	-40.9	178.7	-172.4	67.1	70.7	0	0	112.2	Q199 A200 S201 I234	M197-Q199 VanDerWaalsContact C-N 3.32Å; M197-Q199 PolarHBondContact O-N 3.31Å; M197-A200 PolarHBondContact O-N 2.94Å; M197-A200 VanDerWaalsContact O-N 3.12Å; M197-S201 PolarHBondContact O-N 3.26Å; M197-S201 PolarHBondContact O-OG 3.49Å; M197-S201 VanDerWaalsContact O-OG 3.09Å; M197-I234 HydrophobicContact CB-CD1 4.42Å; M197-I234 HydrophobicContact CE-CD1 3.56Å; M197-I234 HydrophobicContact SD-CD1 3.44Å; M197-I234 WeakPolarHBondContact SD-CD1 3.44Å
198	S	88.6	Confident	92.5	Very high	68 Å²	68	46.2 Å²	46.2	48%	0.476	29%	0.286	S	S	.	.	H	α-helix	trans	-57.2	-41.5	179.6	41.1	0	0	0	0	113.2	G196	G196-S198 VanDerWaalsContact C-N 3.32Å; G196-S198 PolarHBondContact O-N 3.15Å
199	Q	90.8	Very high	92.3	Very high	29 Å²	29	51.2 Å²	51.2	14%	0.136	31%	0.308	C	S	.	.	H	α-helix	trans	-75	-38.4	176	-70.1	81.6	-0.6	0	0	111.2	W154 P156 V195 G196 M197 P203	W154-Q199 HydrophobicContact CE3-CB 4.07Å; W154-Q199 HydrophobicContact CE3-CG 3.89Å; W154-Q199 HydrophobicContact CZ3-CB 4.15Å; W154-Q199 HydrophobicContact CZ3-CG 4.38Å; W154-Q199 WeakPolarHBondContact CZ3-O 3.33Å; W154-Q199 PolarHBondContact O-NE2 3.28Å; W154-Q199 VanDerWaalsContact O-NE2 3.11Å; P156-Q199 HydrophobicContact CG-CG 4.35Å; V195-Q199 HydrophobicContact CG1-CB 4.23Å; G196-Q199 PolarHBondContact O-N 3.26Å; M197-Q199 VanDerWaalsContact C-N 3.32Å; M197-Q199 PolarHBondContact O-N 3.31Å; Q199-P203 VanDerWaalsContact O-CD 3.22Å; Q199-P203 WeakPolarHBondContact O-CD 3.35Å
200	A	88.4	Confident	92.1	Very high	18 Å²	18	53.3 Å²	53.3	15%	0.149	32%	0.317	C	S	.	.	H	α-helix	trans	-69.3	-37.4	-175.3	0	0	0	0	0	113.6	G196 M197 I234 I238	G196-A200 WeakPolarHBondContact O-CB 3.31Å; G196-A200 PolarHBondContact O-N 3.29Å; G196-A200 VanDerWaalsContact O-N 3.08Å; M197-A200 PolarHBondContact O-N 2.94Å; M197-A200 VanDerWaalsContact O-N 3.12Å; A200-I234 HydrophobicContact CB-CD1 3.68Å; A200-I234 HydrophobicContact CB-CG1 4.2Å; A200-I238 HydrophobicContact CB-CD1 3.76Å; A200-I238 HydrophobicContact CB-CG1 3.86Å
201	S	84.1	Confident	91.9	Very high	81 Å²	81	54.7 Å²	54.7	57%	0.566	32%	0.323	S	S	*	.	H	α-helix	trans	-84.5	-16.1	-172.7	63.1	0	0	0	0	114.6	M197	M197-S201 PolarHBondContact O-N 3.26Å; M197-S201 PolarHBondContact O-OG 3.49Å; M197-S201 VanDerWaalsContact O-OG 3.09Å
202	N	86.7	Confident	91.8	Very high	86 Å²	86	54.4 Å²	54.4	46%	0.46	32%	0.322	S	S	.	.	S	Bend	trans	-83.7	-42.1	-166.1	-176.6	-65.7	0	0	0	114.6	W154 G204	W154-N202 HydrophobicContact CH2-CB 3.65Å; W154-N202 WeakPolarHBondContact CH2-OD1 3.28Å; W154-N202 HydrophobicContact CZ3-CB 4.37Å; N202-G204 PolarHBondContact O-N 3.09Å
203	P	82.1	Confident	91.6	Very high	34 Å²	34	55.6 Å²	55.6	22%	0.221	34%	0.335	C	S	.	.	S	Bend	trans	-60.7	-42	178.1	-28.7	37.9	0	0	0	114	W154 F161 Q199 L207	W154-P203 HydrophobicContact CH2-CG 4.32Å; W154-P203 HydrophobicContact CZ3-CG 4.23Å; F161-P203 HydrophobicContact CD2-CG 4.03Å; F161-P203 HydrophobicContact CE2-CG 4.18Å; F161-P203 HydrophobicContact CG-CG 4.17Å; F161-P203 HydrophobicContact CZ-CG 4.48Å; Q199-P203 VanDerWaalsContact O-CD 3.22Å; Q199-P203 WeakPolarHBondContact O-CD 3.35Å; P203-L207 HydrophobicContact CB-CB 4.28Å; P203-L207 HydrophobicContact CB-CD2 3.85Å; P203-L207 HydrophobicContact CB-CG 4.29Å; P203-L207 WeakPolarHBondContact O-CB 3.33Å
204	G	88.8	Confident	91.5	Very high	23 Å²	23	52.5 Å²	52.5	24%	0.237	32%	0.316	C	S	.	.	H	α-helix	trans	65.2	175.3	-175.4	0	0	0	0	0	114.7	N202 F206 A208	N202-G204 PolarHBondContact O-N 3.09Å; G204-F206 PolarHBondContact O-N 2.84Å; G204-A208 PolarHBondContact O-N 3.11Å
205	P	91.6	Very high	91.4	Very high	80 Å²	80	51 Å²	51	52%	0.519	29%	0.293	S	S	.	.	H	α-helix	trans	-68.4	-32.6	-174.3	24.6	-33.5	0	0	0	114.1	A208 K209 I241 F245	P205-A208 PolarHBondContact O-N 3.1Å; P205-K209 WeakPolarHBondContact O-CB 3.42Å; P205-K209 PolarHBondContact O-N 2.84Å; P205-I241 HydrophobicContact CB-CG2 3.99Å; P205-F245 HydrophobicContact CB-CE2 4.33Å; P205-F245 HydrophobicContact CB-CZ 4.28Å; P205-F245 WeakPolarHBondContact O-CE2 3.48Å
206	F	92.2	Very high	91.2	Very high	144 Å²	144	51.3 Å²	51.3	63%	0.632	29%	0.294	S	S	*	.	H	α-helix	trans	-66.3	-44.8	-179.5	-179.8	-102	0	0	0	111.8	G204 K209 K210	G204-F206 PolarHBondContact O-N 2.84Å; F206-K209 PolarHBondContact O-N 3.08Å; F206-K210 HydrophobicContact CD1-CD 4.32Å; F206-K210 HydrophobicContact CE1-CD 3.74Å; F206-K210 VanDerWaalsContact CE1-CE 3.43Å; F206-K210 HydrophobicContact CE1-CG 4.41Å; F206-K210 HydrophobicContact CZ-CD 4.12Å; F206-K210 VanDerWaalsContact CZ-CE 3.42Å; F206-K210 PolarHBondContact O-N 3.03Å; F206-K210 VanDerWaalsContact O-N 3.09Å
207	L	92.3	Very high	91.1	Very high	25 Å²	25	51.8 Å²	51.8	13%	0.131	29%	0.29	C	S	.	.	H	α-helix	trans	-67.5	-41.5	176.9	-171.2	49.5	0	0	0	111.3	W112 F161 P203 K209 K210 I211	W112-L207 HydrophobicContact CH2-CD1 3.31Å; W112-L207 HydrophobicContact CZ2-CD1 3.18Å; F161-L207 HydrophobicContact CB-CD2 3.99Å; F161-L207 HydrophobicContact CD1-CD2 3.44Å; F161-L207 VanDerWaalsContact CD1-CD2 3.44Å; F161-L207 HydrophobicContact CD1-CG 4.19Å; F161-L207 HydrophobicContact CE1-CD2 4.3Å; F161-L207 HydrophobicContact CG-CD2 4Å; P203-L207 HydrophobicContact CB-CB 4.28Å; P203-L207 HydrophobicContact CB-CD2 3.85Å; P203-L207 HydrophobicContact CB-CG 4.29Å; P203-L207 WeakPolarHBondContact O-CB 3.33Å; L207-K209 VanDerWaalsContact C-N 3.31Å; L207-K209 PolarHBondContact O-N 3.02Å; L207-K210 PolarHBondContact O-N 3.3Å; L207-I211 HydrophobicContact CD1-CD1 4.24Å; L207-I211 HydrophobicContact CD1-CG1 4.42Å; L207-I211 HydrophobicContact CG-CD1 3.96Å; L207-I211 WeakPolarHBondContact O-CG1 3.33Å; L207-I211 PolarHBondContact O-N 2.86Å
208	A	93.6	Very high	91.4	Very high	11 Å²	11	46 Å²	46	9%	0.091	26%	0.264	C	S	.	.	H	α-helix	trans	-55.6	-46.1	173.7	0	0	0	0	0	111.6	G204 P205 K210 I211 V212 I241 I242 F245	G204-A208 PolarHBondContact O-N 3.11Å; P205-A208 PolarHBondContact O-N 3.1Å; A208-K210 PolarHBondContact O-N 3.49Å; A208-I211 PolarHBondContact O-N 3.28Å; A208-V212 WeakPolarHBondContact O-CB 3.32Å; A208-V212 VanDerWaalsContact O-CG2 3.27Å; A208-V212 WeakPolarHBondContact O-CG2 3.37Å; A208-V212 PolarHBondContact O-N 3.32Å; A208-I241 HydrophobicContact CB-CG2 4.09Å; A208-I242 HydrophobicContact CB-CG1 4.16Å; A208-F245 HydrophobicContact CB-CD2 4.41Å; A208-F245 HydrophobicContact CB-CE2 4.35Å
209	K	94.8	Very high	91.8	Very high	113 Å²	113	42.8 Å²	42.8	49%	0.491	24%	0.242	S	C	.	.	H	α-helix	trans	-58.1	-48.7	175.2	-175.2	-179.6	178.7	-178	0	111.7	P205 F206 L207 I211 V212 S213 F245	P205-K209 WeakPolarHBondContact O-CB 3.42Å; P205-K209 PolarHBondContact O-N 2.84Å; F206-K209 PolarHBondContact O-N 3.08Å; L207-K209 VanDerWaalsContact C-N 3.31Å; L207-K209 PolarHBondContact O-N 3.02Å; K209-I211 PolarHBondContact O-N 2.97Å; K209-V212 PolarHBondContact O-N 3.13Å; K209-S213 PolarHBondContact O-N 3.13Å; K209-S213 PolarHBondContact O-OG 2.74Å; K209-S213 VanDerWaalsContact O-OG 3.12Å; K209-F245 HydrophobicContact CB-CD1 3.88Å; K209-F245 HydrophobicContact CB-CD2 3.99Å; K209-F245 HydrophobicContact CB-CE1 3.89Å; K209-F245 HydrophobicContact CB-CE2 3.99Å; K209-F245 HydrophobicContact CB-CG 3.93Å; K209-F245 HydrophobicContact CB-CZ 3.94Å; K209-F245 HydrophobicContact CD-CD1 4.06Å; K209-F245 HydrophobicContact CD-CE1 3.92Å; K209-F245 HydrophobicContact CG-CD1 3.73Å; K209-F245 HydrophobicContact CG-CE1 3.97Å; K209-F245 HydrophobicContact CG-CG 4.11Å
210	K	94.3	Very high	92.1	Very high	43 Å²	43	41.5 Å²	41.5	19%	0.187	24%	0.236	C	C	.	.	H	α-helix	trans	-60.4	-44.3	179.5	-75.5	-172.7	157.8	-168.6	0	112.4	T111 W112 F206 L207 A208 S213 I214	T111-K210 PolarHBondContact O-NZ 3.05Å; W112-K210 HydrophobicContact CD2-CD 3.72Å; W112-K210 HydrophobicContact CE3-CB 3.93Å; W112-K210 HydrophobicContact CE3-CD 3.82Å; W112-K210 HydrophobicContact CE3-CG 4.38Å; W112-K210 HydrophobicContact CG-CD 4.23Å; W112-K210 HydrophobicContact CH2-CB 3.86Å; W112-K210 HydrophobicContact CH2-CD 4.29Å; W112-K210 HydrophobicContact CZ2-CD 4.24Å; W112-K210 HydrophobicContact CZ3-CB 3.49Å; W112-K210 VanDerWaalsContact CZ3-CB 3.49Å; W112-K210 HydrophobicContact CZ3-CD 4.09Å; W112-K210 HydrophobicContact CZ3-CG 4.38Å; F206-K210 HydrophobicContact CD1-CD 4.32Å; F206-K210 HydrophobicContact CE1-CD 3.74Å; F206-K210 VanDerWaalsContact CE1-CE 3.43Å; F206-K210 HydrophobicContact CE1-CG 4.41Å; F206-K210 HydrophobicContact CZ-CD 4.12Å; F206-K210 VanDerWaalsContact CZ-CE 3.42Å; F206-K210 PolarHBondContact O-N 3.03Å; F206-K210 VanDerWaalsContact O-N 3.09Å; L207-K210 PolarHBondContact O-N 3.3Å; A208-K210 PolarHBondContact O-N 3.49Å; K210-S213 WeakPolarHBondContact O-CB 3.17Å; K210-S213 PolarHBondContact O-N 3.29Å; K210-I214 PolarHBondContact O-N 2.78Å; K210-I214 VanDerWaalsContact O-N 3.11Å
211	I	94.4	Very high	92.5	Very high	34 Å²	34	41 Å²	41	17%	0.174	23%	0.231	C	C	.	.	H	α-helix	trans	-64.1	-44.6	178	-65.5	162.2	0	0	0	111	W112 F161 V165 L207 A208 K209 S213 I214 L215	W112-I211 HydrophobicContact CH2-CG1 4.24Å; F161-I211 HydrophobicContact CD1-CD1 4.37Å; F161-I211 HydrophobicContact CE1-CD1 3.6Å; F161-I211 HydrophobicContact CZ-CD1 4.45Å; V165-I211 HydrophobicContact CG2-CD1 4.07Å; V165-I211 HydrophobicContact CG2-CG1 4.04Å; L207-I211 HydrophobicContact CD1-CD1 4.24Å; L207-I211 HydrophobicContact CD1-CG1 4.42Å; L207-I211 HydrophobicContact CG-CD1 3.96Å; L207-I211 WeakPolarHBondContact O-CG1 3.33Å; L207-I211 PolarHBondContact O-N 2.86Å; A208-I211 PolarHBondContact O-N 3.28Å; K209-I211 PolarHBondContact O-N 2.97Å; I211-S213 VanDerWaalsContact C-N 3.3Å; I211-S213 PolarHBondContact O-N 2.62Å; I211-I214 WeakPolarHBondContact O-CB 3.22Å; I211-I214 PolarHBondContact O-N 3.17Å; I211-L215 HydrophobicContact CG2-CD1 4.35Å; I211-L215 PolarHBondContact O-N 3.47Å; I211-L215 VanDerWaalsContact O-N 3.16Å
212	V	94.7	Very high	93.1	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.042	21%	0.209	C	C	.	.	H	α-helix	trans	-61.8	-39.9	176.1	169.5	0	0	0	0	111	A208 K209 I214 L215 Q216 I242 F245 L246	A208-V212 WeakPolarHBondContact O-CB 3.32Å; A208-V212 VanDerWaalsContact O-CG2 3.27Å; A208-V212 WeakPolarHBondContact O-CG2 3.37Å; A208-V212 PolarHBondContact O-N 3.32Å; K209-V212 PolarHBondContact O-N 3.13Å; V212-I214 PolarHBondContact O-N 2.97Å; V212-L215 PolarHBondContact O-N 2.83Å; V212-Q216 HydrophobicContact CG1-CG 4.01Å; V212-Q216 VanDerWaalsContact CG1-NE2 3.25Å; V212-Q216 WeakPolarHBondContact O-CB 3.37Å; V212-Q216 VanDerWaalsContact O-CG 3.31Å; V212-Q216 WeakPolarHBondContact O-CG 3.19Å; V212-Q216 PolarHBondContact O-N 2.88Å; V212-I242 HydrophobicContact CG2-CG2 3.82Å; V212-F245 HydrophobicContact CB-CB 4.16Å; V212-F245 HydrophobicContact CG1-CB 3.92Å; V212-F245 VanDerWaalsContact CG1-O 3.24Å; V212-F245 WeakPolarHBondContact CG1-O 3.29Å; V212-F245 HydrophobicContact CG2-CB 4.36Å; V212-L246 HydrophobicContact CG1-CD2 3.86Å; V212-L246 HydrophobicContact CG2-CD2 3.9Å
213	S	93.9	Very high	93.6	Very high	59 Å²	59	34.8 Å²	34.8	41%	0.413	19%	0.189	S	C	.	.	H	α-helix	trans	-59.3	-43.3	175	-68.8	0	0	0	0	112.2	K209 K210 I211 D217 G218	K209-S213 PolarHBondContact O-N 3.13Å; K209-S213 PolarHBondContact O-OG 2.74Å; K209-S213 VanDerWaalsContact O-OG 3.12Å; K210-S213 WeakPolarHBondContact O-CB 3.17Å; K210-S213 PolarHBondContact O-N 3.29Å; I211-S213 VanDerWaalsContact C-N 3.3Å; I211-S213 PolarHBondContact O-N 2.62Å; S213-D217 CarbonylContact O-C 3.56Å; S213-D217 PolarHBondContact O-N 2.7Å; S213-G218 PolarHBondContact O-N 2.78Å
214	I	94.3	Very high	94.4	Very high	16 Å²	16	35.8 Å²	35.8	8%	0.082	19%	0.19	C	C	.	.	I	π-helix	trans	-57.2	-52.9	174.7	-67.2	169.9	0	0	0	110.3	W112 V165 Y169 L172 K210 I211 V212 Q216 G218 F219	W112-I214 HydrophobicContact CE3-CD1 4.16Å; W112-I214 HydrophobicContact CZ3-CD1 3.69Å; V165-I214 HydrophobicContact CG1-CD1 4.15Å; Y169-I214 HydrophobicContact CD2-CD1 4.33Å; Y169-I214 HydrophobicContact CD2-CG2 4.08Å; Y169-I214 HydrophobicContact CE2-CG2 4.17Å; L172-I214 HydrophobicContact CD1-CG2 4.42Å; K210-I214 PolarHBondContact O-N 2.78Å; K210-I214 VanDerWaalsContact O-N 3.11Å; I211-I214 WeakPolarHBondContact O-CB 3.22Å; I211-I214 PolarHBondContact O-N 3.17Å; V212-I214 PolarHBondContact O-N 2.97Å; I214-Q216 PolarHBondContact O-N 2.91Å; I214-G218 CarbonylContact O-C 3.48Å; I214-G218 PolarHBondContact O-N 3.26Å; I214-F219 HydrophobicContact CG2-CB 4.11Å; I214-F219 VanDerWaalsContact O-CB 3.28Å; I214-F219 WeakPolarHBondContact O-CB 3.31Å; I214-F219 PolarHBondContact O-N 3Å
215	L	93.3	Very high	94.8	Very high	25 Å²	25	35.4 Å²	35.4	13%	0.131	18%	0.184	C	C	.	.	I	π-helix	trans	-72.2	-23.1	-172.9	-64.1	177.7	0	0	0	114.5	L172 I188 I211 V212 I223	L172-L215 HydrophobicContact CD1-CD2 3.98Å; I188-L215 HydrophobicContact CD1-CD1 4.46Å; I211-L215 HydrophobicContact CG2-CD1 4.35Å; I211-L215 PolarHBondContact O-N 3.47Å; I211-L215 VanDerWaalsContact O-N 3.16Å; V212-L215 PolarHBondContact O-N 2.83Å; L215-I223 HydrophobicContact CD2-CD1 4.49Å
216	Q	91.8	Very high	95.1	Very high	21 Å²	21	32.1 Å²	32.1	10%	0.098	16%	0.163	C	C	.	.	I	π-helix	trans	-97.3	-49.8	-178	-65.9	-170	142.1	0	0	113.2	R91 V212 I214 F245 M250	R91-Q216 PolarHBondContact NH2-O 3.06Å; V212-Q216 HydrophobicContact CG1-CG 4.01Å; V212-Q216 VanDerWaalsContact CG1-NE2 3.25Å; V212-Q216 WeakPolarHBondContact O-CB 3.37Å; V212-Q216 VanDerWaalsContact O-CG 3.31Å; V212-Q216 WeakPolarHBondContact O-CG 3.19Å; V212-Q216 PolarHBondContact O-N 2.88Å; I214-Q216 PolarHBondContact O-N 2.91Å; Q216-F245 PolarHBondContact NE2-O 2.9Å; Q216-M250 HydrophobicContact CG-CB 4.46Å; Q216-M250 HydrophobicContact CG-CG 3.54Å
217	D	93.2	Very high	95.4	Very high	39 Å²	39	25.3 Å²	25.3	21%	0.209	13%	0.133	C	C	.	.	I	π-helix	trans	-139	2	-163.2	-61.9	-56.7	0	0	0	114.8	R91 L101 N104 S213 K247	R91-D217 IonicContact NH2-OD1 2.81Å; R91-D217 PolarHBondContact NH2-OD1 3.46Å; L101-D217 VanDerWaalsContact CD1-C 3.41Å; L101-D217 WeakPolarHBondContact CD1-O 3.3Å; N104-D217 WeakPolarHBondContact CB-O 3.24Å; N104-D217 PolarHBondContact ND2-O 2.89Å; S213-D217 CarbonylContact O-C 3.56Å; S213-D217 PolarHBondContact O-N 2.7Å; D217-K247 IonicContact OD1-NZ 3.97Å; D217-K247 PolarHBondContact OD1-NZ 3.29Å; D217-K247 WeakPolarHBondContact OD2-CE 3.4Å; D217-K247 IonicContact OD2-NZ 2.88Å; D217-K247 PolarHBondContact OD2-NZ 2.83Å
218	G	95.3	Very high	95.7	Very high	10 Å²	10	24.2 Å²	24.2	10%	0.103	13%	0.127	C	C	.	.	I	π-helix	trans	-117.5	0.1	-177.5	0	0	0	0	0	114.3	Y105 S213 I214	Y105-G218 WeakPolarHBondContact CA-O 3.49Å; Y105-G218 WeakPolarHBondContact CD2-O 3.46Å; S213-G218 PolarHBondContact O-N 2.78Å; I214-G218 CarbonylContact O-C 3.48Å; I214-G218 PolarHBondContact O-N 3.26Å
219	F	97.6	Very high	95.9	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.123	C	C	.	.	S	Bend	trans	-143.7	137.6	178.5	-160.6	-84.3	0	0	0	110.7	Y105 Y169 L172 E173 I176 I214 I221	Y105-F219 HydrophobicContact CD2-CD2 4.2Å; Y105-F219 AromaticContact CE2-CD2 3.92Å; Y105-F219 HydrophobicContact CE2-CD2 3.92Å; Y105-F219 AromaticContact CE2-CE2 3.93Å; Y105-F219 HydrophobicContact CE2-CE2 3.93Å; Y169-F219 HydrophobicContact CD1-CE2 4.44Å; Y169-F219 HydrophobicContact CD2-CD2 4.29Å; Y169-F219 HydrophobicContact CE1-CD2 4.32Å; Y169-F219 AromaticContact CE1-CE2 3.92Å; Y169-F219 HydrophobicContact CE1-CE2 3.92Å; Y169-F219 AromaticContact CE2-CD2 3.63Å; Y169-F219 HydrophobicContact CE2-CD2 3.63Å; Y169-F219 HydrophobicContact CE2-CE2 4.04Å; Y169-F219 AromaticContact CZ-CD2 3.66Å; Y169-F219 AromaticContact CZ-CE2 3.72Å; L172-F219 VanDerWaalsContact C-CZ 3.45Å; L172-F219 HydrophobicContact CB-CD1 4.23Å; L172-F219 HydrophobicContact CB-CE1 3.73Å; L172-F219 HydrophobicContact CB-CE2 4.07Å; L172-F219 HydrophobicContact CB-CZ 3.65Å; E173-F219 HydrophobicContact CG-CE2 3.83Å; E173-F219 HydrophobicContact CG-CZ 4.01Å; E173-F219 WeakPolarHBondContact OE1-CE2 3.42Å; I176-F219 HydrophobicContact CB-CE1 4.04Å; I176-F219 HydrophobicContact CB-CZ 4.47Å; I176-F219 HydrophobicContact CG1-CE1 4.39Å; I176-F219 HydrophobicContact CG2-CE1 4.05Å; I176-F219 HydrophobicContact CG2-CZ 3.99Å; I214-F219 HydrophobicContact CG2-CB 4.11Å; I214-F219 VanDerWaalsContact O-CB 3.28Å; I214-F219 WeakPolarHBondContact O-CB 3.31Å; I214-F219 PolarHBondContact O-N 3Å; F219-I221 HydrophobicContact CB-CG2 4.49Å; F219-I221 HydrophobicContact CD1-CB 3.68Å; F219-I221 HydrophobicContact CD1-CG2 3.69Å; F219-I221 HydrophobicContact CE1-CB 4.11Å; F219-I221 HydrophobicContact CE1-CG2 4.49Å; F219-I221 PolarHBondContact O-N 2.89Å
220	P	97.6	Very high	96.1	Very high	3 Å²	3	21 Å²	21	2%	0.019	11%	0.114	C	C	.	.	S	Bend	trans	-76.4	40.4	-175	32.7	-36.7	0	0	0	114.8	R86 F87 A90 L101 I176	R86-P220 HydrophobicContact CB-CB 3.97Å; R86-P220 HydrophobicContact CB-CG 4.03Å; F87-P220 HydrophobicContact CD1-CB 4.06Å; F87-P220 HydrophobicContact CD1-CG 4.43Å; F87-P220 HydrophobicContact CE1-CB 4.1Å; F87-P220 HydrophobicContact CE1-CG 3.99Å; F87-P220 HydrophobicContact CE2-CG 4.25Å; F87-P220 HydrophobicContact CG-CB 4.29Å; F87-P220 HydrophobicContact CZ-CB 4.39Å; F87-P220 HydrophobicContact CZ-CG 3.9Å; A90-P220 HydrophobicContact CB-CB 4.02Å; L101-P220 HydrophobicContact CD2-CB 4.15Å; I176-P220 WeakPolarHBondContact CD1-O 3.41Å; I176-P220 HydrophobicContact CG1-CG 4.34Å
221	I	95.8	Very high	96.2	Very high	7 Å²	7	21.2 Å²	21.2	4%	0.036	12%	0.115	C	C	.	.			trans	-110.7	147.1	178.6	-160.1	67.7	0	0	0	111.6	L172 I176 T181 L186 F219 I223	L172-I221 HydrophobicContact CD2-CG2 4.43Å; I176-I221 HydrophobicContact CB-CD1 4.46Å; I176-I221 HydrophobicContact CD1-CD1 3.55Å; T181-I221 HydrophobicContact CG2-CD1 3.94Å; L186-I221 HydrophobicContact CB-CG1 4.49Å; L186-I221 HydrophobicContact CD1-CD1 3.75Å; L186-I221 HydrophobicContact CD1-CG1 3.49Å; L186-I221 VanDerWaalsContact CD1-CG1 3.49Å; L186-I221 HydrophobicContact CG-CD1 3.79Å; L186-I221 HydrophobicContact CG-CG1 3.78Å; F219-I221 HydrophobicContact CB-CG2 4.49Å; F219-I221 HydrophobicContact CD1-CB 3.68Å; F219-I221 HydrophobicContact CD1-CG2 3.69Å; F219-I221 HydrophobicContact CE1-CB 4.11Å; F219-I221 HydrophobicContact CE1-CG2 4.49Å; F219-I221 PolarHBondContact O-N 2.89Å; I221-I223 HydrophobicContact CG1-CD1 4.48Å; I221-I223 HydrophobicContact CG2-CD1 3.98Å; I221-I223 HydrophobicContact CG2-CG1 4.48Å
222	R	96.9	Very high	96.2	Very high	31 Å²	31	21.4 Å²	21.4	12%	0.117	12%	0.119	C	C	.	.			trans	-106.3	99.3	177.3	-69	171.8	61.6	-126.3	8.1	110	E49 L50 V183 G185 L186 K224	E49-R222 IonicContact OE2-CZ 3.28Å; E49-R222 IonicContact OE2-NH2 3.1Å; E49-R222 PolarHBondContact OE2-NH2 3.29Å; L50-R222 VanDerWaalsContact CD2-CZ 3.43Å; V183-R222 PolarHBondContact O-NH1 3.45Å; G185-R222 CarbonylContact C-O 3.54Å; G185-R222 WeakPolarHBondContact CA-O 3.44Å; L186-R222 PolarHBondContact N-O 3.28Å; R222-K224 PolarHBondContact O-N 3.28Å
223	I	97.7	Very high	96.2	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.026	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	111.2	175.2	-54.9	-53.2	0	0	0	110	L186 I188 L215 I221 V226 R253	L186-I223 HydrophobicContact CB-CD1 4.26Å; L186-I223 CarbonylContact O-C 3.57Å; I188-I223 HydrophobicContact CD1-CD1 4.07Å; I188-I223 HydrophobicContact CD1-CG2 4.13Å; I188-I223 HydrophobicContact CG1-CD1 4.43Å; I188-I223 HydrophobicContact CG1-CG2 4.36Å; L215-I223 HydrophobicContact CD2-CD1 4.49Å; I221-I223 HydrophobicContact CG1-CD1 4.48Å; I221-I223 HydrophobicContact CG2-CD1 3.98Å; I221-I223 HydrophobicContact CG2-CG1 4.48Å; I223-V226 HydrophobicContact CG2-CG2 3.76Å; I223-R253 WeakPolarHBondContact O-CD 3.31Å; I223-R253 PolarHBondContact O-NE 2.96Å; I223-R253 VanDerWaalsContact O-NE 3.12Å; I223-R253 PolarHBondContact O-NH1 3.31Å
224	K	97.8	Very high	96.2	Very high	56 Å²	56	32.1 Å²	32.1	24%	0.243	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-27.4	-176.6	-59.4	-70.9	-68.8	-154.2	0	113.2	E49 N184 L186 R222	E49-K224 IonicContact OE2-NZ 2.76Å; E49-K224 PolarHBondContact OE2-NZ 3.04Å; N184-K224 WeakPolarHBondContact O-CG 3.49Å; L186-K224 PolarHBondContact O-N 3.29Å; R222-K224 PolarHBondContact O-N 3.28Å
225	A	97.9	Very high	96.2	Very high	15 Å²	15	31.6 Å²	31.6	12%	0.124	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	153.8	176.6	0	0	0	0	0	111	V187 I188	V187-A225 HydrophobicContact CG1-CB 4.28Å; V187-A225 HydrophobicContact CG2-CB 4.4Å; I188-A225 PolarHBondContact N-O 3.5Å
226	V	98.3	Very high	96.1	Very high	11 Å²	11	38.7 Å²	38.7	7%	0.067	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	99.7	170.8	-174.7	0	0	0	0	107.9	I188 I223 I228 R253 Y254 V255	I188-V226 HydrophobicContact CB-CG1 4.23Å; I188-V226 HydrophobicContact CB-CG2 4.31Å; I188-V226 HydrophobicContact CD1-CG2 4.3Å; I188-V226 HydrophobicContact CG2-CG1 4.19Å; I188-V226 WeakPolarHBondContact O-CA 3.49Å; I223-V226 HydrophobicContact CG2-CG2 3.76Å; V226-I228 HydrophobicContact CG1-CG1 4.3Å; V226-R253 PolarHBondContact N-O 3.48Å; V226-Y254 HydrophobicContact CB-CD1 4.09Å; V226-Y254 HydrophobicContact CB-CD2 4.32Å; V226-Y254 HydrophobicContact CB-CE1 4.18Å; V226-Y254 HydrophobicContact CB-CE2 4.39Å; V226-Y254 HydrophobicContact CB-CG 4.16Å; V226-Y254 HydrophobicContact CG1-CD1 3.82Å; V226-Y254 HydrophobicContact CG1-CE1 3.65Å; V226-Y254 HydrophobicContact CG1-CG 4.41Å; V226-Y254 HydrophobicContact CG2-CD2 4.42Å; V226-Y254 HydrophobicContact CG2-CE2 4.15Å; V226-Y254 WeakPolarHBondContact O-CA 3.28Å; V226-V255 PolarHBondContact O-N 3.37Å
227	N	98.6	Very high	96.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.8	-178.1	-60.3	-82.3	0	0	0	108.9	V187 I188 L189 A190 H257 L264 N267 I268	V187-N227 VanDerWaalsContact CG1-ND2 3.31Å; V187-N227 WeakPolarHBondContact CG1-ND2 3.48Å; I188-N227 PolarHBondContact O-N 2.89Å; L189-N227 CarbonylContact C-O 3.6Å; L189-N227 WeakPolarHBondContact CA-O 3.35Å; L189-N227 HydrophobicContact CD1-CB 3.98Å; A190-N227 PolarHBondContact N-O 3.15Å; N227-H257 WeakPolarHBondContact CB-NE2 3.5Å; N227-H257 PolarHBondContact OD1-NE2 2.99Å; N227-H257 VanDerWaalsContact OD1-NE2 3.08Å; N227-L264 HydrophobicContact CB-CD1 4.08Å; N227-N267 WeakPolarHBondContact OD1-CB 3.35Å; N227-N267 PolarHBondContact OD1-ND2 3.45Å; N227-I268 HydrophobicContact CB-CD1 4.33Å
228	I	98.4	Very high	96.2	Very high	2 Å²	2	38.8 Å²	38.8	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	127.8	-178.4	-58.3	-174.6	0	0	0	108.5	A190 Y192 V226 E231 F235 Y254 V255 L256 H257	A190-I228 HydrophobicContact CB-CG1 4.45Å; A190-I228 WeakPolarHBondContact O-CA 3.46Å; Y192-I228 HydrophobicContact CD2-CG2 3.52Å; Y192-I228 HydrophobicContact CE2-CD1 4.26Å; Y192-I228 HydrophobicContact CE2-CG1 4.45Å; Y192-I228 HydrophobicContact CE2-CG2 3.81Å; Y192-I228 HydrophobicContact CG-CG2 4.28Å; V226-I228 HydrophobicContact CG1-CG1 4.3Å; I228-E231 HydrophobicContact CG2-CB 3.84Å; I228-F235 HydrophobicContact CD1-CE1 4.2Å; I228-F235 HydrophobicContact CD1-CE2 3.72Å; I228-F235 HydrophobicContact CD1-CZ 3.29Å; I228-F235 HydrophobicContact CG2-CE2 4.29Å; I228-F235 HydrophobicContact CG2-CZ 4.42Å; I228-Y254 HydrophobicContact CD1-CD1 3.83Å; I228-Y254 HydrophobicContact CD1-CE1 4.18Å; I228-V255 PolarHBondContact N-O 3.17Å; I228-L256 HydrophobicContact CB-CD2 3.67Å; I228-L256 HydrophobicContact CD1-CD2 3.76Å; I228-L256 HydrophobicContact CG1-CD2 4.1Å; I228-L256 HydrophobicContact CG2-CD2 4.05Å; I228-H257 WeakPolarHBondContact O-CB 3.48Å; I228-H257 PolarHBondContact O-CD2 3.25Å; I228-H257 VanDerWaalsContact O-CD2 3.3Å; I228-H257 PolarHBondContact O-N 2.93Å
229	I	98.3	Very high	96.1	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	155.4	178.1	63.3	177.3	0	0	0	110.1	L189 A190 D191 Y192 E231 H257 L264 Y277	L189-I229 HydrophobicContact CD1-CD1 4.27Å; L189-I229 HydrophobicContact CD1-CG1 4.43Å; L189-I229 HydrophobicContact CD1-CG2 4.17Å; A190-I229 PolarHBondContact O-N 3.22Å; D191-I229 HydrophobicContact CB-CD1 4.02Å; D191-I229 HydrophobicContact CB-CG1 3.89Å; Y192-I229 PolarHBondContact N-O 3.31Å; I229-E231 PolarHBondContact O-N 2.97Å; I229-H257 HydrophobicContact CG2-CB 4Å; I229-L264 HydrophobicContact CG2-CB 4.39Å; I229-L264 HydrophobicContact CG2-CD1 4.09Å; I229-L264 HydrophobicContact CG2-CD2 4.11Å; I229-L264 HydrophobicContact CG2-CG 4.42Å; I229-Y277 HydrophobicContact CD1-CD1 3.31Å; I229-Y277 HydrophobicContact CD1-CE1 3.48Å; I229-Y277 VanDerWaalsContact CD1-CE1 3.48Å; I229-Y277 HydrophobicContact CD1-CG 4.41Å
230	N	97.6	Very high	96	Very high	56 Å²	56	43.5 Å²	43.5	30%	0.299	22%	0.219	S	C	.	.	S	Bend	trans	53.7	33.8	178.5	-53.3	-48.7	0	0	0	112.7	D191 Y192 T193 P232 G258	D191-N230 WeakPolarHBondContact OD1-CB 3.14Å; D191-N230 PolarHBondContact OD1-ND2 3.41Å; Y192-N230 CarbonylContact C-O 3.53Å; T193-N230 WeakPolarHBondContact OG1-CB 3.08Å; T193-N230 PolarHBondContact OG1-ND2 3.05Å; N230-P232 WeakPolarHBondContact O-CD 3.36Å; N230-G258 PolarHBondContact N-O 3.35Å
231	E	96.8	Very high	95.8	Very high	47 Å²	47	46.6 Å²	46.6	22%	0.22	24%	0.235	C	C	.	.			trans	-68.1	125.4	179.5	73.3	-70.8	172.8	0	0	111.6	I228 I229 F235 G258	I228-E231 HydrophobicContact CG2-CB 3.84Å; I229-E231 PolarHBondContact O-N 2.97Å; E231-F235 HydrophobicContact CB-CB 3.78Å; E231-F235 HydrophobicContact CB-CD1 4.11Å; E231-F235 HydrophobicContact CB-CD2 4.11Å; E231-F235 HydrophobicContact CB-CG 3.71Å; E231-F235 HydrophobicContact CG-CB 4.18Å; E231-F235 HydrophobicContact CG-CD1 4.06Å; E231-F235 HydrophobicContact CG-CG 4.12Å; E231-G258 VanDerWaalsContact OE1-CA 3.23Å; E231-G258 WeakPolarHBondContact OE1-CA 3.47Å; E231-G258 PolarHBondContact OE1-N 3.31Å; E231-G258 WeakPolarHBondContact OE2-CA 3.28Å; E231-G258 PolarHBondContact OE2-N 3.29Å
232	P	95.3	Very high	95.7	Very high	37 Å²	37	47.6 Å²	47.6	24%	0.24	24%	0.24	C	C	.	.			trans	-73.1	165.2	179	31	-37.5	0	0	0	111	V195 N230 I234 F235	V195-P232 HydrophobicContact CB-CG 4.25Å; V195-P232 HydrophobicContact CG1-CG 4.42Å; N230-P232 WeakPolarHBondContact O-CD 3.36Å; P232-I234 HydrophobicContact CB-CG2 4.03Å; P232-I234 HydrophobicContact CG-CG2 3.63Å; P232-I234 PolarHBondContact O-N 3.43Å; P232-F235 WeakPolarHBondContact O-CB 3.35Å; P232-F235 PolarHBondContact O-N 2.99Å
233	R	93.6	Very high	95.6	Very high	244 Å²	244	52 Å²	52	92%	0.921	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53	-33.7	177.8	-66.6	-177.4	-179	171.3	0.6	113.4	F235	R233-F235 PolarHBondContact O-N 3.37Å
234	I	93.4	Very high	95.5	Very high	48 Å²	48	56.5 Å²	56.5	25%	0.246	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-18.3	177.5	-167.9	168.2	0	0	0	113.4	M197 A200 P232 K236 G237 I238	M197-I234 HydrophobicContact CB-CD1 4.42Å; M197-I234 HydrophobicContact CE-CD1 3.56Å; M197-I234 HydrophobicContact SD-CD1 3.44Å; M197-I234 WeakPolarHBondContact SD-CD1 3.44Å; A200-I234 HydrophobicContact CB-CD1 3.68Å; A200-I234 HydrophobicContact CB-CG1 4.2Å; P232-I234 HydrophobicContact CB-CG2 4.03Å; P232-I234 HydrophobicContact CG-CG2 3.63Å; P232-I234 PolarHBondContact O-N 3.43Å; I234-K236 PolarHBondContact O-N 3.42Å; I234-K236 VanDerWaalsContact O-N 3.12Å; I234-G237 PolarHBondContact O-N 2.96Å; I234-I238 PolarHBondContact O-N 2.84Å
235	F	94.3	Very high	95.5	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-56.9	-31.1	179	-177.5	-92.8	0	0	0	112.7	Y192 I228 E231 P232 R233 G237 I238 F239 L256	Y192-F235 AromaticContact CD1-CD2 3.76Å; Y192-F235 HydrophobicContact CD1-CD2 3.76Å; Y192-F235 HydrophobicContact CD1-CE2 4.22Å; Y192-F235 AromaticContact CE1-CD2 3.57Å; Y192-F235 HydrophobicContact CE1-CD2 3.57Å; Y192-F235 AromaticContact CE1-CE2 3.67Å; Y192-F235 HydrophobicContact CE1-CE2 3.67Å; Y192-F235 HydrophobicContact CE2-CD2 4.47Å; Y192-F235 HydrophobicContact CE2-CE2 4.01Å; Y192-F235 HydrophobicContact CG-CD2 4.32Å; Y192-F235 AromaticContact CZ-CD2 3.95Å; Y192-F235 AromaticContact CZ-CE2 3.54Å; I228-F235 HydrophobicContact CD1-CE1 4.2Å; I228-F235 HydrophobicContact CD1-CE2 3.72Å; I228-F235 HydrophobicContact CD1-CZ 3.29Å; I228-F235 HydrophobicContact CG2-CE2 4.29Å; I228-F235 HydrophobicContact CG2-CZ 4.42Å; E231-F235 HydrophobicContact CB-CB 3.78Å; E231-F235 HydrophobicContact CB-CD1 4.11Å; E231-F235 HydrophobicContact CB-CD2 4.11Å; E231-F235 HydrophobicContact CB-CG 3.71Å; E231-F235 HydrophobicContact CG-CB 4.18Å; E231-F235 HydrophobicContact CG-CD1 4.06Å; E231-F235 HydrophobicContact CG-CG 4.12Å; P232-F235 WeakPolarHBondContact O-CB 3.35Å; P232-F235 PolarHBondContact O-N 2.99Å; R233-F235 PolarHBondContact O-N 3.37Å; F235-G237 PolarHBondContact O-N 3.44Å; F235-I238 HydrophobicContact CD2-CB 4.48Å; F235-I238 WeakPolarHBondContact O-CB 3.44Å; F235-I238 PolarHBondContact O-N 2.91Å; F235-I238 VanDerWaalsContact O-N 3.13Å; F235-F239 HydrophobicContact CD1-CB 4.28Å; F235-F239 HydrophobicContact CE1-CB 3.74Å; F235-F239 HydrophobicContact CE1-CD2 4.27Å; F235-F239 HydrophobicContact CE1-CG 4.16Å; F235-F239 HydrophobicContact CZ-CB 4.13Å; F235-F239 HydrophobicContact CZ-CD2 4.22Å; F235-F239 HydrophobicContact CZ-CG 4.5Å; F235-F239 WeakPolarHBondContact O-CB 3.46Å; F235-F239 PolarHBondContact O-N 3.34Å; F235-L256 HydrophobicContact CD1-CD1 4Å; F235-L256 HydrophobicContact CD1-CD2 4.14Å; F235-L256 HydrophobicContact CE1-CD1 3.79Å; F235-L256 HydrophobicContact CE1-CD2 3.41Å; F235-L256 VanDerWaalsContact CE1-CD2 3.41Å; F235-L256 HydrophobicContact CE1-CG 4.26Å; F235-L256 HydrophobicContact CZ-CD2 3.9Å
236	K	92.9	Very high	95.4	Very high	174 Å²	174	57.2 Å²	57.2	76%	0.757	29%	0.291	S	S	*	.	H	α-helix	trans	-55.8	-39.9	173.5	-68.1	-174.6	179.1	-177.4	0	112.3	I234 A240	I234-K236 PolarHBondContact O-N 3.42Å; I234-K236 VanDerWaalsContact O-N 3.12Å; K236-A240 WeakPolarHBondContact O-CB 3.38Å; K236-A240 PolarHBondContact O-N 3.32Å
237	G	92.8	Very high	95.3	Very high	39 Å²	39	61.5 Å²	61.5	40%	0.402	31%	0.309	S	S	.	.	H	α-helix	trans	-69.4	-43.5	175.3	0	0	0	0	0	112.3	I234 F235 F239 A240 I241	I234-G237 PolarHBondContact O-N 2.96Å; F235-G237 PolarHBondContact O-N 3.44Å; G237-F239 VanDerWaalsContact C-N 3.33Å; G237-F239 PolarHBondContact O-N 3.34Å; G237-A240 PolarHBondContact O-N 3.46Å; G237-I241 WeakPolarHBondContact O-CG1 3.32Å; G237-I241 PolarHBondContact O-N 2.89Å; G237-I241 VanDerWaalsContact O-N 3.15Å
238	I	93.3	Very high	95.1	Very high	24 Å²	24	69 Å²	69	12%	0.123	34%	0.343	C	S	.	.	H	α-helix	trans	-57.5	-48.6	174.9	-58.9	175.4	0	0	0	110.2	Y192 V195 A200 I234 F235 A240 I241 I242	Y192-I238 HydrophobicContact CE1-CD1 4.38Å; V195-I238 HydrophobicContact CG1-CD1 4.07Å; A200-I238 HydrophobicContact CB-CD1 3.76Å; A200-I238 HydrophobicContact CB-CG1 3.86Å; I234-I238 PolarHBondContact O-N 2.84Å; F235-I238 HydrophobicContact CD2-CB 4.48Å; F235-I238 WeakPolarHBondContact O-CB 3.44Å; F235-I238 PolarHBondContact O-N 2.91Å; F235-I238 VanDerWaalsContact O-N 3.13Å; I238-A240 VanDerWaalsContact C-N 3.34Å; I238-A240 PolarHBondContact O-N 2.97Å; I238-I241 WeakPolarHBondContact O-CB 3.41Å; I238-I241 PolarHBondContact O-N 2.67Å; I238-I241 VanDerWaalsContact O-N 3.15Å; I238-I242 HydrophobicContact CG2-CD1 3.87Å; I238-I242 WeakPolarHBondContact O-CG1 3.26Å; I238-I242 PolarHBondContact O-N 3.01Å; I238-I242 VanDerWaalsContact O-N 3.15Å
239	F	94.2	Very high	94.9	Very high	44 Å²	44	74.3 Å²	74.3	19%	0.193	37%	0.367	C	S	.	.	H	α-helix	trans	-66.9	-34.9	179.8	-167.9	-112.8	0	0	0	112.3	F235 G237 I241 I242 K243 L246 Y254	F235-F239 HydrophobicContact CD1-CB 4.28Å; F235-F239 HydrophobicContact CE1-CB 3.74Å; F235-F239 HydrophobicContact CE1-CD2 4.27Å; F235-F239 HydrophobicContact CE1-CG 4.16Å; F235-F239 HydrophobicContact CZ-CB 4.13Å; F235-F239 HydrophobicContact CZ-CD2 4.22Å; F235-F239 HydrophobicContact CZ-CG 4.5Å; F235-F239 WeakPolarHBondContact O-CB 3.46Å; F235-F239 PolarHBondContact O-N 3.34Å; G237-F239 VanDerWaalsContact C-N 3.33Å; G237-F239 PolarHBondContact O-N 3.34Å; F239-I241 PolarHBondContact O-N 2.9Å; F239-I242 PolarHBondContact O-N 3.49Å; F239-K243 HydrophobicContact CD1-CB 4.36Å; F239-K243 HydrophobicContact CD1-CD 4.43Å; F239-K243 HydrophobicContact CE1-CB 4.19Å; F239-K243 HydrophobicContact CE1-CD 3.92Å; F239-K243 HydrophobicContact CE1-CG 4.25Å; F239-K243 HydrophobicContact CZ-CB 4.42Å; F239-K243 WeakPolarHBondContact O-CB 3.41Å; F239-K243 PolarHBondContact O-N 3.47Å; F239-L246 HydrophobicContact CE2-CD1 4.04Å; F239-L246 HydrophobicContact CZ-CD1 4.35Å; F239-Y254 HydrophobicContact CD2-CD1 4.4Å; F239-Y254 AromaticContact CE2-CD1 3.8Å; F239-Y254 HydrophobicContact CE2-CD1 3.8Å; F239-Y254 HydrophobicContact CE2-CD2 4.41Å; F239-Y254 HydrophobicContact CE2-CE1 4.26Å; F239-Y254 AromaticContact CE2-CG 3.89Å; F239-Y254 HydrophobicContact CE2-CG 3.89Å; F239-Y254 HydrophobicContact CZ-CG 4.47Å
240	A	94	Very high	94.7	Very high	64 Å²	64	75.4 Å²	75.4	53%	0.529	37%	0.372	S	S	.	.	H	α-helix	trans	-62.8	-28.7	173.6	0	0	0	0	0	113	K236 G237 I238 P244	K236-A240 WeakPolarHBondContact O-CB 3.38Å; K236-A240 PolarHBondContact O-N 3.32Å; G237-A240 PolarHBondContact O-N 3.46Å; I238-A240 VanDerWaalsContact C-N 3.34Å; I238-A240 PolarHBondContact O-N 2.97Å; A240-P244 WeakPolarHBondContact O-CD 3.36Å; A240-P244 WeakPolarHBondContact O-CG 3.2Å
241	I	93.9	Very high	94.7	Very high	68 Å²	68	74.1 Å²	74.1	35%	0.349	37%	0.369	S	S	.	.	H	α-helix	trans	-75.1	-39.1	173.4	-66.4	165.7	0	0	0	111.2	P205 A208 G237 I238 F239 F245	P205-I241 HydrophobicContact CB-CG2 3.99Å; A208-I241 HydrophobicContact CB-CG2 4.09Å; G237-I241 WeakPolarHBondContact O-CG1 3.32Å; G237-I241 PolarHBondContact O-N 2.89Å; G237-I241 VanDerWaalsContact O-N 3.15Å; I238-I241 WeakPolarHBondContact O-CB 3.41Å; I238-I241 PolarHBondContact O-N 2.67Å; I238-I241 VanDerWaalsContact O-N 3.15Å; F239-I241 PolarHBondContact O-N 2.9Å; I241-F245 WeakPolarHBondContact O-CD2 3.41Å; I241-F245 WeakPolarHBondContact O-CE2 3.28Å
242	I	94	Very high	94.7	Very high	29 Å²	29	78.3 Å²	78.3	15%	0.149	39%	0.389	C	S	.	.	H	α-helix	trans	-78.9	-43.4	-176.1	-63.7	168.4	0	0	0	111.8	A208 V212 I238 F239 P244 F245 L246	A208-I242 HydrophobicContact CB-CG1 4.16Å; V212-I242 HydrophobicContact CG2-CG2 3.82Å; I238-I242 HydrophobicContact CG2-CD1 3.87Å; I238-I242 WeakPolarHBondContact O-CG1 3.26Å; I238-I242 PolarHBondContact O-N 3.01Å; I238-I242 VanDerWaalsContact O-N 3.15Å; F239-I242 PolarHBondContact O-N 3.49Å; I242-P244 VanDerWaalsContact C-CD 3.4Å; I242-F245 PolarHBondContact O-N 3.43Å; I242-L246 HydrophobicContact CG2-CD1 4.1Å; I242-L246 HydrophobicContact CG2-CD2 4.14Å; I242-L246 HydrophobicContact CG2-CG 4.05Å
243	K	94.9	Very high	94.7	Very high	123 Å²	123	78.9 Å²	78.9	54%	0.535	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-51.7	-41.5	-170.9	-176.8	-179.3	-177.5	-178.7	0	114.4	F239 F245 L246	F239-K243 HydrophobicContact CD1-CB 4.36Å; F239-K243 HydrophobicContact CD1-CD 4.43Å; F239-K243 HydrophobicContact CE1-CB 4.19Å; F239-K243 HydrophobicContact CE1-CD 3.92Å; F239-K243 HydrophobicContact CE1-CG 4.25Å; F239-K243 HydrophobicContact CZ-CB 4.42Å; F239-K243 WeakPolarHBondContact O-CB 3.41Å; F239-K243 PolarHBondContact O-N 3.47Å; K243-F245 PolarHBondContact O-N 2.83Å; K243-F245 VanDerWaalsContact O-N 3.1Å; K243-L246 PolarHBondContact O-N 2.95Å
244	P	96.3	Very high	94.9	Very high	99 Å²	99	69.7 Å²	69.7	64%	0.643	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-59.8	-20.7	178.4	-25.6	35.8	0	0	0	114.7	A240 I242	A240-P244 WeakPolarHBondContact O-CD 3.36Å; A240-P244 WeakPolarHBondContact O-CG 3.2Å; I242-P244 VanDerWaalsContact C-CD 3.4Å
245	F	96.3	Very high	95.1	Very high	65 Å²	65	69.6 Å²	69.6	29%	0.285	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-95	-11.6	178.6	-50.1	-58.1	0	0	0	113	P205 A208 K209 V212 Q216 I241 I242 K243	P205-F245 HydrophobicContact CB-CE2 4.33Å; P205-F245 HydrophobicContact CB-CZ 4.28Å; P205-F245 WeakPolarHBondContact O-CE2 3.48Å; A208-F245 HydrophobicContact CB-CD2 4.41Å; A208-F245 HydrophobicContact CB-CE2 4.35Å; K209-F245 HydrophobicContact CB-CD1 3.88Å; K209-F245 HydrophobicContact CB-CD2 3.99Å; K209-F245 HydrophobicContact CB-CE1 3.89Å; K209-F245 HydrophobicContact CB-CE2 3.99Å; K209-F245 HydrophobicContact CB-CG 3.93Å; K209-F245 HydrophobicContact CB-CZ 3.94Å; K209-F245 HydrophobicContact CD-CD1 4.06Å; K209-F245 HydrophobicContact CD-CE1 3.92Å; K209-F245 HydrophobicContact CG-CD1 3.73Å; K209-F245 HydrophobicContact CG-CE1 3.97Å; K209-F245 HydrophobicContact CG-CG 4.11Å; V212-F245 HydrophobicContact CB-CB 4.16Å; V212-F245 HydrophobicContact CG1-CB 3.92Å; V212-F245 VanDerWaalsContact CG1-O 3.24Å; V212-F245 WeakPolarHBondContact CG1-O 3.29Å; V212-F245 HydrophobicContact CG2-CB 4.36Å; Q216-F245 PolarHBondContact NE2-O 2.9Å; I241-F245 WeakPolarHBondContact O-CD2 3.41Å; I241-F245 WeakPolarHBondContact O-CE2 3.28Å; I242-F245 PolarHBondContact O-N 3.43Å; K243-F245 PolarHBondContact O-N 2.83Å; K243-F245 VanDerWaalsContact O-N 3.1Å
246	L	96.2	Very high	95.2	Very high	22 Å²	22	73.3 Å²	73.3	12%	0.115	37%	0.373	C	S	.	.	S	Bend	trans	-79.8	131.6	-179.7	-62.3	178.2	0	0	0	110.6	V212 F239 I242 K243 M250 A251 Y254	V212-L246 HydrophobicContact CG1-CD2 3.86Å; V212-L246 HydrophobicContact CG2-CD2 3.9Å; F239-L246 HydrophobicContact CE2-CD1 4.04Å; F239-L246 HydrophobicContact CZ-CD1 4.35Å; I242-L246 HydrophobicContact CG2-CD1 4.1Å; I242-L246 HydrophobicContact CG2-CD2 4.14Å; I242-L246 HydrophobicContact CG2-CG 4.05Å; K243-L246 PolarHBondContact O-N 2.95Å; L246-M250 HydrophobicContact CD2-CB 4.3Å; L246-A251 HydrophobicContact CB-CB 4.12Å; L246-A251 HydrophobicContact CD1-CB 4.26Å; L246-Y254 HydrophobicContact CD1-CD2 3.98Å; L246-Y254 HydrophobicContact CD1-CE2 3.62Å; L246-Y254 HydrophobicContact CD2-CE2 4.02Å
247	K	95.9	Very high	95.5	Very high	101 Å²	101	65.5 Å²	65.5	44%	0.439	34%	0.339	S	S	.	.			trans	-66.1	149	162.6	-67.4	178.2	175.3	179.4	0	108.5	D217 K249 M250 A251	D217-K247 IonicContact OD1-NZ 3.97Å; D217-K247 PolarHBondContact OD1-NZ 3.29Å; D217-K247 WeakPolarHBondContact OD2-CE 3.4Å; D217-K247 IonicContact OD2-NZ 2.88Å; D217-K247 PolarHBondContact OD2-NZ 2.83Å; K247-K249 VanDerWaalsContact C-N 3.31Å; K247-K249 PolarHBondContact O-N 3.1Å; K247-M250 WeakPolarHBondContact O-CA 3.42Å; K247-M250 WeakPolarHBondContact O-CB 3.28Å; K247-M250 PolarHBondContact O-N 3.19Å; K247-A251 PolarHBondContact O-N 3.13Å
248	E	95.6	Very high	95.6	Very high	156 Å²	156	64.7 Å²	64.7	73%	0.729	33%	0.33	S	S	*	.	H	α-helix	trans	-47.3	-52.2	-178.5	-176.4	171	-151.8	0	0	112.4	M250 A251 E252	E248-M250 PolarHBondContact O-N 2.93Å; E248-M250 VanDerWaalsContact O-N 3.12Å; E248-A251 WeakPolarHBondContact O-CB 3.43Å; E248-A251 PolarHBondContact O-N 3.09Å; E248-E252 WeakPolarHBondContact O-CG 3.21Å; E248-E252 PolarHBondContact O-N 3.35Å
249	K	93.6	Very high	95.6	Very high	115 Å²	115	68.6 Å²	68.6	50%	0.5	36%	0.36	S	S	.	.	H	α-helix	trans	-56.1	-31.6	176.5	-171.7	177.3	-177.6	172.2	0	114.6	K247 R253	K247-K249 VanDerWaalsContact C-N 3.31Å; K247-K249 PolarHBondContact O-N 3.1Å; K249-R253 WeakPolarHBondContact O-CD 3.3Å; K249-R253 WeakPolarHBondContact O-CG 3.34Å
250	M	95.1	Very high	95.6	Very high	25 Å²	25	69.8 Å²	69.8	12%	0.123	37%	0.368	C	S	.	.	H	α-helix	trans	-80.6	-40.7	175.1	-86.1	-26.2	76.7	0	0	111	Q216 L246 K247 E248 E252 R253 Y254	Q216-M250 HydrophobicContact CG-CB 4.46Å; Q216-M250 HydrophobicContact CG-CG 3.54Å; L246-M250 HydrophobicContact CD2-CB 4.3Å; K247-M250 WeakPolarHBondContact O-CA 3.42Å; K247-M250 WeakPolarHBondContact O-CB 3.28Å; K247-M250 PolarHBondContact O-N 3.19Å; E248-M250 PolarHBondContact O-N 2.93Å; E248-M250 VanDerWaalsContact O-N 3.12Å; M250-E252 PolarHBondContact O-N 3.47Å; M250-R253 WeakPolarHBondContact O-CB 3.46Å; M250-R253 PolarHBondContact O-N 3.44Å; M250-R253 PolarHBondContact SD-NH1 2.78Å; M250-Y254 VanDerWaalsContact O-CD2 3.27Å; M250-Y254 WeakPolarHBondContact O-CD2 3.36Å
251	A	96.1	Very high	95.5	Very high	29 Å²	29	69.7 Å²	69.7	24%	0.24	36%	0.359	C	S	.	.	H	α-helix	trans	-57.4	-40.2	176.6	0	0	0	0	0	111.4	L246 K247 E248 R253 Y254	L246-A251 HydrophobicContact CB-CB 4.12Å; L246-A251 HydrophobicContact CD1-CB 4.26Å; K247-A251 PolarHBondContact O-N 3.13Å; E248-A251 WeakPolarHBondContact O-CB 3.43Å; E248-A251 PolarHBondContact O-N 3.09Å; A251-R253 PolarHBondContact O-N 3.41Å; A251-Y254 PolarHBondContact O-N 3.43Å
252	E	96.4	Very high	95.6	Very high	135 Å²	135	75.9 Å²	75.9	63%	0.631	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.7	174.6	-70	171.4	171.2	0	0	114.2	E248 M250 Y254	E248-E252 WeakPolarHBondContact O-CG 3.21Å; E248-E252 PolarHBondContact O-N 3.35Å; M250-E252 PolarHBondContact O-N 3.47Å; E252-Y254 VanDerWaalsContact C-N 3.34Å
253	R	96.9	Very high	95.7	Very high	48 Å²	48	75.4 Å²	75.4	18%	0.181	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-12.5	179.1	-70.6	170.3	176.4	-177.7	-12.8	113	I223 V226 K249 M250 A251	I223-R253 WeakPolarHBondContact O-CD 3.31Å; I223-R253 PolarHBondContact O-NE 2.96Å; I223-R253 VanDerWaalsContact O-NE 3.12Å; I223-R253 PolarHBondContact O-NH1 3.31Å; V226-R253 PolarHBondContact N-O 3.48Å; K249-R253 WeakPolarHBondContact O-CD 3.3Å; K249-R253 WeakPolarHBondContact O-CG 3.34Å; M250-R253 WeakPolarHBondContact O-CB 3.46Å; M250-R253 PolarHBondContact O-N 3.44Å; M250-R253 PolarHBondContact SD-NH1 2.78Å; A251-R253 PolarHBondContact O-N 3.41Å
254	Y	97.1	Very high	95.8	Very high	52 Å²	52	69.5 Å²	69.5	20%	0.204	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	123.8	176.4	-78.5	-105	0	0	0	110.1	V226 I228 F239 L246 M250 A251 E252	V226-Y254 HydrophobicContact CB-CD1 4.09Å; V226-Y254 HydrophobicContact CB-CD2 4.32Å; V226-Y254 HydrophobicContact CB-CE1 4.18Å; V226-Y254 HydrophobicContact CB-CE2 4.39Å; V226-Y254 HydrophobicContact CB-CG 4.16Å; V226-Y254 HydrophobicContact CG1-CD1 3.82Å; V226-Y254 HydrophobicContact CG1-CE1 3.65Å; V226-Y254 HydrophobicContact CG1-CG 4.41Å; V226-Y254 HydrophobicContact CG2-CD2 4.42Å; V226-Y254 HydrophobicContact CG2-CE2 4.15Å; V226-Y254 WeakPolarHBondContact O-CA 3.28Å; I228-Y254 HydrophobicContact CD1-CD1 3.83Å; I228-Y254 HydrophobicContact CD1-CE1 4.18Å; F239-Y254 HydrophobicContact CD2-CD1 4.4Å; F239-Y254 AromaticContact CE2-CD1 3.8Å; F239-Y254 HydrophobicContact CE2-CD1 3.8Å; F239-Y254 HydrophobicContact CE2-CD2 4.41Å; F239-Y254 HydrophobicContact CE2-CE1 4.26Å; F239-Y254 AromaticContact CE2-CG 3.89Å; F239-Y254 HydrophobicContact CE2-CG 3.89Å; F239-Y254 HydrophobicContact CZ-CG 4.47Å; L246-Y254 HydrophobicContact CD1-CD2 3.98Å; L246-Y254 HydrophobicContact CD1-CE2 3.62Å; L246-Y254 HydrophobicContact CD2-CE2 4.02Å; M250-Y254 VanDerWaalsContact O-CD2 3.27Å; M250-Y254 WeakPolarHBondContact O-CD2 3.36Å; A251-Y254 PolarHBondContact O-N 3.43Å; E252-Y254 VanDerWaalsContact C-N 3.34Å
255	V	97.2	Very high	95.7	Very high	46 Å²	46	67.2 Å²	67.2	28%	0.279	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	121.8	174.8	-171.1	0	0	0	0	108.3	V226 I228 H257	V226-V255 PolarHBondContact O-N 3.37Å; I228-V255 PolarHBondContact N-O 3.17Å; V255-H257 VanDerWaalsContact CG1-CE1 3.42Å; V255-H257 WeakPolarHBondContact CG1-CE1 3.11Å
256	L	97.3	Very high	95.7	Very high	81 Å²	81	72.6 Å²	72.6	42%	0.424	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	124.9	174.2	-52.6	-174.2	0	0	0	108.6	I228 F235	I228-L256 HydrophobicContact CB-CD2 3.67Å; I228-L256 HydrophobicContact CD1-CD2 3.76Å; I228-L256 HydrophobicContact CG1-CD2 4.1Å; I228-L256 HydrophobicContact CG2-CD2 4.05Å; F235-L256 HydrophobicContact CD1-CD1 4Å; F235-L256 HydrophobicContact CD1-CD2 4.14Å; F235-L256 HydrophobicContact CE1-CD1 3.79Å; F235-L256 HydrophobicContact CE1-CD2 3.41Å; F235-L256 VanDerWaalsContact CE1-CD2 3.41Å; F235-L256 HydrophobicContact CE1-CG 4.26Å; F235-L256 HydrophobicContact CZ-CD2 3.9Å
257	H	97.8	Very high	95.6	Very high	11 Å²	11	74.4 Å²	74.4	5%	0.051	36%	0.36	C	S	.	.			trans	-104.9	-15	-177.2	-60.8	-72.2	0	0	0	112.7	N227 I228 I229 V255 S259 D260 S263 L264 N267	N227-H257 WeakPolarHBondContact CB-NE2 3.5Å; N227-H257 PolarHBondContact OD1-NE2 2.99Å; N227-H257 VanDerWaalsContact OD1-NE2 3.08Å; I228-H257 WeakPolarHBondContact O-CB 3.48Å; I228-H257 PolarHBondContact O-CD2 3.25Å; I228-H257 VanDerWaalsContact O-CD2 3.3Å; I228-H257 PolarHBondContact O-N 2.93Å; I229-H257 HydrophobicContact CG2-CB 4Å; V255-H257 VanDerWaalsContact CG1-CE1 3.42Å; V255-H257 WeakPolarHBondContact CG1-CE1 3.11Å; H257-S259 PolarHBondContact O-N 2.84Å; H257-D260 PolarHBondContact O-N 3.47Å; H257-S263 PolarHBondContact CE1-O 2.57Å; H257-S263 WeakPolarHBondContact ND1-CB 3.36Å; H257-S263 PolarHBondContact ND1-O 3.23Å; H257-S263 PolarHBondContact ND1-OG 3.12Å; H257-L264 PolarHBondContact ND1-N 3.44Å; H257-N267 PolarHBondContact CE1-ND2 3.23Å; H257-N267 VanDerWaalsContact CE1-ND2 3.3Å
258	G	95.9	Very high	95.6	Very high	21 Å²	21	69.6 Å²	69.6	22%	0.216	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	-130.3	-169	0	0	0	0	0	110.1	N230 E231	N230-G258 PolarHBondContact N-O 3.35Å; E231-G258 VanDerWaalsContact OE1-CA 3.23Å; E231-G258 WeakPolarHBondContact OE1-CA 3.47Å; E231-G258 PolarHBondContact OE1-N 3.31Å; E231-G258 WeakPolarHBondContact OE2-CA 3.28Å; E231-G258 PolarHBondContact OE2-N 3.29Å
259	S	94	Very high	95.7	Very high	106 Å²	106	63.6 Å²	63.6	74%	0.741	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.5	5.1	173.3	54.3	0	0	0	0	113.8	H257 L261	H257-S259 PolarHBondContact O-N 2.84Å; S259-L261 PolarHBondContact O-N 2.86Å; S259-L261 VanDerWaalsContact O-N 3.15Å
260	D	94.4	Very high	95.8	Very high	70 Å²	70	60.3 Å²	60.3	37%	0.374	30%	0.304	S	S	.	.			trans	-82.8	92.6	-178.4	-178.7	15.3	0	0	0	111.7	H257 R262 S263 L264	H257-D260 PolarHBondContact O-N 3.47Å; D260-R262 PolarHBondContact O-N 2.89Å; D260-R262 WeakPolarHBondContact OD1-CA 3.31Å; D260-R262 VanDerWaalsContact OD1-CB 3.25Å; D260-R262 WeakPolarHBondContact OD1-CB 3.39Å; D260-R262 PolarHBondContact OD1-N 3.08Å; D260-S263 VanDerWaalsContact O-CB 3.27Å; D260-S263 WeakPolarHBondContact O-CB 3.23Å; D260-S263 PolarHBondContact O-N 2.87Å; D260-S263 PolarHBondContact OD1-N 2.81Å; D260-S263 WeakPolarHBondContact OD2-CB 2.99Å; D260-S263 PolarHBondContact OD2-N 2.81Å; D260-L264 PolarHBondContact O-N 2.77Å
261	L	91.8	Very high	95.9	Very high	62 Å²	62	61.7 Å²	61.7	33%	0.325	32%	0.316	S	S	.	.	H	α-helix	trans	-62.1	-25.6	174.8	-63.6	-177.9	0	0	0	113.1	S259 S263 L264 H265	S259-L261 PolarHBondContact O-N 2.86Å; S259-L261 VanDerWaalsContact O-N 3.15Å; L261-S263 VanDerWaalsContact C-N 3.26Å; L261-S263 PolarHBondContact O-N 2.8Å; L261-L264 HydrophobicContact CD2-CD2 4.21Å; L261-L264 WeakPolarHBondContact O-CB 3.46Å; L261-L264 PolarHBondContact O-N 2.98Å; L261-H265 WeakPolarHBondContact O-CB 3.3Å; L261-H265 PolarHBondContact O-CD2 2.66Å; L261-H265 PolarHBondContact O-N 3.38Å; L261-H265 PolarHBondContact O-ND1 3.2Å
262	R	94.4	Very high	95.9	Very high	198 Å²	198	60.9 Å²	60.9	75%	0.747	31%	0.308	S	S	*	.	H	α-helix	trans	-67.1	-34.3	175.5	-55.2	177.4	-175	176.3	1.8	110.5	D260 H265 R266	D260-R262 PolarHBondContact O-N 2.89Å; D260-R262 WeakPolarHBondContact OD1-CA 3.31Å; D260-R262 VanDerWaalsContact OD1-CB 3.25Å; D260-R262 WeakPolarHBondContact OD1-CB 3.39Å; D260-R262 PolarHBondContact OD1-N 3.08Å; R262-H265 PolarHBondContact O-N 2.66Å; R262-R266 PolarHBondContact O-N 3.24Å
263	S	96.4	Very high	96	Very high	18 Å²	18	54.4 Å²	54.4	13%	0.126	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-44.9	171.9	-169	0	0	0	0	111.8	H257 D260 L261 H265 R266	H257-S263 PolarHBondContact CE1-O 2.57Å; H257-S263 WeakPolarHBondContact ND1-CB 3.36Å; H257-S263 PolarHBondContact ND1-O 3.23Å; H257-S263 PolarHBondContact ND1-OG 3.12Å; D260-S263 VanDerWaalsContact O-CB 3.27Å; D260-S263 WeakPolarHBondContact O-CB 3.23Å; D260-S263 PolarHBondContact O-N 2.87Å; D260-S263 PolarHBondContact OD1-N 2.81Å; D260-S263 WeakPolarHBondContact OD2-CB 2.99Å; D260-S263 PolarHBondContact OD2-N 2.81Å; L261-S263 VanDerWaalsContact C-N 3.26Å; L261-S263 PolarHBondContact O-N 2.8Å; S263-H265 VanDerWaalsContact C-N 3.33Å; S263-H265 PolarHBondContact O-N 2.76Å; S263-R266 VanDerWaalsContact CA-NH2 3.31Å; S263-R266 VanDerWaalsContact CB-NH2 3.33Å; S263-R266 PolarHBondContact O-N 2.91Å; S263-R266 PolarHBondContact OG-NH2 3.29Å; S263-R266 VanDerWaalsContact OG-NH2 3.16Å
264	L	96.9	Very high	96	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-58.8	-45.9	173.8	176.3	66.5	0	0	0	111.2	L189 N227 I229 H257 D260 L261 R266 N267 I268 L273	L189-L264 HydrophobicContact CD1-CD1 3.62Å; L189-L264 HydrophobicContact CD1-CD2 4.5Å; N227-L264 HydrophobicContact CB-CD1 4.08Å; I229-L264 HydrophobicContact CG2-CB 4.39Å; I229-L264 HydrophobicContact CG2-CD1 4.09Å; I229-L264 HydrophobicContact CG2-CD2 4.11Å; I229-L264 HydrophobicContact CG2-CG 4.42Å; H257-L264 PolarHBondContact ND1-N 3.44Å; D260-L264 PolarHBondContact O-N 2.77Å; L261-L264 HydrophobicContact CD2-CD2 4.21Å; L261-L264 WeakPolarHBondContact O-CB 3.46Å; L261-L264 PolarHBondContact O-N 2.98Å; L264-R266 PolarHBondContact O-N 3.05Å; L264-N267 PolarHBondContact O-N 3.16Å; L264-I268 HydrophobicContact CD1-CB 4.4Å; L264-I268 HydrophobicContact CD1-CD1 4.1Å; L264-I268 HydrophobicContact CD1-CG1 4.32Å; L264-I268 PolarHBondContact O-N 3.11Å; L264-L273 HydrophobicContact CD2-CD1 3.76Å; L264-L273 HydrophobicContact CG-CD1 4.14Å
265	H	95.5	Very high	96	Very high	51 Å²	51	55.4 Å²	55.4	24%	0.236	29%	0.287	C	S	.	.	H	α-helix	trans	-65.1	-19.6	-175.7	-65.3	168.3	0	0	0	114.3	L261 R262 S263 N267 I268 P270 Y277 G278	L261-H265 WeakPolarHBondContact O-CB 3.3Å; L261-H265 PolarHBondContact O-CD2 2.66Å; L261-H265 PolarHBondContact O-N 3.38Å; L261-H265 PolarHBondContact O-ND1 3.2Å; R262-H265 PolarHBondContact O-N 2.66Å; S263-H265 VanDerWaalsContact C-N 3.33Å; S263-H265 PolarHBondContact O-N 2.76Å; H265-N267 VanDerWaalsContact C-N 3.3Å; H265-I268 VanDerWaalsContact CA-O 3.28Å; H265-I268 WeakPolarHBondContact CA-O 3.44Å; H265-P270 HydrophobicContact CB-CG 4.24Å; H265-Y277 PolarHBondContact NE2-O 3.47Å; H265-G278 PolarHBondContact CE1-O 2.96Å; H265-G278 PolarHBondContact NE2-O 3.05Å
266	R	94.6	Very high	95.9	Very high	177 Å²	177	57.5 Å²	57.5	67%	0.668	29%	0.294	S	S	*	.	H	α-helix	trans	-70	-26.6	169.8	-70.4	-172.1	-66.9	-94.9	7.1	112.9	R262 S263 L264	R262-R266 PolarHBondContact O-N 3.24Å; S263-R266 VanDerWaalsContact CA-NH2 3.31Å; S263-R266 VanDerWaalsContact CB-NH2 3.33Å; S263-R266 PolarHBondContact O-N 2.91Å; S263-R266 PolarHBondContact OG-NH2 3.29Å; S263-R266 VanDerWaalsContact OG-NH2 3.16Å; L264-R266 PolarHBondContact O-N 3.05Å
267	N	94.3	Very high	95.8	Very high	61 Å²	61	54.6 Å²	54.6	33%	0.326	28%	0.277	S	S	.	.	H	α-helix	trans	-102.7	-36.9	-178.9	-72.3	-25.6	0	0	0	113.1	N227 H257 L264 H265	N227-N267 WeakPolarHBondContact OD1-CB 3.35Å; N227-N267 PolarHBondContact OD1-ND2 3.45Å; H257-N267 PolarHBondContact CE1-ND2 3.23Å; H257-N267 VanDerWaalsContact CE1-ND2 3.3Å; L264-N267 PolarHBondContact O-N 3.16Å; H265-N267 VanDerWaalsContact C-N 3.3Å
268	I	96.9	Very high	95.6	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.291	C	S	.	.	S	Bend	trans	-129.5	112.7	179.5	-53.2	-176.9	0	0	0	108.4	I146 V187 L189 N227 L264 H265 V272 L273	I146-I268 HydrophobicContact CD1-CG2 3.59Å; I146-I268 HydrophobicContact CG2-CD1 4.28Å; V187-I268 HydrophobicContact CG1-CD1 3.77Å; V187-I268 HydrophobicContact CG1-CG1 4.16Å; L189-I268 HydrophobicContact CB-CD1 4.04Å; L189-I268 HydrophobicContact CD1-CD1 4.28Å; L189-I268 HydrophobicContact CD2-CD1 4.33Å; L189-I268 HydrophobicContact CG-CD1 4.44Å; N227-I268 HydrophobicContact CB-CD1 4.33Å; L264-I268 HydrophobicContact CD1-CB 4.4Å; L264-I268 HydrophobicContact CD1-CD1 4.1Å; L264-I268 HydrophobicContact CD1-CG1 4.32Å; L264-I268 PolarHBondContact O-N 3.11Å; H265-I268 VanDerWaalsContact CA-O 3.28Å; H265-I268 WeakPolarHBondContact CA-O 3.44Å; I268-V272 HydrophobicContact CG2-CG2 3.72Å; I268-L273 HydrophobicContact CB-CD1 4.32Å; I268-L273 HydrophobicContact CB-CG 4.49Å; I268-L273 HydrophobicContact CG2-CD1 4.11Å; I268-L273 HydrophobicContact CG2-CD2 3.77Å; I268-L273 HydrophobicContact CG2-CG 3.75Å; I268-L273 WeakPolarHBondContact O-CD1 3.38Å
269	P	96.5	Very high	95.7	Very high	30 Å²	30	55.1 Å²	55.1	20%	0.195	29%	0.286	C	S	.	.			trans	-69	150.5	-172.2	25.9	-31.7	0	0	0	112.4	P141 S271 V272	P141-P269 HydrophobicContact CG-CG 3.67Å; P269-S271 PolarHBondContact O-N 2.88Å; P269-S271 VanDerWaalsContact O-N 3.08Å; P269-V272 HydrophobicContact CG-CG2 4.04Å; P269-V272 WeakPolarHBondContact O-CG2 3.27Å; P269-V272 PolarHBondContact O-N 3.27Å
270	P	97	Very high	95.8	Very high	46 Å²	46	55 Å²	55	30%	0.299	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-53.9	-31.7	177.6	-28.3	35.2	0	0	0	114	H265 V272 L273 G279 T280	H265-P270 HydrophobicContact CB-CG 4.24Å; P270-V272 PolarHBondContact O-N 3.34Å; P270-V272 VanDerWaalsContact O-N 3.09Å; P270-L273 PolarHBondContact O-N 3.43Å; P270-L273 VanDerWaalsContact O-N 3.13Å; P270-G279 CarbonylContact O-C 3.59Å; P270-G279 WeakPolarHBondContact O-CA 3.21Å; P270-T280 PolarHBondContact O-N 3.27Å
271	S	96.8	Very high	95.8	Very high	54 Å²	54	53.3 Å²	53.3	38%	0.378	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-61.1	-20.3	-177.6	56.7	0	0	0	0	114.4	R138 P269	R138-S271 PolarHBondContact NH2-O 3.04Å; P269-S271 PolarHBondContact O-N 2.88Å; P269-S271 VanDerWaalsContact O-N 3.08Å
272	V	96.8	Very high	96	Very high	11 Å²	11	51.5 Å²	51.5	7%	0.067	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-112.9	-3.3	179.4	-55.5	0	0	0	0	112.8	L136 R138 P139 D140 I146 I268 P269 P270	L136-V272 WeakPolarHBondContact CD1-O 3.25Å; R138-V272 HydrophobicContact CB-CG1 4.5Å; P139-V272 WeakPolarHBondContact O-CG1 3.48Å; D140-V272 HydrophobicContact CB-CG2 4.44Å; I146-V272 HydrophobicContact CD1-CB 4.31Å; I146-V272 HydrophobicContact CD1-CG2 3.55Å; I268-V272 HydrophobicContact CG2-CG2 3.72Å; P269-V272 HydrophobicContact CG-CG2 4.04Å; P269-V272 WeakPolarHBondContact O-CG2 3.27Å; P269-V272 PolarHBondContact O-N 3.27Å; P270-V272 PolarHBondContact O-N 3.34Å; P270-V272 VanDerWaalsContact O-N 3.09Å
273	L	97.4	Very high	96.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.272	C	S	.	.	S	Bend	trans	-91.8	148.9	179.1	-74.8	172.2	0	0	0	111.7	L136 L189 L264 I268 P270 G279 T280 A281	L136-L273 HydrophobicContact CD1-CD2 4.14Å; L189-L273 HydrophobicContact CD2-CD2 3.71Å; L264-L273 HydrophobicContact CD2-CD1 3.76Å; L264-L273 HydrophobicContact CG-CD1 4.14Å; I268-L273 HydrophobicContact CB-CD1 4.32Å; I268-L273 HydrophobicContact CB-CG 4.49Å; I268-L273 HydrophobicContact CG2-CD1 4.11Å; I268-L273 HydrophobicContact CG2-CD2 3.77Å; I268-L273 HydrophobicContact CG2-CG 3.75Å; I268-L273 WeakPolarHBondContact O-CD1 3.38Å; P270-L273 PolarHBondContact O-N 3.43Å; P270-L273 VanDerWaalsContact O-N 3.13Å; L273-G279 CarbonylContact O-C 3.48Å; L273-G279 VanDerWaalsContact O-CA 3.28Å; L273-G279 WeakPolarHBondContact O-CA 3.35Å; L273-T280 PolarHBondContact O-N 2.97Å; L273-A281 WeakPolarHBondContact O-CB 3.26Å; L273-A281 PolarHBondContact O-N 3.43Å
274	P	96.8	Very high	96.1	Very high	7 Å²	7	52 Å²	52	5%	0.045	27%	0.274	C	S	.	.			trans	-65.3	157.3	168.6	-16.5	28.8	0	0	0	112.8	L136 E276 Y277 G279 G282 L284	L136-P274 HydrophobicContact CD2-CG 3.98Å; P274-E276 VanDerWaalsContact CB-OE2 3.29Å; P274-E276 WeakPolarHBondContact CB-OE2 3.46Å; P274-E276 PolarHBondContact O-N 3.18Å; P274-Y277 HydrophobicContact CB-CD2 4.23Å; P274-Y277 HydrophobicContact CG-CD2 4.13Å; P274-Y277 CarbonylContact O-C 3.36Å; P274-Y277 PolarHBondContact O-N 2.99Å; P274-G279 WeakPolarHBondContact O-CA 3.44Å; P274-G279 PolarHBondContact O-N 3.02Å; P274-G282 CarbonylContact C-O 3.57Å; P274-G282 WeakPolarHBondContact CA-O 3.45Å; P274-L284 HydrophobicContact CB-CB 3.8Å; P274-L284 HydrophobicContact CG-CB 3.97Å; P274-L284 HydrophobicContact CG-CD1 3.8Å; P274-L284 HydrophobicContact CG-CG 4.43Å
275	E	96.9	Very high	95.9	Very high	113 Å²	113	55.7 Å²	55.7	53%	0.528	29%	0.294	S	S	.	.	G	3₁₀ helix	trans	-54.6	-38.3	175.8	-73.1	172.5	-165.7	0	0	112.4	Y277 G278 G282	E275-Y277 PolarHBondContact O-N 3.4Å; E275-G278 PolarHBondContact O-N 3.05Å; E275-G282 PolarHBondContact N-O 3.21Å
276	E	94.8	Very high	95.7	Very high	90 Å²	90	54.8 Å²	54.8	42%	0.421	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-60.6	-18.8	178.4	-62.6	86	171.8	0	0	113.4	P274 R283 L284	P274-E276 VanDerWaalsContact CB-OE2 3.29Å; P274-E276 WeakPolarHBondContact CB-OE2 3.46Å; P274-E276 PolarHBondContact O-N 3.18Å; E276-R283 IonicContact OE1-NE 2.86Å; E276-L284 PolarHBondContact OE1-N 3.26Å; E276-L284 PolarHBondContact OE2-N 2.96Å
277	Y	95.3	Very high	95.7	Very high	20 Å²	20	48.8 Å²	48.8	8%	0.078	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-116	23.8	179.6	-60.2	-76.3	0	0	0	112.4	F148 D191 I229 H265 P274 E275 G279 L284	F148-Y277 HydrophobicContact CE1-CD2 4.41Å; F148-Y277 AromaticContact CE1-CE2 3.6Å; F148-Y277 HydrophobicContact CE1-CE2 3.6Å; F148-Y277 AromaticContact CE1-CZ 3.84Å; F148-Y277 HydrophobicContact CZ-CD2 4.33Å; F148-Y277 AromaticContact CZ-CE1 3.99Å; F148-Y277 HydrophobicContact CZ-CE1 3.99Å; F148-Y277 AromaticContact CZ-CE2 3.55Å; F148-Y277 HydrophobicContact CZ-CE2 3.55Å; F148-Y277 AromaticContact CZ-CZ 3.35Å; F148-Y277 WeakPolarHBondContact CZ-OH 3.47Å; D191-Y277 HydrophobicContact CB-CE1 4.11Å; D191-Y277 VanDerWaalsContact OD2-CE1 3.31Å; D191-Y277 WeakPolarHBondContact OD2-CE1 3.42Å; D191-Y277 PolarHBondContact OD2-OH 3.12Å; I229-Y277 HydrophobicContact CD1-CD1 3.31Å; I229-Y277 HydrophobicContact CD1-CE1 3.48Å; I229-Y277 VanDerWaalsContact CD1-CE1 3.48Å; I229-Y277 HydrophobicContact CD1-CG 4.41Å; H265-Y277 PolarHBondContact NE2-O 3.47Å; P274-Y277 HydrophobicContact CB-CD2 4.23Å; P274-Y277 HydrophobicContact CG-CD2 4.13Å; P274-Y277 CarbonylContact O-C 3.36Å; P274-Y277 PolarHBondContact O-N 2.99Å; E275-Y277 PolarHBondContact O-N 3.4Å; Y277-G279 VanDerWaalsContact C-N 3.33Å; Y277-L284 HydrophobicContact CE2-CD2 4.14Å
278	G	95	Very high	95.8	Very high	34 Å²	34	47.9 Å²	47.9	35%	0.351	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.1	24.2	177.7	0	0	0	0	0	113.7	H265 E275	H265-G278 PolarHBondContact CE1-O 2.96Å; H265-G278 PolarHBondContact NE2-O 3.05Å; E275-G278 PolarHBondContact O-N 3.05Å
279	G	96.4	Very high	95.8	Very high	10 Å²	10	49.2 Å²	49.2	10%	0.103	28%	0.281	C	S	.	.			trans	-98.2	-175.1	176.8	0	0	0	0	0	114.4	P270 L273 P274 Y277	P270-G279 CarbonylContact O-C 3.59Å; P270-G279 WeakPolarHBondContact O-CA 3.21Å; L273-G279 CarbonylContact O-C 3.48Å; L273-G279 VanDerWaalsContact O-CA 3.28Å; L273-G279 WeakPolarHBondContact O-CA 3.35Å; P274-G279 WeakPolarHBondContact O-CA 3.44Å; P274-G279 PolarHBondContact O-N 3.02Å; Y277-G279 VanDerWaalsContact C-N 3.33Å
280	T	96.8	Very high	95.8	Very high	104 Å²	104	48.1 Å²	48.1	64%	0.638	28%	0.275	S	S	*	.	S	Bend	trans	-128.9	13.8	-179.1	60	0	0	0	0	112.6	P270 L273 G282	P270-T280 PolarHBondContact O-N 3.27Å; L273-T280 PolarHBondContact O-N 2.97Å; T280-G282 PolarHBondContact O-N 3.15Å
281	A	95.4	Very high	95.8	Very high	33 Å²	33	52 Å²	52	27%	0.273	28%	0.283	S	S	.	.	S	Bend	trans	-84.1	16.8	179.1	0	0	0	0	0	113.8	L273	L273-A281 WeakPolarHBondContact O-CB 3.26Å; L273-A281 PolarHBondContact O-N 3.43Å
282	G	95.6	Very high	95.9	Very high	25 Å²	25	52.7 Å²	52.7	26%	0.258	28%	0.282	S	S	.	.			trans	81.2	-169.9	-172.4	0	0	0	0	0	112.7	P274 E275 T280	P274-G282 CarbonylContact C-O 3.57Å; P274-G282 WeakPolarHBondContact CA-O 3.45Å; E275-G282 PolarHBondContact N-O 3.21Å; T280-G282 PolarHBondContact O-N 3.15Å
283	R	96.4	Very high	95.9	Very high	194 Å²	194	52.2 Å²	52.2	73%	0.732	28%	0.279	S	S	*	.	S	Bend	trans	-74.8	150.1	-179.5	-61.9	-174.1	67.5	177.2	2.6	111.8	E276 D285	E276-R283 IonicContact OE1-NE 2.86Å; R283-D285 PolarHBondContact O-N 3.27Å; R283-D285 VanDerWaalsContact O-N 3.11Å
284	L	95.3	Very high	95.9	Very high	32 Å²	32	54.5 Å²	54.5	17%	0.168	29%	0.291	C	S	.	.			trans	-63.5	112.2	177.1	176.8	64.1	0	0	0	111.5	T134 L136 F148 P274 E276 Y277 M286	T134-L284 HydrophobicContact CG2-CD1 4.09Å; L136-L284 HydrophobicContact CD2-CD1 4.13Å; F148-L284 HydrophobicContact CD1-CD1 4.08Å; F148-L284 HydrophobicContact CD1-CD2 4.3Å; F148-L284 HydrophobicContact CE1-CD1 4.32Å; F148-L284 HydrophobicContact CE1-CD2 3.79Å; P274-L284 HydrophobicContact CB-CB 3.8Å; P274-L284 HydrophobicContact CG-CB 3.97Å; P274-L284 HydrophobicContact CG-CD1 3.8Å; P274-L284 HydrophobicContact CG-CG 4.43Å; E276-L284 PolarHBondContact OE1-N 3.26Å; E276-L284 PolarHBondContact OE2-N 2.96Å; Y277-L284 HydrophobicContact CE2-CD2 4.14Å; L284-M286 HydrophobicContact CD1-SD 3.84Å; L284-M286 HydrophobicContact CD2-CG 4.27Å; L284-M286 HydrophobicContact CD2-SD 3.53Å; L284-M286 VanDerWaalsContact CD2-SD 3.53Å; L284-M286 HydrophobicContact CG-CG 4.18Å; L284-M286 HydrophobicContact CG-SD 3.63Å
285	D	93.6	Very high	96	Very high	77 Å²	77	60.7 Å²	60.7	41%	0.412	32%	0.324	S	S	.	.			trans	-92.3	111.8	168.8	-173.1	2.2	0	0	0	110.8	R283 S287 A288 R291	R283-D285 PolarHBondContact O-N 3.27Å; R283-D285 VanDerWaalsContact O-N 3.11Å; D285-S287 WeakPolarHBondContact OD1-CA 3.35Å; D285-S287 WeakPolarHBondContact OD1-CB 3.49Å; D285-S287 PolarHBondContact OD1-N 3.39Å; D285-S287 PolarHBondContact OD1-OG 3.3Å; D285-S287 PolarHBondContact OD2-OG 3.42Å; D285-A288 PolarHBondContact OD1-N 2.92Å; D285-A288 WeakPolarHBondContact OD2-CB 3.35Å; D285-R291 IonicContact OD2-NH2 2.98Å
286	M	91.6	Very high	96	Very high	32 Å²	32	56.2 Å²	56.2	16%	0.158	31%	0.305	C	S	.	.	S	Bend	trans	-87.3	-13.7	175.1	-62.4	-57.7	-53.7	0	0	113.1	G131 L133 T134 R150 L284 S290	G131-M286 WeakPolarHBondContact O-CE 3.39Å; L133-M286 WeakPolarHBondContact O-CE 3.27Å; T134-M286 HydrophobicContact CG2-CE 3.65Å; T134-M286 HydrophobicContact CG2-SD 3.61Å; R150-M286 VanDerWaalsContact CZ-SD 3.55Å; L284-M286 HydrophobicContact CD1-SD 3.84Å; L284-M286 HydrophobicContact CD2-CG 4.27Å; L284-M286 HydrophobicContact CD2-SD 3.53Å; L284-M286 VanDerWaalsContact CD2-SD 3.53Å; L284-M286 HydrophobicContact CG-CG 4.18Å; L284-M286 HydrophobicContact CG-SD 3.63Å; M286-S290 PolarHBondContact O-OG 3.06Å; M286-S290 VanDerWaalsContact O-OG 3.09Å
287	S	94.2	Very high	96.1	Very high	51 Å²	51	54.3 Å²	54.3	36%	0.357	30%	0.296	S	S	.	.	H	α-helix	trans	-89.2	-30.5	-173	75	0	0	0	0	113	D285 W289 S290 R291	D285-S287 WeakPolarHBondContact OD1-CA 3.35Å; D285-S287 WeakPolarHBondContact OD1-CB 3.49Å; D285-S287 PolarHBondContact OD1-N 3.39Å; D285-S287 PolarHBondContact OD1-OG 3.3Å; D285-S287 PolarHBondContact OD2-OG 3.42Å; S287-W289 PolarHBondContact O-N 3.38Å; S287-S290 PolarHBondContact O-N 3.26Å; S287-R291 WeakPolarHBondContact O-CB 3.44Å; S287-R291 WeakPolarHBondContact O-CG 3.47Å; S287-R291 PolarHBondContact O-N 2.92Å; S287-R291 PolarHBondContact O-NE 3.3Å; S287-R291 PolarHBondContact OG-NE 2.85Å; S287-R291 PolarHBondContact OG-NH2 2.87Å
288	A	95.8	Very high	96.1	Very high	42 Å²	42	61 Å²	61	35%	0.347	33%	0.328	S	S	.	.	H	α-helix	trans	-59	-51.1	-175.7	0	0	0	0	0	112.5	D285 R291 L292	D285-A288 PolarHBondContact OD1-N 2.92Å; D285-A288 WeakPolarHBondContact OD2-CB 3.35Å; A288-R291 PolarHBondContact O-N 2.93Å; A288-L292 WeakPolarHBondContact O-CB 3.27Å; A288-L292 PolarHBondContact O-N 2.81Å
289	W	97.4	Very high	96	Very high	28 Å²	28	63.4 Å²	63.4	11%	0.106	33%	0.33	C	S	.	.	H	α-helix	trans	-66.6	-40.2	178.8	-170.9	-106.3	0	0	0	112.2	T134 V135 T171 K174 L175 S287 R291 L292 L293	T134-W289 WeakPolarHBondContact OG1-CB 3.35Å; V135-W289 HydrophobicContact CB-CD2 3.63Å; V135-W289 HydrophobicContact CB-CE3 3.63Å; V135-W289 HydrophobicContact CB-CG 4.1Å; V135-W289 HydrophobicContact CB-CH2 4.38Å; V135-W289 HydrophobicContact CB-CZ2 4.4Å; V135-W289 HydrophobicContact CB-CZ3 4.01Å; V135-W289 HydrophobicContact CG1-CE3 4.36Å; V135-W289 HydrophobicContact CG1-CZ3 4.33Å; V135-W289 HydrophobicContact CG2-CD2 3.54Å; V135-W289 HydrophobicContact CG2-CE3 3.92Å; V135-W289 HydrophobicContact CG2-CG 4.07Å; V135-W289 HydrophobicContact CG2-CH2 3.97Å; V135-W289 HydrophobicContact CG2-CZ2 3.62Å; V135-W289 HydrophobicContact CG2-CZ3 4.11Å; T171-W289 HydrophobicContact CG2-CZ2 3.82Å; T171-W289 PolarHBondContact OG1-NE1 2.87Å; K174-W289 HydrophobicContact CB-CH2 4.28Å; K174-W289 HydrophobicContact CB-CZ2 4.16Å; K174-W289 HydrophobicContact CG-CH2 4.06Å; K174-W289 HydrophobicContact CG-CZ2 4.33Å; L175-W289 HydrophobicContact CD2-CH2 3.77Å; L175-W289 HydrophobicContact CD2-CZ2 4.32Å; L175-W289 HydrophobicContact CD2-CZ3 4.45Å; L175-W289 HydrophobicContact CG-CH2 3.98Å; L175-W289 HydrophobicContact CG-CZ2 4.08Å; S287-W289 PolarHBondContact O-N 3.38Å; W289-R291 PolarHBondContact O-N 3.33Å; W289-L292 HydrophobicContact CE3-CD1 4.32Å; W289-L292 HydrophobicContact CE3-CD2 4.3Å; W289-L292 HydrophobicContact CH2-CD2 4.23Å; W289-L292 HydrophobicContact CZ3-CD1 4.15Å; W289-L292 HydrophobicContact CZ3-CD2 4.04Å; W289-L292 PolarHBondContact O-N 3.23Å; W289-L293 HydrophobicContact CZ2-CD2 4.33Å; W289-L293 PolarHBondContact O-N 3.45Å
290	S	96.7	Very high	95.9	Very high	7 Å²	7	63.2 Å²	63.2	5%	0.049	33%	0.327	C	S	.	.	H	α-helix	trans	-61.3	-44	176.9	-57.7	0	0	0	0	112	M286 S287 L293 L294	M286-S290 PolarHBondContact O-OG 3.06Å; M286-S290 VanDerWaalsContact O-OG 3.09Å; S287-S290 PolarHBondContact O-N 3.26Å; S290-L293 PolarHBondContact O-N 2.86Å; S290-L294 VanDerWaalsContact O-CG 3.28Å; S290-L294 WeakPolarHBondContact O-CG 3.02Å; S290-L294 PolarHBondContact O-N 3.17Å
291	R	97.6	Very high	95.7	Very high	129 Å²	129	60.3 Å²	60.3	49%	0.487	31%	0.309	S	S	.	.	H	α-helix	trans	-61.1	-48.4	174.1	-77.6	-178.6	-80.1	116.7	-4.9	111.1	D285 S287 A288 W289 L293 L294 D295	D285-R291 IonicContact OD2-NH2 2.98Å; S287-R291 WeakPolarHBondContact O-CB 3.44Å; S287-R291 WeakPolarHBondContact O-CG 3.47Å; S287-R291 PolarHBondContact O-N 2.92Å; S287-R291 PolarHBondContact O-NE 3.3Å; S287-R291 PolarHBondContact OG-NE 2.85Å; S287-R291 PolarHBondContact OG-NH2 2.87Å; A288-R291 PolarHBondContact O-N 2.93Å; W289-R291 PolarHBondContact O-N 3.33Å; R291-L293 VanDerWaalsContact C-N 3.32Å; R291-L293 PolarHBondContact O-N 2.64Å; R291-L294 PolarHBondContact O-N 2.97Å; R291-L294 VanDerWaalsContact O-N 3.12Å; R291-D295 WeakPolarHBondContact O-CB 3.42Å; R291-D295 PolarHBondContact O-N 3.19Å
292	L	97.6	Very high	95.4	Very high	68 Å²	68	62.4 Å²	62.4	36%	0.356	32%	0.318	S	S	.	.	H	α-helix	trans	-55.9	-45.1	177	-178.4	154.6	0	0	0	112.3	K174 A288 W289 D295 C296	K174-L292 HydrophobicContact CD-CD2 4.47Å; K174-L292 HydrophobicContact CG-CD2 3.84Å; A288-L292 WeakPolarHBondContact O-CB 3.27Å; A288-L292 PolarHBondContact O-N 2.81Å; W289-L292 HydrophobicContact CE3-CD1 4.32Å; W289-L292 HydrophobicContact CE3-CD2 4.3Å; W289-L292 HydrophobicContact CH2-CD2 4.23Å; W289-L292 HydrophobicContact CZ3-CD1 4.15Å; W289-L292 HydrophobicContact CZ3-CD2 4.04Å; W289-L292 PolarHBondContact O-N 3.23Å; L292-D295 PolarHBondContact O-N 3.34Å; L292-C296 PolarHBondContact O-N 2.97Å; L292-C296 PolarHBondContact O-SG 3.21Å
293	L	97.6	Very high	95	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.1	-45.4	177.1	-75.4	179.7	0	0	0	111.6	P121 L128 K174 W289 S290 R291 C296 E297 F300	P121-L293 HydrophobicContact CB-CB 4.35Å; P121-L293 WeakPolarHBondContact CB-O 3.42Å; P121-L293 HydrophobicContact CG-CB 4.39Å; P121-L293 WeakPolarHBondContact CG-O 3.24Å; L128-L293 HydrophobicContact CD1-CD1 4.39Å; L128-L293 HydrophobicContact CD2-CD1 4.07Å; K174-L293 HydrophobicContact CB-CD2 4.02Å; K174-L293 HydrophobicContact CG-CD2 4.34Å; W289-L293 HydrophobicContact CZ2-CD2 4.33Å; W289-L293 PolarHBondContact O-N 3.45Å; S290-L293 PolarHBondContact O-N 2.86Å; R291-L293 VanDerWaalsContact C-N 3.32Å; R291-L293 PolarHBondContact O-N 2.64Å; L293-C296 CarbonylContact O-C 3.51Å; L293-C296 PolarHBondContact O-N 2.96Å; L293-C296 VanDerWaalsContact O-N 3.14Å; L293-E297 PolarHBondContact O-N 3.03Å; L293-F300 HydrophobicContact CD2-CE2 4.15Å; L293-F300 HydrophobicContact CD2-CZ 4.05Å
294	L	97.7	Very high	94.6	Very high	48 Å²	48	56.1 Å²	56.1	25%	0.251	29%	0.29	S	S	.	.	H	α-helix	trans	-63.4	-39.5	178.5	-69.5	165.5	0	0	0	112.2	P121 K125 S290 R291 C296 E297	P121-L294 HydrophobicContact CB-CD2 3.98Å; P121-L294 HydrophobicContact CB-CG 4.49Å; K125-L294 HydrophobicContact CG-CD1 4.47Å; K125-L294 HydrophobicContact CG-CD2 4.47Å; S290-L294 VanDerWaalsContact O-CG 3.28Å; S290-L294 WeakPolarHBondContact O-CG 3.02Å; S290-L294 PolarHBondContact O-N 3.17Å; R291-L294 PolarHBondContact O-N 2.97Å; R291-L294 VanDerWaalsContact O-N 3.12Å; L294-C296 PolarHBondContact O-N 3.01Å; L294-E297 VanDerWaalsContact O-CB 3.27Å; L294-E297 WeakPolarHBondContact O-CB 3.46Å; L294-E297 PolarHBondContact O-N 2.95Å; L294-E297 VanDerWaalsContact O-N 3.12Å
295	D	97.9	Very high	94.1	Very high	138 Å²	138	56.2 Å²	56.2	74%	0.738	29%	0.293	S	S	*	.	H	α-helix	trans	-65.4	-23.8	176.3	-64.9	-20.4	0	0	0	111.8	R291 L292	R291-D295 WeakPolarHBondContact O-CB 3.42Å; R291-D295 PolarHBondContact O-N 3.19Å; L292-D295 PolarHBondContact O-N 3.34Å
296	C	96.8	Very high	93.2	Very high	19 Å²	19	57.2 Å²	57.2	13%	0.128	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	16	175.4	-72.2	0	0	0	0	113.7	K174 L292 L293 L294 E298 E299 F300	K174-C296 WeakPolarHBondContact CE-SG 3.42Å; K174-C296 PolarHBondContact NZ-SG 3.35Å; L292-C296 PolarHBondContact O-N 2.97Å; L292-C296 PolarHBondContact O-SG 3.21Å; L293-C296 CarbonylContact O-C 3.51Å; L293-C296 PolarHBondContact O-N 2.96Å; L293-C296 VanDerWaalsContact O-N 3.14Å; L294-C296 PolarHBondContact O-N 3.01Å; C296-E298 VanDerWaalsContact C-N 3.3Å; C296-E298 PolarHBondContact O-N 3.06Å; C296-E299 HydrophobicContact CB-CG 4.5Å; C296-E299 WeakPolarHBondContact O-CB 3.22Å; C296-E299 PolarHBondContact O-N 3.49Å; C296-E299 VanDerWaalsContact O-N 3.12Å; C296-E299 PolarHBondContact SG-OE1 3.19Å; C296-F300 HydrophobicContact CB-CE2 4.1Å; C296-F300 VanDerWaalsContact O-CD2 3.22Å; C296-F300 WeakPolarHBondContact O-CD2 3.47Å
297	E	97	Very high	91.9	Very high	50 Å²	50	59.9 Å²	59.9	23%	0.234	32%	0.315	C	S	.	.	H	α-helix	trans	-54.5	-42.2	-174	179.2	145.3	164.6	0	0	113.8	K120 P121 S122 L293 L294 E299 F300 V301	K120-E297 HydrophobicContact CB-CG 4.46Å; P121-E297 HydrophobicContact CG-CB 4.45Å; S122-E297 VanDerWaalsContact CB-OE1 3.23Å; S122-E297 WeakPolarHBondContact CB-OE1 3.47Å; S122-E297 WeakPolarHBondContact CB-OE2 3.21Å; S122-E297 PolarHBondContact N-OE2 3.21Å; S122-E297 VanDerWaalsContact OG-CD 3.26Å; S122-E297 PolarHBondContact OG-OE1 3.12Å; S122-E297 PolarHBondContact OG-OE2 3.27Å; L293-E297 PolarHBondContact O-N 3.03Å; L294-E297 VanDerWaalsContact O-CB 3.27Å; L294-E297 WeakPolarHBondContact O-CB 3.46Å; L294-E297 PolarHBondContact O-N 2.95Å; L294-E297 VanDerWaalsContact O-N 3.12Å; E297-E299 VanDerWaalsContact C-N 3.28Å; E297-E299 PolarHBondContact O-N 3.11Å; E297-F300 PolarHBondContact O-N 2.94Å; E297-V301 HydrophobicContact CG-CG2 4.14Å; E297-V301 WeakPolarHBondContact O-CG2 3.02Å; E297-V301 PolarHBondContact O-N 2.83Å
298	E	94.8	Very high	90.1	Very high	161 Å²	161	60.2 Å²	60.2	75%	0.752	31%	0.312	S	S	*	.	H	α-helix	trans	-59.9	-36.7	-179.5	-65.3	-176.7	172.8	0	0	112.6	C296 F300 V301 V302	C296-E298 VanDerWaalsContact C-N 3.3Å; C296-E298 PolarHBondContact O-N 3.06Å; E298-F300 PolarHBondContact O-N 3.06Å; E298-V301 PolarHBondContact O-N 3.29Å; E298-V302 WeakPolarHBondContact O-CG2 3.23Å; E298-V302 PolarHBondContact O-N 3.4Å
299	E	93.6	Very high	88.1	Confident	84 Å²	84	63.4 Å²	63.4	39%	0.393	33%	0.33	S	S	.	.	H	α-helix	trans	-58	-39.8	176.1	-63.1	177.4	-147.8	0	0	111.1	K174 Q177 C296 E297 E303	K174-E299 VanDerWaalsContact NZ-CD 3.27Å; K174-E299 IonicContact NZ-OE1 3.86Å; K174-E299 PolarHBondContact NZ-OE1 3.09Å; K174-E299 IonicContact NZ-OE2 3.7Å; K174-E299 PolarHBondContact NZ-OE2 2.94Å; Q177-E299 PolarHBondContact NE2-OE2 3.17Å; C296-E299 HydrophobicContact CB-CG 4.5Å; C296-E299 WeakPolarHBondContact O-CB 3.22Å; C296-E299 PolarHBondContact O-N 3.49Å; C296-E299 VanDerWaalsContact O-N 3.12Å; C296-E299 PolarHBondContact SG-OE1 3.19Å; E297-E299 VanDerWaalsContact C-N 3.28Å; E297-E299 PolarHBondContact O-N 3.11Å; E299-E303 PolarHBondContact O-N 3.47Å
300	F	94.4	Very high	85.8	Confident	5 Å²	5	66.7 Å²	66.7	2%	0.022	35%	0.349	C	S	.	.	H	α-helix	trans	-79.9	-33.7	-179.2	-63.8	-74.8	0	0	0	112.5	K120 P121 L170 E173 K174 L293 C296 E297 E298 V302 E303 F304	K120-F300 HydrophobicContact CB-CB 4.26Å; P121-F300 VanDerWaalsContact CD-CD2 3.47Å; P121-F300 HydrophobicContact CG-CD2 3.41Å; P121-F300 VanDerWaalsContact CG-CD2 3.41Å; P121-F300 HydrophobicContact CG-CE2 3.77Å; P121-F300 HydrophobicContact CG-CG 4.22Å; L170-F300 HydrophobicContact CB-CE1 4.21Å; L170-F300 HydrophobicContact CB-CZ 4.35Å; L170-F300 HydrophobicContact CD2-CB 4.13Å; L170-F300 HydrophobicContact CD2-CD1 3.18Å; L170-F300 HydrophobicContact CD2-CD2 4.23Å; L170-F300 HydrophobicContact CD2-CE1 3.46Å; L170-F300 VanDerWaalsContact CD2-CE1 3.46Å; L170-F300 HydrophobicContact CD2-CE2 4.46Å; L170-F300 HydrophobicContact CD2-CG 3.59Å; L170-F300 HydrophobicContact CD2-CZ 4.1Å; L170-F300 HydrophobicContact CG-CE1 4.46Å; E173-F300 HydrophobicContact CB-CE1 3.93Å; K174-F300 HydrophobicContact CB-CZ 4.31Å; L293-F300 HydrophobicContact CD2-CE2 4.15Å; L293-F300 HydrophobicContact CD2-CZ 4.05Å; C296-F300 HydrophobicContact CB-CE2 4.1Å; C296-F300 VanDerWaalsContact O-CD2 3.22Å; C296-F300 WeakPolarHBondContact O-CD2 3.47Å; E297-F300 PolarHBondContact O-N 2.94Å; E298-F300 PolarHBondContact O-N 3.06Å; F300-V302 VanDerWaalsContact C-N 3.29Å; F300-V302 PolarHBondContact O-N 3.16Å; F300-E303 PolarHBondContact O-N 3.39Å; F300-F304 HydrophobicContact CB-CD2 4.36Å; F300-F304 HydrophobicContact CD1-CD2 4.09Å; F300-F304 AromaticContact CD1-CE2 3.92Å; F300-F304 HydrophobicContact CD1-CE2 3.92Å; F300-F304 WeakPolarHBondContact O-CB 3.41Å; F300-F304 PolarHBondContact O-N 3.09Å
301	V	92.8	Very high	83.4	Confident	44 Å²	44	73.6 Å²	73.6	27%	0.267	38%	0.38	S	S	.	.	H	α-helix	trans	-61	-41.3	173.7	170.1	0	0	0	0	110.8	K120 E297 E298 C305 Q306	K120-V301 HydrophobicContact CB-CG2 4.24Å; K120-V301 HydrophobicContact CD-CG2 3.77Å; E297-V301 HydrophobicContact CG-CG2 4.14Å; E297-V301 WeakPolarHBondContact O-CG2 3.02Å; E297-V301 PolarHBondContact O-N 2.83Å; E298-V301 PolarHBondContact O-N 3.29Å; V301-C305 HydrophobicContact CB-CB 4.49Å; V301-C305 HydrophobicContact CG1-CB 4.21Å; V301-C305 WeakPolarHBondContact O-CA 3.45Å; V301-C305 WeakPolarHBondContact O-CB 3.1Å; V301-C305 PolarHBondContact O-N 2.84Å; V301-Q306 PolarHBondContact O-N 3.36Å; V301-Q306 PolarHBondContact O-NE2 2.94Å
302	V	89	Confident	80.8	Confident	76 Å²	76	71.1 Å²	71.1	46%	0.461	40%	0.395	S	S	.	.	H	α-helix	trans	-65.8	-43.9	176.4	173.1	0	0	0	0	111.4	E298 F300 Q306 Y345	E298-V302 WeakPolarHBondContact O-CG2 3.23Å; E298-V302 PolarHBondContact O-N 3.4Å; F300-V302 VanDerWaalsContact C-N 3.29Å; F300-V302 PolarHBondContact O-N 3.16Å; V302-Q306 VanDerWaalsContact O-CG 3.3Å; V302-Q306 WeakPolarHBondContact O-CG 3.15Å; V302-Y345 HydrophobicContact CG1-CD1 4.16Å
303	E	86.8	Confident	78.1	Confident	63 Å²	63	71.5 Å²	71.5	29%	0.294	40%	0.4	S	S	.	.	H	α-helix	trans	-76.6	-36	-176.2	178.6	68.7	-157.8	0	0	113.6	R109 E299 F300	R109-E303 IonicContact CZ-OE1 3.07Å; R109-E303 IonicContact NH1-OE1 2.74Å; R109-E303 PolarHBondContact NH1-OE1 3.02Å; R109-E303 IonicContact NH2-OE1 2.62Å; R109-E303 PolarHBondContact NH2-OE1 3.34Å; E299-E303 PolarHBondContact O-N 3.47Å; F300-E303 PolarHBondContact O-N 3.39Å
304	F	88.4	Confident	75.4	Confident	25 Å²	25	77.8 Å²	77.8	11%	0.11	44%	0.438	C	S	.	.	H	α-helix	trans	-122.7	-10.5	-166.3	-63.9	-75.5	0	0	0	115.8	R109 F116 L119 Y169 E173 F300	R109-F304 VanDerWaalsContact CZ-CE1 3.49Å; F116-F304 HydrophobicContact CD1-CE1 4.44Å; L119-F304 HydrophobicContact CB-CB 3.88Å; L119-F304 HydrophobicContact CB-CD1 4.33Å; L119-F304 HydrophobicContact CB-CG 4.03Å; L119-F304 HydrophobicContact CD2-CD1 4.17Å; L119-F304 HydrophobicContact CD2-CE1 4.19Å; L119-F304 HydrophobicContact CD2-CG 4.38Å; L119-F304 HydrophobicContact CD2-CZ 4.44Å; L119-F304 HydrophobicContact CG-CG 4.42Å; L119-F304 WeakPolarHBondContact O-CB 3.45Å; Y169-F304 HydrophobicContact CD1-CZ 4.29Å; Y169-F304 HydrophobicContact CE1-CE1 4.06Å; Y169-F304 AromaticContact CE1-CZ 3.87Å; Y169-F304 HydrophobicContact CE1-CZ 3.87Å; E173-F304 HydrophobicContact CG-CE2 4.19Å; E173-F304 HydrophobicContact CG-CZ 3.85Å; F300-F304 HydrophobicContact CB-CD2 4.36Å; F300-F304 HydrophobicContact CD1-CD2 4.09Å; F300-F304 AromaticContact CD1-CE2 3.92Å; F300-F304 HydrophobicContact CD1-CE2 3.92Å; F300-F304 WeakPolarHBondContact O-CB 3.41Å; F300-F304 PolarHBondContact O-N 3.09Å
305	C	85.3	Confident	72.8	Confident	33 Å²	33	80.6 Å²	80.6	22%	0.223	45%	0.452	C	S	.	.	S	Bend	trans	-119.7	-0.4	-171.4	-50.8	0	0	0	0	114.1	D118 V301	D118-C305 PolarHBondContact OD1-SG 2.96Å; V301-C305 HydrophobicContact CB-CB 4.49Å; V301-C305 HydrophobicContact CG1-CB 4.21Å; V301-C305 WeakPolarHBondContact O-CA 3.45Å; V301-C305 WeakPolarHBondContact O-CB 3.1Å; V301-C305 PolarHBondContact O-N 2.84Å
306	Q	74.8	Confident	70	Confident	99 Å²	99	77.6 Å²	77.6	46%	0.463	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-73.8	134.5	176.1	-59.9	-57	-46.8	0	0	110.5	V301 V302	V301-Q306 PolarHBondContact O-N 3.36Å; V301-Q306 PolarHBondContact O-NE2 2.94Å; V302-Q306 VanDerWaalsContact O-CG 3.3Å; V302-Q306 WeakPolarHBondContact O-CG 3.15Å
307	P	63.5	Low	67.3	Low	88 Å²	88	83.3 Å²	83.3	57%	0.571	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-61.7	149.6	173.4	25.4	-31.7	0	0	0	110.1	P309	P307-P309 VanDerWaalsContact O-CD 3.31Å; P307-P309 WeakPolarHBondContact O-CD 3.45Å
308	D	57.8	Low	64.6	Low	58 Å²	58	85.3 Å²	85.3	31%	0.31	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-60.2	124.1	169.7	-175.1	-40.4	0	0	0	107.5	R76 L310 E311	R76-D308 IonicContact CZ-OD1 2.68Å; R76-D308 IonicContact CZ-OD2 2.77Å; R76-D308 IonicContact NE-OD2 3.5Å; R76-D308 IonicContact NH1-OD1 3.15Å; R76-D308 PolarHBondContact NH1-OD1 3.4Å; R76-D308 IonicContact NH1-OD2 2.9Å; R76-D308 PolarHBondContact NH1-OD2 3.47Å; R76-D308 IonicContact NH2-OD1 3.53Å; R76-D308 PolarHBondContact NH2-OD1 2.79Å; R76-D308 IonicContact NH2-OD2 3.84Å; R76-D308 PolarHBondContact NH2-OD2 3.44Å; D308-L310 PolarHBondContact O-N 2.79Å; D308-L310 WeakPolarHBondContact OD1-CB 3.43Å; D308-L310 PolarHBondContact OD1-N 3.33Å; D308-E311 HydrophobicContact CB-CB 3.97Å; D308-E311 HydrophobicContact CB-CG 3.89Å; D308-E311 PolarHBondContact N-OE2 3.06Å; D308-E311 WeakPolarHBondContact O-CB 3.44Å; D308-E311 PolarHBondContact O-N 3.18Å
309	P	53	Low	62	Low	109 Å²	109	83.6 Å²	83.6	71%	0.708	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-13.1	179.8	-25.4	33.5	0	0	0	114.4	P307	P307-P309 VanDerWaalsContact O-CD 3.31Å; P307-P309 WeakPolarHBondContact O-CD 3.45Å
310	L	48.7	Very low	59.6	Low	96 Å²	96	86.3 Å²	86.3	50%	0.503	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	2.1	177	-62.8	174.4	0	0	0	113.8	D308 G312 V313	D308-L310 PolarHBondContact O-N 2.79Å; D308-L310 WeakPolarHBondContact OD1-CB 3.43Å; D308-L310 PolarHBondContact OD1-N 3.33Å; L310-G312 PolarHBondContact O-N 3.03Å; L310-V313 HydrophobicContact CD2-CB 4.06Å; L310-V313 HydrophobicContact CD2-CG1 4.3Å; L310-V313 HydrophobicContact CD2-CG2 3.96Å; L310-V313 PolarHBondContact O-N 3.36Å; L310-V313 VanDerWaalsContact O-N 3.13Å
311	E	45.7	Very low	56.8	Low	152 Å²	152	91.5 Å²	91.5	71%	0.71	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	104.9	169.4	-107.4	174.7	150.8	0	0	109.1	D308	D308-E311 HydrophobicContact CB-CB 3.97Å; D308-E311 HydrophobicContact CB-CG 3.89Å; D308-E311 PolarHBondContact N-OE2 3.06Å; D308-E311 WeakPolarHBondContact O-CB 3.44Å; D308-E311 PolarHBondContact O-N 3.18Å
312	G	43.6	Very low	54	Low	77 Å²	77	98.5 Å²	98.5	79%	0.794	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.9	0.6	-178.8	0	0	0	0	0	115.7	L310 V314	L310-G312 PolarHBondContact O-N 3.03Å; G312-V314 PolarHBondContact O-N 3.1Å
313	V	40.7	Very low	51.4	Low	77 Å²	77	98.1 Å²	98.1	47%	0.467	58%	0.577	S	S	.	*			trans	-81.2	99	172.1	-179.4	0	0	0	0	109.3	L310 L315	L310-V313 HydrophobicContact CD2-CB 4.06Å; L310-V313 HydrophobicContact CD2-CG1 4.3Å; L310-V313 HydrophobicContact CD2-CG2 3.96Å; L310-V313 PolarHBondContact O-N 3.36Å; L310-V313 VanDerWaalsContact O-N 3.13Å; V313-L315 HydrophobicContact CG1-CD2 4.23Å; V313-L315 PolarHBondContact O-N 3.41Å; V313-L315 VanDerWaalsContact O-N 3.16Å
314	V	41.3	Very low	48.9	Very low	132 Å²	132	103.8 Å²	103.8	80%	0.8	60%	0.603	S	S	*	*			trans	-69.6	104.2	162.3	-179.2	0	0	0	0	106.6	G312 P316	G312-V314 PolarHBondContact O-N 3.1Å; V314-P316 WeakPolarHBondContact O-CD 3.16Å
315	L	42.7	Very low	46.2	Very low	106 Å²	106	111 Å²	111	56%	0.555	64%	0.637	S	S	*	*			trans	-62.9	125	171.9	-69.2	169	0	0	0	107.8	V313 M319	V313-L315 HydrophobicContact CG1-CD2 4.23Å; V313-L315 PolarHBondContact O-N 3.41Å; V313-L315 VanDerWaalsContact O-N 3.16Å; L315-M319 HydrophobicContact CD2-SD 4.19Å
316	P	38.3	Very low	43.7	Very low	75 Å²	75	114.4 Å²	114.4	49%	0.487	67%	0.668	S	S	.	*			trans	-60.9	142.3	175.7	22.1	-29.7	0	0	0	110	V314 S318 M319	V314-P316 WeakPolarHBondContact O-CD 3.16Å; P316-S318 PolarHBondContact O-N 3.08Å; P316-M319 PolarHBondContact O-N 3.15Å
317	D	40.8	Very low	41.6	Very low	140 Å²	140	113.2 Å²	113.2	75%	0.749	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-52.6	-17	-176.5	-76.1	-32.7	0	0	0	114.1	M319 L320	D317-M319 PolarHBondContact O-N 3.15Å; D317-M319 VanDerWaalsContact O-N 3.15Å; D317-L320 PolarHBondContact O-N 2.98Å; D317-L320 VanDerWaalsContact O-N 3.16Å
318	S	39.9	Very low	40.5	Very low	92 Å²	92	113 Å²	113	64%	0.643	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-65.3	-7	171	62.5	0	0	0	0	114.8	P316	P316-S318 PolarHBondContact O-N 3.08Å
319	M	40.9	Very low	39.4	Very low	124 Å²	124	121.2 Å²	121.2	61%	0.611	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-95.6	-1.6	174.1	-65.8	-128.8	-176.9	0	0	113.6	L315 P316 D317	L315-M319 HydrophobicContact CD2-SD 4.19Å; P316-M319 PolarHBondContact O-N 3.15Å; D317-M319 PolarHBondContact O-N 3.15Å; D317-M319 VanDerWaalsContact O-N 3.15Å
320	L	42	Very low	38.6	Very low	142 Å²	142	124.1 Å²	124.1	74%	0.743	73%	0.727	S	S	*	*			trans	-101.4	66.6	170.6	-64.8	174.5	0	0	0	109.3	D317	D317-L320 PolarHBondContact O-N 2.98Å; D317-L320 VanDerWaalsContact O-N 3.16Å
321	C	35.6	Very low	38	Very low	114 Å²	114	127.9 Å²	127.9	77%	0.77	74%	0.742	S	S	*	*			trans	-98.2	115.4	170	-74.8	0	0	0	0	110.4
322	E	34.5	Very low	37.5	Very low	190 Å²	190	126.7 Å²	126.7	89%	0.888	74%	0.74	S	S	*	*			trans	-57.2	141.7	164.8	-64.1	-179.5	136.2	0	0	111.2
323	G	34.6	Very low	36.9	Very low	69 Å²	69	124.9 Å²	124.9	71%	0.711	72%	0.722	S	S	*	*			trans	64.9	109.9	138.4	0	0	0	0	0	120.1
324	E	34.3	Very low	36.8	Very low	181 Å²	181	128.5 Å²	128.5	85%	0.846	73%	0.731	S	S	*	*			trans	80.9	117.2	141.7	-66	-170.4	120	0	0	121.4
325	Q	32.5	Very low	36.7	Very low	176 Å²	176	131.1 Å²	131.1	82%	0.822	73%	0.727	S	S	*	*			trans	92.1	117.4	142.9	-71	-178.3	28	0	0	121.7
326	A	32.5	Very low	36.2	Very low	105 Å²	105	128.3 Å²	128.3	87%	0.868	72%	0.719	S	S	*	*			trans	87.7	120.2	135.8	0	0	0	0	0	119.6
327	G	29.7	Very low	35.8	Very low	74 Å²	74	130 Å²	130	76%	0.763	72%	0.723	S	S	*	*			trans	130.2	93.9	149.3	0	0	0	0	0	114.9	R329	G327-R329 PolarHBondContact O-N 3.34Å; G327-R329 VanDerWaalsContact O-N 3.13Å
328	G	41.1	Very low	35.7	Very low	84 Å²	84	130.5 Å²	130.5	87%	0.866	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	110.5	173	0	0	0	0	0	112.4
329	R	35.5	Very low	35.5	Very low	231 Å²	231	128.8 Å²	128.8	87%	0.872	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.2	-10	151.7	-124.3	174	175.4	-178	-2.7	114.6	G327	G327-R329 PolarHBondContact O-N 3.34Å; G327-R329 VanDerWaalsContact O-N 3.13Å
330	E	34.9	Very low	35.1	Very low	170 Å²	170	128.9 Å²	128.9	79%	0.794	70%	0.702	S	S	*	*	S	Bend	trans	-96.4	-19	-176.4	-72.2	-174.3	151.4	0	0	115	D332 G333	E330-D332 PolarHBondContact O-N 2.96Å; E330-G333 PolarHBondContact O-N 3.12Å
331	E	36.2	Very low	34.8	Very low	174 Å²	174	127.8 Å²	127.8	81%	0.813	70%	0.696	S	S	*	*	H	α-helix	trans	-68.4	-30.4	179.4	-74	-169.9	146.9	0	0	113.5	R335	E331-R335 PolarHBondContact O-N 3.09Å
332	D	36.5	Very low	35.1	Very low	128 Å²	128	129 Å²	129	68%	0.684	69%	0.685	S	S	*	*	H	α-helix	trans	-71.7	-33.7	-179.9	-86.8	-22.5	0	0	0	112.6	E330 A336	E330-D332 PolarHBondContact O-N 2.96Å; D332-A336 WeakPolarHBondContact O-CB 3.4Å; D332-A336 PolarHBondContact O-N 3.47Å
333	G	30.1	Very low	35.1	Very low	39 Å²	39	127.1 Å²	127.1	40%	0.402	67%	0.671	S	S	.	*	H	α-helix	trans	-68.3	-39.5	176.5	0	0	0	0	0	112.4	E330 A336 L337	E330-G333 PolarHBondContact O-N 3.12Å; G333-A336 PolarHBondContact O-N 3.3Å; G333-L337 PolarHBondContact O-N 3.04Å
334	F	38.9	Very low	34.8	Very low	152 Å²	152	129 Å²	129	67%	0.667	67%	0.672	S	S	*	*	H	α-helix	trans	-69.9	-36.2	178.5	-114.2	-95.2	0	0	0	112.8	R338	F334-R338 PolarHBondContact O-N 3.27Å
335	R	38.2	Very low	35	Very low	188 Å²	188	130.8 Å²	130.8	71%	0.709	67%	0.673	S	S	*	*	H	α-helix	trans	-67.9	-41.3	172.3	-114.6	180	179	-173.4	0	111.9	E331 S339	E331-R335 PolarHBondContact O-N 3.09Å; R335-S339 VanDerWaalsContact O-CB 3.3Å; R335-S339 WeakPolarHBondContact O-CB 3.32Å; R335-S339 PolarHBondContact O-N 3.4Å
336	A	31.9	Very low	35.1	Very low	47 Å²	47	128.6 Å²	128.6	39%	0.388	67%	0.665	S	S	.	*	H	α-helix	trans	-65.8	-42.7	179.7	0	0	0	0	0	112.6	D332 G333 S339 Q340	D332-A336 WeakPolarHBondContact O-CB 3.4Å; D332-A336 PolarHBondContact O-N 3.47Å; G333-A336 PolarHBondContact O-N 3.3Å; A336-S339 PolarHBondContact O-N 2.83Å; A336-Q340 WeakPolarHBondContact O-CB 3.36Å; A336-Q340 WeakPolarHBondContact O-CG 3.49Å; A336-Q340 PolarHBondContact O-N 2.98Å
337	L	31.4	Very low	35.3	Very low	110 Å²	110	129.8 Å²	129.8	58%	0.576	66%	0.655	S	S	*	*	H	α-helix	trans	-67.2	-40.7	177.3	-99.5	147.9	0	0	0	112.9	G333 S339 Q340 L341	G333-L337 PolarHBondContact O-N 3.04Å; L337-S339 VanDerWaalsContact C-N 3.34Å; L337-Q340 PolarHBondContact O-N 3.12Å; L337-L341 WeakPolarHBondContact O-CG 3.44Å; L337-L341 PolarHBondContact O-N 3.23Å; L337-L341 VanDerWaalsContact O-N 3.17Å
338	R	38.7	Very low	35.6	Very low	150 Å²	150	132.9 Å²	132.9	57%	0.566	65%	0.649	S	S	*	*	H	α-helix	trans	-62.9	-42.1	172.4	-86.9	-175.7	164.1	-177.5	-2.9	111.4	F334 Y342	F334-R338 PolarHBondContact O-N 3.27Å; R338-Y342 WeakPolarHBondContact O-CD2 3.45Å
339	S	36.1	Very low	35.2	Very low	57 Å²	57	135.8 Å²	135.8	40%	0.399	64%	0.636	S	S	.	*	H	α-helix	trans	-64.2	-45.5	177.8	-155.4	0	0	0	0	111.5	R335 A336 L337 L341 Y342 Y343	R335-S339 VanDerWaalsContact O-CB 3.3Å; R335-S339 WeakPolarHBondContact O-CB 3.32Å; R335-S339 PolarHBondContact O-N 3.4Å; A336-S339 PolarHBondContact O-N 2.83Å; L337-S339 VanDerWaalsContact C-N 3.34Å; S339-L341 PolarHBondContact O-N 3.45Å; S339-Y342 PolarHBondContact O-N 2.91Å; S339-Y342 VanDerWaalsContact O-N 3.07Å; S339-Y343 WeakPolarHBondContact O-CD2 3.12Å; S339-Y343 PolarHBondContact O-N 3.3Å; S339-Y343 WeakPolarHBondContact OG-CE2 3.48Å
340	Q	30.8	Very low	35.2	Very low	126 Å²	126	129.8 Å²	129.8	59%	0.589	62%	0.621	S	S	*	*	H	α-helix	trans	-64	-33.5	-179.7	-79	177.7	-14.7	0	0	113.9	A336 L337 Y342 Y343	A336-Q340 WeakPolarHBondContact O-CB 3.36Å; A336-Q340 WeakPolarHBondContact O-CG 3.49Å; A336-Q340 PolarHBondContact O-N 2.98Å; L337-Q340 PolarHBondContact O-N 3.12Å; Q340-Y342 PolarHBondContact O-N 3.13Å; Q340-Y343 PolarHBondContact O-N 3.15Å; Q340-Y343 VanDerWaalsContact O-N 3.15Å
341	L	37.5	Very low	35.2	Very low	119 Å²	119	127.1 Å²	127.1	62%	0.623	61%	0.609	S	S	*	*	H	α-helix	trans	-68.5	-21.9	174.7	-74.7	165.5	0	0	0	113.3	L337 S339	L337-L341 WeakPolarHBondContact O-CG 3.44Å; L337-L341 PolarHBondContact O-N 3.23Å; L337-L341 VanDerWaalsContact O-N 3.17Å; S339-L341 PolarHBondContact O-N 3.45Å
342	Y	40.5	Very low	35.2	Very low	139 Å²	139	123.8 Å²	123.8	55%	0.545	60%	0.595	S	S	.	*	H	α-helix	trans	-90.2	-11.5	172	-72.6	-72.6	0	0	0	113.5	R338 S339 Q340	R338-Y342 WeakPolarHBondContact O-CD2 3.45Å; S339-Y342 PolarHBondContact O-N 2.91Å; S339-Y342 VanDerWaalsContact O-N 3.07Å; Q340-Y342 PolarHBondContact O-N 3.13Å
343	Y	34.8	Very low	35.1	Very low	151 Å²	151	123.5 Å²	123.5	59%	0.592	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-3.8	175.7	-82.6	-71.6	0	0	0	113.8	P31 S339 Q340	P31-Y343 HydrophobicContact CG-CD1 4.09Å; P31-Y343 HydrophobicContact CG-CE1 3.74Å; S339-Y343 WeakPolarHBondContact O-CD2 3.12Å; S339-Y343 PolarHBondContact O-N 3.3Å; S339-Y343 WeakPolarHBondContact OG-CE2 3.48Å; Q340-Y343 PolarHBondContact O-N 3.15Å; Q340-Y343 VanDerWaalsContact O-N 3.15Å
344	C	29.3	Very low	35.5	Very low	108 Å²	108	130.5 Å²	130.5	73%	0.73	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	15.9	174.5	-66.9	0	0	0	0	113.8
345	Y	37.7	Very low	35.2	Very low	219 Å²	219	128.5 Å²	128.5	86%	0.859	60%	0.598	S	S	*	*			trans	-126	0	175.9	-68.3	-77.2	0	0	0	111.6	V302	V302-Y345 HydrophobicContact CG1-CD1 4.16Å

Retrieved 345 of 345 residues in 258.6 ms (Link to these results)

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