A0A087X6K7_POEFO Loading...

Nipsnap homolog 3A (C. elegans)

AlphaFold DB , UniProt , Accession A0A087X6K7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 256 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	41.7	Very low	31.5	Very low	249 Å²	249	166.8 Å²	166.8	100%	1.227	84%	0.837	S	S	*	*				0	96.7	0	-149.6	168.2	-175.7	0	0	106.9
2	F	31.7	Very low	31.3	Very low	213 Å²	213	159.1 Å²	159.1	93%	0.934	83%	0.831	S	S	*	*			trans	-101.4	143.1	177.1	-95.4	-90.3	0	0	0	108.6
3	C	27.4	Very low	31.5	Very low	124 Å²	124	155.5 Å²	155.5	84%	0.838	83%	0.827	S	S	*	*			trans	150.2	149.4	151.1	-94.7	0	0	0	0	109.8
4	T	31.1	Very low	31.6	Very low	126 Å²	126	156.7 Å²	156.7	77%	0.773	83%	0.833	S	S	*	*			cis	-172.5	155.7	-16.1	-76.7	0	0	0	0	105.9
5	V	33	Very low	32.1	Very low	124 Å²	124	161.2 Å²	161.2	75%	0.752	83%	0.834	S	S	*	*			trans	-74.5	149.8	-177.3	176.3	0	0	0	0	114.5
6	K	32.4	Very low	32.5	Very low	199 Å²	199	159.3 Å²	159.3	87%	0.865	83%	0.834	S	S	*	*			trans	158.8	119.5	133	-92.1	176	175.4	178.6	0	109.9
7	M	29	Very low	32.9	Very low	165 Å²	165	157.1 Å²	157.1	81%	0.813	84%	0.836	S	S	*	*				77.3	107.2	60.1	-157.5	-158.6	-96.3	0	0	115.2
8	L	29.3	Very low	33.2	Very low	141 Å²	141	153.8 Å²	153.8	74%	0.738	83%	0.834	S	S	*	*			trans	170.6	115.3	131.2	-118.1	63.7	0	0	0	108.7
9	K	30.1	Very low	33.6	Very low	177 Å²	177	150.2 Å²	150.2	77%	0.77	83%	0.827	S	S	*	*				60.3	131.1	98.2	-75.2	-175.6	-179.5	-173.2	0	113.3
10	L	30.2	Very low	33.9	Very low	123 Å²	123	151.1 Å²	151.1	64%	0.644	83%	0.83	S	S	*	*			cis	-178.1	151.5	47.5	-144.4	68.3	0	0	0	111.3
11	F	30.2	Very low	34	Very low	194 Å²	194	153 Å²	153	85%	0.851	83%	0.83	S	S	*	*			trans	69.3	129.9	153.8	-65	-53.7	0	0	0	124.2
12	G	28.9	Very low	33.7	Very low	74 Å²	74	152.6 Å²	152.6	76%	0.763	82%	0.815	S	S	*	*			trans	159.3	86.7	143.7	0	0	0	0	0	118.1
13	S	34	Very low	33.9	Very low	113 Å²	113	148.9 Å²	148.9	79%	0.79	81%	0.81	S	S	*	*			trans	71.8	106.1	151.9	-159	0	0	0	0	120.4
14	L	33.3	Very low	34.6	Very low	172 Å²	172	149.6 Å²	149.6	90%	0.901	81%	0.811	S	S	*	*			trans	-74.5	130	159.1	-77.6	144.2	0	0	0	110.5
15	R	38.5	Very low	35	Very low	224 Å²	224	148.1 Å²	148.1	85%	0.845	81%	0.811	S	S	*	*			trans	-131.1	120.1	151.8	-75.2	-172.1	176.9	-167.8	-0	108.4	S17	R15-S17 PolarHBondContact O-N 3.42Å
16	P	38.9	Very low	35.5	Very low	130 Å²	130	146.9 Å²	146.9	84%	0.844	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-78	121.7	173.7	29.5	-28.3	0	0	0	109.2
17	S	39.4	Very low	36	Very low	123 Å²	123	142 Å²	142	86%	0.86	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-75.4	121.4	165.9	-68.9	0	0	0	0	108.4	R15 A19	R15-S17 PolarHBondContact O-N 3.42Å; S17-A19 PolarHBondContact O-N 3.22Å
18	A	38.8	Very low	36.7	Very low	98 Å²	98	138.9 Å²	138.9	81%	0.81	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-61.3	116.7	176.4	0	0	0	0	0	110.1	L20	A18-L20 PolarHBondContact O-N 2.81Å
19	A	40.1	Very low	37.2	Very low	84 Å²	84	140.5 Å²	140.5	69%	0.694	82%	0.815	S	S	*	*			trans	-71.3	112	168.5	0	0	0	0	0	108.7	S17 F21	S17-A19 PolarHBondContact O-N 3.22Å; A19-F21 PolarHBondContact O-N 3.11Å; A19-F21 VanDerWaalsContact O-N 3.1Å
20	L	38.8	Very low	37.4	Very low	168 Å²	168	138 Å²	138	88%	0.88	82%	0.817	S	S	*	*			trans	-65.6	103.9	168.5	-85.8	149.7	0	0	0	108.8	A18 R22	A18-L20 PolarHBondContact O-N 2.81Å; L20-R22 PolarHBondContact O-N 3.13Å; L20-R22 VanDerWaalsContact O-N 3.09Å
21	F	36.4	Very low	38	Very low	193 Å²	193	136 Å²	136	85%	0.846	81%	0.813	S	S	*	*			trans	-62.8	107.3	164.5	-81.8	-88.1	0	0	0	108.7	A19 T23	A19-F21 PolarHBondContact O-N 3.11Å; A19-F21 VanDerWaalsContact O-N 3.1Å; F21-T23 PolarHBondContact O-N 3.19Å; F21-T23 VanDerWaalsContact O-N 3.15Å
22	R	36.4	Very low	38.3	Very low	240 Å²	240	130.9 Å²	130.9	91%	0.906	81%	0.807	S	S	*	*			trans	-69.1	104.2	163.4	-80.7	-178.3	171.6	-177.1	-2.7	107.7	L20 T24	L20-R22 PolarHBondContact O-N 3.13Å; L20-R22 VanDerWaalsContact O-N 3.09Å; R22-T24 PolarHBondContact O-N 3.04Å
23	T	36.1	Very low	38.8	Very low	135 Å²	135	134.7 Å²	134.7	83%	0.828	80%	0.804	S	S	*	*			trans	-64.4	112.3	164.1	35.8	0	0	0	0	108.3	F21 A25	F21-T23 PolarHBondContact O-N 3.19Å; F21-T23 VanDerWaalsContact O-N 3.15Å; T23-A25 PolarHBondContact O-N 3.36Å
24	T	41.1	Very low	39.3	Very low	139 Å²	139	134.3 Å²	134.3	85%	0.853	79%	0.793	S	S	*	*			trans	-66	104.7	166.2	47.1	0	0	0	0	107.6	R22 A26	R22-T24 PolarHBondContact O-N 3.04Å; T24-A26 PolarHBondContact O-N 3.1Å; T24-A26 VanDerWaalsContact O-N 3.14Å
25	A	40.4	Very low	39.8	Very low	95 Å²	95	128.2 Å²	128.2	79%	0.785	77%	0.767	S	S	*	*			trans	-58.5	116.8	169.7	0	0	0	0	0	108.3	T23 A27	T23-A25 PolarHBondContact O-N 3.36Å; A25-A27 PolarHBondContact O-N 2.97Å
26	A	43.8	Very low	40.2	Very low	97 Å²	97	122 Å²	122	80%	0.802	76%	0.755	S	S	*	*			trans	-56.8	121.4	170.5	0	0	0	0	0	108.1	T24 A28	T24-A26 PolarHBondContact O-N 3.1Å; T24-A26 VanDerWaalsContact O-N 3.14Å; A26-A28 PolarHBondContact O-N 2.88Å
27	A	42.8	Very low	40.7	Very low	98 Å²	98	117.6 Å²	117.6	81%	0.81	73%	0.732	S	S	*	*			trans	-58.3	112.6	175	0	0	0	0	0	108.6	A25 Q29	A25-A27 PolarHBondContact O-N 2.97Å; A27-Q29 PolarHBondContact O-N 3.34Å
28	A	43.8	Very low	41.1	Very low	99 Å²	99	116.8 Å²	116.8	82%	0.818	72%	0.724	S	S	*	*			trans	-60.7	120.3	174	0	0	0	0	0	108.6	A26	A26-A28 PolarHBondContact O-N 2.88Å
29	Q	38.9	Very low	41.5	Very low	174 Å²	174	119.6 Å²	119.6	81%	0.813	72%	0.72	S	S	*	*			trans	-60.5	136.5	169.9	-72.5	-168.5	-45.2	0	0	108.8	A27 S31	A27-Q29 PolarHBondContact O-N 3.34Å; Q29-S31 PolarHBondContact O-N 3.43Å; Q29-S31 VanDerWaalsContact O-N 3.09Å
30	P	34.6	Very low	42.1	Very low	125 Å²	125	117.8 Å²	117.8	81%	0.812	70%	0.697	S	S	*	*			trans	-65.5	115.2	176	-1.7	12.1	0	0	0	109.1	A32	P30-A32 VanDerWaalsContact C-N 3.31Å; P30-A32 PolarHBondContact O-N 2.85Å
31	S	42	Very low	42.9	Very low	81 Å²	81	117.6 Å²	117.6	57%	0.566	69%	0.692	S	S	*	*			trans	-67.3	91.4	164.8	-56.2	0	0	0	0	107.9	Q29 H33	Q29-S31 PolarHBondContact O-N 3.43Å; Q29-S31 VanDerWaalsContact O-N 3.09Å; S31-H33 PolarHBondContact O-CD2 2.83Å; S31-H33 PolarHBondContact O-N 2.75Å
32	A	36.7	Very low	44	Very low	86 Å²	86	112.7 Å²	112.7	71%	0.711	67%	0.672	S	S	*	*			trans	-68.4	98.1	172.9	0	0	0	0	0	108.9	P30 L34	P30-A32 VanDerWaalsContact C-N 3.31Å; P30-A32 PolarHBondContact O-N 2.85Å; A32-L34 PolarHBondContact O-N 3.26Å
33	H	40.7	Very low	46.2	Very low	154 Å²	154	110.1 Å²	110.1	71%	0.713	66%	0.662	S	S	*	*			trans	-83.6	85	170.3	-71.3	-80.1	0	0	0	108.8	S31 A35	S31-H33 PolarHBondContact O-CD2 2.83Å; S31-H33 PolarHBondContact O-N 2.75Å; H33-A35 PolarHBondContact O-N 3.47Å
34	L	43.8	Very low	48.9	Very low	105 Å²	105	105.1 Å²	105.1	55%	0.55	63%	0.632	S	S	.	*			trans	-83.4	65	167.5	-63.4	171.5	0	0	0	108.7	A32	A32-L34 PolarHBondContact O-N 3.26Å
35	A	44.1	Very low	51.5	Low	44 Å²	44	98.5 Å²	98.5	36%	0.364	59%	0.591	S	S	.	*			trans	-111.6	115.6	-178.8	0	0	0	0	0	110.4	H33 G37	H33-A35 PolarHBondContact O-N 3.47Å; A35-G37 PolarHBondContact O-N 3.37Å
36	T	46.6	Very low	54.2	Low	95 Å²	95	94.5 Å²	94.5	58%	0.583	56%	0.556	S	S	*	*	S	Bend	trans	-86.1	44.8	175.3	56.4	0	0	0	0	112.8
37	G	49.4	Very low	56.8	Low	36 Å²	36	89.9 Å²	89.9	37%	0.371	52%	0.518	S	S	.	.	S	Bend	trans	174.6	168.8	177.6	0	0	0	0	0	113.6	A35 Q39	A35-G37 PolarHBondContact O-N 3.37Å; G37-Q39 PolarHBondContact O-N 3.01Å
38	P	47.7	Very low	59.5	Low	106 Å²	106	85.4 Å²	85.4	69%	0.688	48%	0.48	S	S	*	.	S	Bend	trans	-58.5	110.6	-178.5	22.9	-30.5	0	0	0	110
39	Q	47.1	Very low	62.1	Low	157 Å²	157	82 Å²	82	73%	0.734	45%	0.446	S	S	*	.			trans	31.9	92.7	171.7	-93	166.1	-28.9	0	0	116.3	G37 E41	G37-Q39 PolarHBondContact O-N 3.01Å; Q39-E41 HydrophobicContact CB-CG 4.11Å; Q39-E41 PolarHBondContact O-N 3.4Å
40	Q	53.1	Low	64.9	Low	46 Å²	46	75.1 Å²	75.1	22%	0.215	42%	0.415	C	S	.	.			trans	-68.7	88.4	147.1	-82	174.8	-30.3	0	0	109.3	Q42 H194	Q40-Q42 PolarHBondContact O-N 3.28Å; Q40-H194 PolarHBondContact NE2-NE2 3.45Å
41	E	54.7	Low	68	Low	165 Å²	165	70.5 Å²	70.5	77%	0.771	38%	0.382	S	S	*	.			trans	-63.5	-24.9	169.6	-61.2	-175.8	166.5	0	0	111.1	Q39 R43	Q39-E41 HydrophobicContact CB-CG 4.11Å; Q39-E41 PolarHBondContact O-N 3.4Å; E41-R43 PolarHBondContact O-N 3.1Å
42	Q	60.4	Low	70.7	Confident	89 Å²	89	67.9 Å²	67.9	42%	0.416	36%	0.364	S	S	.	.			trans	-83.2	112.7	176.4	-65.7	-171.5	-7.5	0	0	111.1	Q40 T44	Q40-Q42 PolarHBondContact O-N 3.28Å; Q42-T44 PolarHBondContact O-N 2.89Å
43	R	82.6	Confident	73.6	Confident	186 Å²	186	64 Å²	64	70%	0.702	33%	0.331	S	S	*	.			trans	-68.4	-21.6	172.2	-65.4	-178.1	176.9	-175.5	-2.1	112.9	E41 F45 D99	E41-R43 PolarHBondContact O-N 3.1Å; R43-F45 PolarHBondContact O-N 3.39Å; R43-D99 CarbonylContact C-O 3.54Å; R43-D99 VanDerWaalsContact C-O 3.32Å; R43-D99 VanDerWaalsContact CB-O 3.22Å; R43-D99 WeakPolarHBondContact CB-O 3.21Å
44	T	92.5	Very high	76.3	Confident	31 Å²	31	60.1 Å²	60.1	19%	0.19	31%	0.31	C	S	.	.			trans	-63.1	127	-178.9	-54.1	0	0	0	0	111.1	Q42 Y46 Q97 Y98 Y138	Q42-T44 PolarHBondContact O-N 2.89Å; T44-Y46 HydrophobicContact CG2-CE2 4.47Å; T44-Q97 HydrophobicContact CG2-CG 3.45Å; T44-Q97 VanDerWaalsContact CG2-CG 3.45Å; T44-Y98 CarbonylContact C-O 3.59Å; T44-Y98 VanDerWaalsContact CA-O 3.23Å; T44-Y98 WeakPolarHBondContact CA-O 3.38Å; T44-Y138 WeakPolarHBondContact O-CD1 3.2Å
45	F	95.9	Very high	78.9	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	165.4	172.1	72.7	-97.3	0	0	0	110.9	R43 Y98 S100 Y101 R104 V136 L137 Y138	R43-F45 PolarHBondContact O-N 3.39Å; F45-Y98 HydrophobicContact CD2-CD2 4.48Å; F45-Y98 AromaticContact CE2-CD2 3.75Å; F45-Y98 HydrophobicContact CE2-CD2 3.75Å; F45-Y98 HydrophobicContact CE2-CG 4.24Å; F45-Y98 HydrophobicContact CZ-CD2 4.08Å; F45-Y98 HydrophobicContact CZ-CG 4.14Å; F45-Y98 PolarHBondContact N-O 2.93Å; F45-Y98 PolarHBondContact O-N 3.32Å; F45-S100 VanDerWaalsContact CE1-C 3.45Å; F45-Y101 HydrophobicContact CD1-CD1 4.38Å; F45-Y101 HydrophobicContact CD1-CE1 4.2Å; F45-Y101 AromaticContact CE1-CD1 3.58Å; F45-Y101 HydrophobicContact CE1-CD1 3.58Å; F45-Y101 HydrophobicContact CE1-CD2 4.44Å; F45-Y101 AromaticContact CE1-CE1 3.77Å; F45-Y101 HydrophobicContact CE1-CE1 3.77Å; F45-Y101 AromaticContact CE1-CG 3.93Å; F45-Y101 HydrophobicContact CE1-CG 3.93Å; F45-Y101 HydrophobicContact CE2-CE1 4.28Å; F45-Y101 AromaticContact CZ-CD1 3.65Å; F45-Y101 HydrophobicContact CZ-CD1 3.65Å; F45-Y101 AromaticContact CZ-CE1 3.82Å; F45-Y101 HydrophobicContact CZ-CE1 3.82Å; F45-Y101 HydrophobicContact CZ-CG 4.41Å; F45-R104 HydrophobicContact CZ-CB 3.85Å; F45-R104 VanDerWaalsContact CZ-CD 3.48Å; F45-R104 HydrophobicContact CZ-CG 4.27Å; F45-V136 HydrophobicContact CB-CG1 4.25Å; F45-V136 HydrophobicContact CD2-CG1 3.46Å; F45-V136 VanDerWaalsContact CD2-CG1 3.46Å; F45-V136 HydrophobicContact CE2-CG1 3.93Å; F45-V136 HydrophobicContact CE2-CG2 4.4Å; F45-V136 HydrophobicContact CG-CG1 3.97Å; F45-L137 CarbonylContact C-O 3.57Å; F45-L137 WeakPolarHBondContact CA-O 3.11Å; F45-L137 WeakPolarHBondContact CB-O 3.33Å; F45-Y138 HydrophobicContact CB-CD1 3.77Å; F45-Y138 HydrophobicContact CB-CE1 3.56Å; F45-Y138 HydrophobicContact CB-CG 4.33Å
46	Y	98.1	Very high	81.4	Confident	11 Å²	11	62.6 Å²	62.6	4%	0.043	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136.2	-177.9	-60.3	-87.4	0	0	0	109.5	T44 I79 I95 W96 Q97 L137 L139 L145 F193	T44-Y46 HydrophobicContact CG2-CE2 4.47Å; Y46-I79 HydrophobicContact CD1-CG1 4.22Å; Y46-I79 HydrophobicContact CE1-CD1 4.39Å; Y46-I79 HydrophobicContact CE1-CG1 4.18Å; Y46-I95 HydrophobicContact CD1-CG2 4.01Å; Y46-W96 CarbonylContact C-O 3.51Å; Y46-W96 VanDerWaalsContact CA-O 3.25Å; Y46-W96 WeakPolarHBondContact CA-O 3.36Å; Y46-Q97 HydrophobicContact CD1-CB 4.17Å; Y46-Q97 HydrophobicContact CD1-CG 4.38Å; Y46-Q97 HydrophobicContact CE1-CB 4.01Å; Y46-Q97 HydrophobicContact CE1-CG 3.92Å; Y46-Q97 PolarHBondContact OH-OE1 3.35Å; Y46-L137 PolarHBondContact N-O 2.86Å; Y46-L137 PolarHBondContact O-N 2.76Å; Y46-L139 HydrophobicContact CD2-CG 4.36Å; Y46-L139 HydrophobicContact CE2-CD1 3.78Å; Y46-L139 HydrophobicContact CE2-CG 3.69Å; Y46-L145 HydrophobicContact CE1-CD2 3.73Å; Y46-F193 HydrophobicContact CD1-CE1 4.13Å; Y46-F193 AromaticContact CD2-CD1 3.85Å; Y46-F193 HydrophobicContact CD2-CD1 3.85Å; Y46-F193 AromaticContact CD2-CE1 3.69Å; Y46-F193 HydrophobicContact CD2-CE1 3.69Å; Y46-F193 HydrophobicContact CE1-CE1 4.48Å; Y46-F193 HydrophobicContact CE2-CD1 4.48Å; Y46-F193 HydrophobicContact CE2-CE1 4.08Å; Y46-F193 HydrophobicContact CG-CD1 4.09Å; Y46-F193 AromaticContact CG-CE1 3.72Å; Y46-F193 HydrophobicContact CG-CE1 3.72Å
47	E	98.1	Very high	83.9	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	110.7	171.3	-172.1	-178.5	-176.1	0	0	108.7	R49 I95 W96 Y98 R104 E135	E47-R49 HydrophobicContact CG-CG 3.91Å; E47-R49 IonicContact OE1-CZ 2.76Å; E47-R49 IonicContact OE1-NH1 3.88Å; E47-R49 PolarHBondContact OE1-NH1 3.48Å; E47-I95 WeakPolarHBondContact O-CA 3.29Å; E47-W96 HydrophobicContact CB-CB 4.34Å; E47-W96 PolarHBondContact N-O 2.81Å; E47-W96 PolarHBondContact O-N 3Å; E47-Y98 HydrophobicContact CB-CD2 4.38Å; E47-Y98 HydrophobicContact CB-CE2 4.09Å; E47-Y98 WeakPolarHBondContact OE2-CE2 3.37Å; E47-R104 IonicContact OE1-CZ 3.86Å; E47-R104 IonicContact OE1-NE 3.42Å; E47-R104 IonicContact OE1-NH2 3.14Å; E47-R104 PolarHBondContact OE1-NH2 2.84Å; E47-R104 IonicContact OE2-CZ 2.83Å; E47-R104 IonicContact OE2-NE 3.08Å; E47-R104 PolarHBondContact OE2-NE 3.27Å; E47-R104 IonicContact OE2-NH2 2.69Å; E47-R104 PolarHBondContact OE2-NH2 3.27Å; E47-R104 VanDerWaalsContact OE2-NH2 3.14Å; E47-E135 WeakPolarHBondContact CA-O 3.28Å
48	F	98.6	Very high	86.1	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.018	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	134.4	170.1	-78.3	20.3	0	0	0	108	F93 I95 N134 E135 L137 L157 F193 H204	F48-F93 HydrophobicContact CB-CE2 3.89Å; F48-F93 HydrophobicContact CB-CZ 4.34Å; F48-F93 HydrophobicContact CD1-CZ 4.27Å; F48-F93 AromaticContact CD2-CE2 3.66Å; F48-F93 HydrophobicContact CD2-CE2 3.66Å; F48-F93 AromaticContact CD2-CZ 3.53Å; F48-F93 HydrophobicContact CD2-CZ 3.53Å; F48-F93 HydrophobicContact CE1-CZ 4.49Å; F48-F93 HydrophobicContact CE2-CE2 4.34Å; F48-F93 AromaticContact CE2-CZ 3.77Å; F48-F93 HydrophobicContact CE2-CZ 3.77Å; F48-F93 AromaticContact CG-CE2 3.83Å; F48-F93 HydrophobicContact CG-CE2 3.83Å; F48-F93 AromaticContact CG-CZ 3.79Å; F48-F93 HydrophobicContact CG-CZ 3.79Å; F48-F93 HydrophobicContact CZ-CZ 4.24Å; F48-I95 HydrophobicContact CD1-CB 4.21Å; F48-I95 HydrophobicContact CD1-CD1 4.07Å; F48-I95 HydrophobicContact CD1-CG1 3.59Å; F48-I95 HydrophobicContact CD1-CG2 3.88Å; F48-I95 HydrophobicContact CE1-CB 4.22Å; F48-I95 HydrophobicContact CE1-CD1 3.43Å; F48-I95 VanDerWaalsContact CE1-CD1 3.43Å; F48-I95 HydrophobicContact CE1-CG1 3.5Å; F48-I95 HydrophobicContact CE1-CG2 3.71Å; F48-I95 HydrophobicContact CG-CG1 4.32Å; F48-I95 HydrophobicContact CZ-CD1 3.7Å; F48-I95 HydrophobicContact CZ-CG1 4.15Å; F48-N134 CarbonylContact O-C 3.58Å; F48-N134 VanDerWaalsContact O-CA 3.23Å; F48-N134 WeakPolarHBondContact O-CA 3.16Å; F48-E135 HydrophobicContact CB-CB 4.35Å; F48-E135 PolarHBondContact N-O 2.99Å; F48-E135 PolarHBondContact O-N 2.92Å; F48-L137 HydrophobicContact CB-CD1 3.59Å; F48-L137 HydrophobicContact CD1-CD1 3.61Å; F48-L137 HydrophobicContact CD2-CD1 3.91Å; F48-L137 HydrophobicContact CD2-CD2 4.14Å; F48-L137 HydrophobicContact CE1-CD1 4.25Å; F48-L137 HydrophobicContact CE2-CD2 4.22Å; F48-L137 HydrophobicContact CG-CD1 3.42Å; F48-L137 VanDerWaalsContact CG-CD1 3.42Å; F48-L137 HydrophobicContact CG-CD2 4.47Å; F48-L157 HydrophobicContact CE2-CD1 4.05Å; F48-L157 HydrophobicContact CE2-CD2 4.46Å; F48-F193 HydrophobicContact CE1-CD1 4.16Å; F48-F193 HydrophobicContact CE1-CD2 4.35Å; F48-F193 HydrophobicContact CE1-CE1 4.19Å; F48-F193 HydrophobicContact CE1-CE2 4.39Å; F48-F193 HydrophobicContact CE1-CG 4.23Å; F48-F193 HydrophobicContact CE1-CZ 4.29Å; F48-F193 HydrophobicContact CE2-CD2 4.42Å; F48-F193 HydrophobicContact CZ-CB 4.33Å; F48-F193 HydrophobicContact CZ-CD1 4.16Å; F48-F193 AromaticContact CZ-CD2 3.58Å; F48-F193 HydrophobicContact CZ-CD2 3.58Å; F48-F193 HydrophobicContact CZ-CE1 4.34Å; F48-F193 AromaticContact CZ-CE2 3.79Å; F48-F193 HydrophobicContact CZ-CE2 3.79Å; F48-F193 AromaticContact CZ-CG 3.77Å; F48-F193 HydrophobicContact CZ-CG 3.77Å; F48-F193 HydrophobicContact CZ-CZ 4.15Å; F48-H204 HydrophobicContact CE2-CB 3.84Å; F48-H204 AromaticContact CE2-CG 3.91Å
49	R	98.4	Very high	88.4	Confident	28 Å²	28	60.3 Å²	60.3	11%	0.106	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	136	176.2	-62.4	-178.4	65.2	87.9	6.1	108.9	E47 Y51 F93 H94 D133 N134	E47-R49 HydrophobicContact CG-CG 3.91Å; E47-R49 IonicContact OE1-CZ 2.76Å; E47-R49 IonicContact OE1-NH1 3.88Å; E47-R49 PolarHBondContact OE1-NH1 3.48Å; R49-Y51 HydrophobicContact CB-CE1 4.22Å; R49-Y51 PolarHBondContact NE-OH 2.83Å; R49-Y51 PolarHBondContact NH2-OH 2.96Å; R49-F93 WeakPolarHBondContact O-CA 3.27Å; R49-F93 WeakPolarHBondContact O-CD2 3.47Å; R49-H94 WeakPolarHBondContact CB-NE2 3.37Å; R49-H94 VanDerWaalsContact CD-NE2 3.33Å; R49-H94 WeakPolarHBondContact CD-NE2 3.47Å; R49-H94 PolarHBondContact N-O 2.88Å; R49-H94 PolarHBondContact O-N 2.78Å; R49-D133 VanDerWaalsContact CA-O 3.29Å; R49-D133 WeakPolarHBondContact CA-O 3.2Å; R49-N134 HydrophobicContact CG-CB 3.97Å
50	T	98.4	Very high	90.9	Very high	28 Å²	28	55 Å²	55	17%	0.172	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	121.4	175.6	-55.9	0	0	0	0	108.5	K91 F92 D133	T50-K91 HydrophobicContact CG2-CB 4.17Å; T50-K91 HydrophobicContact CG2-CD 3.96Å; T50-K91 HydrophobicContact CG2-CG 4.26Å; T50-F92 CarbonylContact C-O 3.43Å; T50-F92 WeakPolarHBondContact CA-O 3.48Å; T50-D133 PolarHBondContact N-O 2.86Å; T50-D133 PolarHBondContact O-N 2.84Å
51	Y	98.6	Very high	93	Very high	28 Å²	28	52.8 Å²	52.8	11%	0.11	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128.9	174.9	-62.7	-11.8	0	0	0	109.1	R49 F61 K91 F92 H94 L129 Q132	R49-Y51 HydrophobicContact CB-CE1 4.22Å; R49-Y51 PolarHBondContact NE-OH 2.83Å; R49-Y51 PolarHBondContact NH2-OH 2.96Å; Y51-F61 HydrophobicContact CD2-CE2 4.49Å; Y51-F61 AromaticContact CD2-CZ 3.95Å; Y51-F61 HydrophobicContact CD2-CZ 3.95Å; Y51-K91 CarbonylContact O-C 3.53Å; Y51-K91 VanDerWaalsContact O-CA 3.26Å; Y51-K91 WeakPolarHBondContact O-CA 3.37Å; Y51-F92 HydrophobicContact CD2-CD1 4.31Å; Y51-F92 PolarHBondContact N-O 3.29Å; Y51-F92 PolarHBondContact O-N 3.31Å; Y51-H94 AromaticContact CE2-CE1 3.66Å; Y51-H94 AromaticContact CZ-CE1 3.64Å; Y51-L129 HydrophobicContact CD2-CD1 3.79Å; Y51-L129 HydrophobicContact CE2-CD1 4.31Å; Y51-L129 HydrophobicContact CG-CD1 3.96Å; Y51-Q132 HydrophobicContact CD1-CB 3.79Å; Y51-Q132 HydrophobicContact CD1-CG 3.53Å; Y51-Q132 HydrophobicContact CE1-CB 3.91Å; Y51-Q132 HydrophobicContact CE1-CG 3.74Å; Y51-Q132 HydrophobicContact CG-CG 4.14Å
52	S	98.5	Very high	95.1	Very high	26 Å²	26	46.9 Å²	46.9	18%	0.182	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	119.3	168.3	-58.1	0	0	0	0	107.7	L129 T130 A131	S52-L129 CarbonylContact O-C 3.52Å; S52-L129 WeakPolarHBondContact O-CA 3.3Å; S52-T130 VanDerWaalsContact CB-OG1 3.29Å; S52-T130 WeakPolarHBondContact CB-OG1 3.13Å; S52-T130 PolarHBondContact O-N 2.87Å; S52-T130 PolarHBondContact O-OG1 3.06Å; S52-A131 PolarHBondContact N-O 3.5Å; S52-A131 PolarHBondContact O-N 2.85Å
53	I	98.6	Very high	96.9	Very high	4 Å²	4	48.9 Å²	48.9	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	144.5	-177.4	-50.7	160.5	0	0	0	107.9	Q57 F61 N90 F92 L128 L129	I53-Q57 HydrophobicContact CG2-CB 4.49Å; I53-F61 HydrophobicContact CD1-CB 4.42Å; I53-F61 HydrophobicContact CD1-CD1 3.38Å; I53-F61 HydrophobicContact CD1-CE1 3.89Å; I53-F61 HydrophobicContact CD1-CG 4.03Å; I53-F61 HydrophobicContact CG1-CD1 3.86Å; I53-F61 HydrophobicContact CG1-CE1 4.25Å; I53-F61 HydrophobicContact CG1-CG 4.12Å; I53-F61 HydrophobicContact CG2-CB 3.82Å; I53-F61 HydrophobicContact CG2-CG 4.15Å; I53-N90 PolarHBondContact N-O 2.87Å; I53-N90 WeakPolarHBondContact O-CB 3.18Å; I53-F92 HydrophobicContact CD1-CB 3.93Å; I53-L128 WeakPolarHBondContact CG2-O 3.35Å; I53-L129 HydrophobicContact CB-CD2 4.32Å; I53-L129 HydrophobicContact CG1-CD2 3.81Å; I53-L129 HydrophobicContact CG2-CD2 4.48Å
54	R	98.2	Very high	97.6	Very high	74 Å²	74	41 Å²	41	28%	0.279	22%	0.224	S	C	.	.	P	Polyproline II helix	trans	-56.9	128.6	166.9	-75.6	171.2	39.5	-145.9	-3.1	109.7	D56 Q57 N58 P127 L128 T130	R54-D56 VanDerWaalsContact C-N 3.26Å; R54-D56 WeakPolarHBondContact CB-OD1 3.42Å; R54-D56 IonicContact CZ-OD1 3.93Å; R54-D56 IonicContact CZ-OD2 3.78Å; R54-D56 IonicContact NE-OD1 3.47Å; R54-D56 PolarHBondContact NE-OD1 3.4Å; R54-D56 IonicContact NH2-OD1 3.54Å; R54-D56 IonicContact NH2-OD2 2.75Å; R54-D56 PolarHBondContact NH2-OD2 2.91Å; R54-D56 PolarHBondContact O-N 2.75Å; R54-Q57 HydrophobicContact CB-CB 4.11Å; R54-Q57 HydrophobicContact CB-CG 4.03Å; R54-Q57 VanDerWaalsContact NH2-CD 3.27Å; R54-Q57 PolarHBondContact O-N 2.69Å; R54-N58 PolarHBondContact O-N 3.17Å; R54-P127 WeakPolarHBondContact CD-O 3.34Å; R54-P127 PolarHBondContact NH1-O 3.34Å; R54-L128 WeakPolarHBondContact CB-O 3.24Å; R54-L128 PolarHBondContact N-O 3.2Å; R54-T130 HydrophobicContact CB-CG2 4.43Å; R54-T130 HydrophobicContact CG-CG2 3.55Å
55	P	97	Very high	97.9	Very high	89 Å²	89	39.5 Å²	39.5	58%	0.578	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-54.6	-40	-174.4	-28.5	35.2	0	0	0	114	Q57	P55-Q57 PolarHBondContact O-N 2.69Å
56	D	97.7	Very high	98	Very high	111 Å²	111	43.2 Å²	43.2	59%	0.594	24%	0.235	S	C	*	.	G	3₁₀ helix	trans	-72.1	-9.5	179.4	67	-57.3	0	0	0	114.1	R54	R54-D56 VanDerWaalsContact C-N 3.26Å; R54-D56 WeakPolarHBondContact CB-OD1 3.42Å; R54-D56 IonicContact CZ-OD1 3.93Å; R54-D56 IonicContact CZ-OD2 3.78Å; R54-D56 IonicContact NE-OD1 3.47Å; R54-D56 PolarHBondContact NE-OD1 3.4Å; R54-D56 IonicContact NH2-OD1 3.54Å; R54-D56 IonicContact NH2-OD2 2.75Å; R54-D56 PolarHBondContact NH2-OD2 2.91Å; R54-D56 PolarHBondContact O-N 2.75Å
57	Q	98.1	Very high	97.9	Very high	48 Å²	48	47 Å²	47	22%	0.224	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-115.7	5.7	-176.3	-60.1	-59.1	-45.9	0	0	114.1	I53 R54 P55 S59 A60 F61 L128	I53-Q57 HydrophobicContact CG2-CB 4.49Å; R54-Q57 HydrophobicContact CB-CB 4.11Å; R54-Q57 HydrophobicContact CB-CG 4.03Å; R54-Q57 VanDerWaalsContact NH2-CD 3.27Å; R54-Q57 PolarHBondContact O-N 2.69Å; P55-Q57 PolarHBondContact O-N 2.69Å; Q57-S59 VanDerWaalsContact C-N 3.35Å; Q57-S59 PolarHBondContact O-N 2.89Å; Q57-A60 PolarHBondContact O-N 3.04Å; Q57-A60 VanDerWaalsContact O-N 3.11Å; Q57-F61 PolarHBondContact O-N 3.32Å; Q57-L128 HydrophobicContact CB-CB 4.13Å; Q57-L128 HydrophobicContact CB-CD2 4.04Å; Q57-L128 HydrophobicContact CG-CD2 3.94Å
58	N	95.9	Very high	97.9	Very high	41 Å²	41	49.3 Å²	49.3	22%	0.219	26%	0.262	C	S	.	.	H	α-helix	trans	-53.3	-51.5	-174.8	-165.1	-47.1	0	0	0	111.8	R54 A60 F61 L62 N90	R54-N58 PolarHBondContact O-N 3.17Å; N58-A60 PolarHBondContact O-N 3.11Å; N58-F61 PolarHBondContact O-N 3.34Å; N58-L62 WeakPolarHBondContact O-CG 3.41Å; N58-L62 PolarHBondContact O-N 3.41Å; N58-L62 WeakPolarHBondContact OD1-CD1 3.33Å; N58-N90 PolarHBondContact ND2-OD1 3.24Å
59	S	96.5	Very high	97.8	Very high	101 Å²	101	50 Å²	50	71%	0.706	27%	0.266	S	S	*	.	H	α-helix	trans	-60.6	-43.6	177.3	-177.8	0	0	0	0	113	Q57 F61 L62 K63	Q57-S59 VanDerWaalsContact C-N 3.35Å; Q57-S59 PolarHBondContact O-N 2.89Å; S59-F61 PolarHBondContact O-N 3.01Å; S59-L62 PolarHBondContact O-N 3.14Å; S59-K63 WeakPolarHBondContact O-CB 3.49Å; S59-K63 PolarHBondContact O-N 2.76Å
60	A	98.3	Very high	97.8	Very high	44 Å²	44	53.4 Å²	53.4	36%	0.364	28%	0.283	S	S	.	.	H	α-helix	trans	-63.6	-43.2	179.8	0	0	0	0	0	111.8	Q57 N58 L64	Q57-A60 PolarHBondContact O-N 3.04Å; Q57-A60 VanDerWaalsContact O-N 3.11Å; N58-A60 PolarHBondContact O-N 3.11Å; A60-L64 WeakPolarHBondContact O-CB 3.5Å; A60-L64 PolarHBondContact O-N 3.49Å
61	F	98.4	Very high	97.7	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.8	-46.6	177.4	176.6	-91.4	0	0	0	111.8	Y51 I53 Q57 N58 S59 L64 T65 F92 A125 L128 L129	Y51-F61 HydrophobicContact CD2-CE2 4.49Å; Y51-F61 AromaticContact CD2-CZ 3.95Å; Y51-F61 HydrophobicContact CD2-CZ 3.95Å; I53-F61 HydrophobicContact CD1-CB 4.42Å; I53-F61 HydrophobicContact CD1-CD1 3.38Å; I53-F61 HydrophobicContact CD1-CE1 3.89Å; I53-F61 HydrophobicContact CD1-CG 4.03Å; I53-F61 HydrophobicContact CG1-CD1 3.86Å; I53-F61 HydrophobicContact CG1-CE1 4.25Å; I53-F61 HydrophobicContact CG1-CG 4.12Å; I53-F61 HydrophobicContact CG2-CB 3.82Å; I53-F61 HydrophobicContact CG2-CG 4.15Å; Q57-F61 PolarHBondContact O-N 3.32Å; N58-F61 PolarHBondContact O-N 3.34Å; S59-F61 PolarHBondContact O-N 3.01Å; F61-L64 PolarHBondContact O-N 3.42Å; F61-T65 WeakPolarHBondContact CE1-OG1 3.47Å; F61-T65 WeakPolarHBondContact CZ-OG1 3.42Å; F61-T65 WeakPolarHBondContact O-CB 3.35Å; F61-T65 PolarHBondContact O-N 3.29Å; F61-T65 PolarHBondContact O-OG1 2.92Å; F61-F92 HydrophobicContact CE1-CB 3.94Å; F61-F92 AromaticContact CE1-CD1 3.99Å; F61-F92 HydrophobicContact CE1-CD1 3.99Å; F61-F92 HydrophobicContact CE1-CD2 4.17Å; F61-F92 AromaticContact CE1-CG 3.79Å; F61-F92 HydrophobicContact CE1-CG 3.79Å; F61-F92 HydrophobicContact CZ-CD1 4.25Å; F61-F92 HydrophobicContact CZ-CG 4.48Å; F61-A125 HydrophobicContact CD2-CB 4.47Å; F61-A125 HydrophobicContact CE2-CB 4.2Å; F61-L128 HydrophobicContact CB-CB 4.26Å; F61-L128 HydrophobicContact CB-CD1 3.88Å; F61-L128 HydrophobicContact CD2-CB 4.23Å; F61-L128 HydrophobicContact CD2-CD1 4.26Å; F61-L129 HydrophobicContact CD2-CD2 3.79Å; F61-L129 HydrophobicContact CD2-CG 4.49Å; F61-L129 HydrophobicContact CE2-CD1 4.35Å; F61-L129 HydrophobicContact CE2-CD2 3.62Å; F61-L129 HydrophobicContact CE2-CG 4.22Å; F61-L129 HydrophobicContact CG-CD2 4.46Å; F61-L129 HydrophobicContact CZ-CD2 4.18Å
62	L	97.4	Very high	97.6	Very high	42 Å²	42	52.2 Å²	52.2	22%	0.22	28%	0.277	C	S	.	.	H	α-helix	trans	-66.1	-40.2	-179.5	-67.4	176.7	0	0	0	112.2	N58 S59 T65 N66 T83 F92	N58-L62 WeakPolarHBondContact O-CG 3.41Å; N58-L62 PolarHBondContact O-N 3.41Å; N58-L62 WeakPolarHBondContact OD1-CD1 3.33Å; S59-L62 PolarHBondContact O-N 3.14Å; L62-T65 PolarHBondContact O-N 2.89Å; L62-N66 WeakPolarHBondContact O-CB 3.39Å; L62-N66 PolarHBondContact O-N 2.92Å; L62-T83 HydrophobicContact CD1-CG2 3.65Å; L62-T83 HydrophobicContact CD2-CG2 3.54Å; L62-T83 HydrophobicContact CG-CG2 4.24Å; L62-F92 HydrophobicContact CD2-CD2 3.83Å; L62-F92 HydrophobicContact CD2-CE2 4.22Å
63	K	98.1	Very high	97.5	Very high	131 Å²	131	53.8 Å²	53.8	57%	0.57	29%	0.285	S	S	*	.	H	α-helix	trans	-60.3	-51.7	174.2	-179.8	177.9	175.6	-179.1	0	111.1	S59 T65 N66 E67	S59-K63 WeakPolarHBondContact O-CB 3.49Å; S59-K63 PolarHBondContact O-N 2.76Å; K63-T65 VanDerWaalsContact C-N 3.29Å; K63-T65 PolarHBondContact O-N 3.45Å; K63-N66 PolarHBondContact O-N 3.38Å; K63-E67 WeakPolarHBondContact CE-OE1 3.34Å; K63-E67 WeakPolarHBondContact CG-OE1 3.34Å; K63-E67 WeakPolarHBondContact O-CG 3.15Å; K63-E67 PolarHBondContact O-N 3.32Å
64	L	98.5	Very high	97.4	Very high	19 Å²	19	57.4 Å²	57.4	10%	0.099	32%	0.316	C	S	.	.	H	α-helix	trans	-57.9	-43.5	178	176.9	64.8	0	0	0	111.6	A60 F61 E67 K68 Y121 K124 A125 L128	A60-L64 WeakPolarHBondContact O-CB 3.5Å; A60-L64 PolarHBondContact O-N 3.49Å; F61-L64 PolarHBondContact O-N 3.42Å; L64-E67 PolarHBondContact O-N 3.4Å; L64-K68 HydrophobicContact CD1-CG 3.94Å; L64-K68 WeakPolarHBondContact O-CB 3.24Å; L64-K68 PolarHBondContact O-N 2.92Å; L64-Y121 HydrophobicContact CD1-CD2 4.43Å; L64-Y121 HydrophobicContact CD2-CD2 4.23Å; L64-Y121 HydrophobicContact CD2-CE2 4.44Å; L64-Y121 HydrophobicContact CG-CD2 3.87Å; L64-Y121 HydrophobicContact CG-CE2 4.14Å; L64-K124 HydrophobicContact CD1-CD 4.44Å; L64-K124 HydrophobicContact CD2-CB 3.67Å; L64-A125 HydrophobicContact CD2-CB 3.87Å; L64-L128 HydrophobicContact CD2-CD1 4.38Å
65	T	98.1	Very high	97.2	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-47.8	178.5	-53.3	0	0	0	0	111.1	F61 L62 K63 E67 K68 I69 F92 Y121 F252	F61-T65 WeakPolarHBondContact CE1-OG1 3.47Å; F61-T65 WeakPolarHBondContact CZ-OG1 3.42Å; F61-T65 WeakPolarHBondContact O-CB 3.35Å; F61-T65 PolarHBondContact O-N 3.29Å; F61-T65 PolarHBondContact O-OG1 2.92Å; L62-T65 PolarHBondContact O-N 2.89Å; K63-T65 VanDerWaalsContact C-N 3.29Å; K63-T65 PolarHBondContact O-N 3.45Å; T65-E67 VanDerWaalsContact C-N 3.28Å; T65-E67 PolarHBondContact O-N 3.24Å; T65-K68 PolarHBondContact O-N 2.83Å; T65-I69 HydrophobicContact CG2-CB 4.22Å; T65-I69 HydrophobicContact CG2-CD1 4.23Å; T65-I69 HydrophobicContact CG2-CG1 4.48Å; T65-I69 WeakPolarHBondContact O-CB 3.47Å; T65-I69 WeakPolarHBondContact O-CG2 3.42Å; T65-I69 PolarHBondContact O-N 2.95Å; T65-F92 HydrophobicContact CG2-CE1 4.41Å; T65-F92 HydrophobicContact CG2-CE2 4.47Å; T65-F92 HydrophobicContact CG2-CZ 3.89Å; T65-Y121 HydrophobicContact CG2-CE2 4.37Å; T65-Y121 PolarHBondContact OG1-OH 2.93Å; T65-F252 HydrophobicContact CG2-CE2 3.8Å; T65-F252 HydrophobicContact CG2-CZ 3.53Å
66	N	97.4	Very high	97.1	Very high	79 Å²	79	53.4 Å²	53.4	42%	0.422	29%	0.293	S	S	.	.	H	α-helix	trans	-55.6	-44.1	176	-179.3	58.5	0	0	0	112.2	L62 K63 F252	L62-N66 WeakPolarHBondContact O-CB 3.39Å; L62-N66 PolarHBondContact O-N 2.92Å; K63-N66 PolarHBondContact O-N 3.38Å; N66-F252 HydrophobicContact CB-CD1 3.55Å; N66-F252 HydrophobicContact CB-CE1 3.64Å; N66-F252 HydrophobicContact CB-CG 4.49Å; N66-F252 WeakPolarHBondContact OD1-CD1 3.29Å
67	E	97.9	Very high	97.1	Very high	90 Å²	90	53.1 Å²	53.1	42%	0.421	29%	0.289	S	S	.	.	H	α-helix	trans	-69.8	-34.4	-178.6	-71.8	172.1	-171.8	0	0	113.1	K63 L64 T65 H70	K63-E67 WeakPolarHBondContact CE-OE1 3.34Å; K63-E67 WeakPolarHBondContact CG-OE1 3.34Å; K63-E67 WeakPolarHBondContact O-CG 3.15Å; K63-E67 PolarHBondContact O-N 3.32Å; L64-E67 PolarHBondContact O-N 3.4Å; T65-E67 VanDerWaalsContact C-N 3.28Å; T65-E67 PolarHBondContact O-N 3.24Å; E67-H70 PolarHBondContact O-CE1 2.97Å; E67-H70 PolarHBondContact O-ND1 3.48Å
68	K	97.9	Very high	97.1	Very high	48 Å²	48	51.7 Å²	51.7	21%	0.209	28%	0.282	C	S	.	.	H	α-helix	trans	-119.9	-5.4	-164.9	-58	-61.4	177.6	176.5	0	115.5	L64 T65 H70 L71 E120 Y121	L64-K68 HydrophobicContact CD1-CG 3.94Å; L64-K68 WeakPolarHBondContact O-CB 3.24Å; L64-K68 PolarHBondContact O-N 2.92Å; T65-K68 PolarHBondContact O-N 2.83Å; K68-H70 PolarHBondContact O-N 3.29Å; K68-H70 VanDerWaalsContact O-N 3.13Å; K68-L71 HydrophobicContact CB-CD1 4.32Å; K68-L71 HydrophobicContact CD-CD1 4.32Å; K68-L71 WeakPolarHBondContact O-CB 3.12Å; K68-L71 WeakPolarHBondContact O-CG 3.27Å; K68-L71 PolarHBondContact O-N 3.07Å; K68-L71 VanDerWaalsContact O-N 3.13Å; K68-E120 HydrophobicContact CD-CB 4.27Å; K68-E120 IonicContact NZ-OE2 3.59Å; K68-E120 PolarHBondContact NZ-OE2 2.91Å; K68-Y121 HydrophobicContact CB-CD2 3.78Å; K68-Y121 HydrophobicContact CB-CG 4.3Å
69	I	96.8	Very high	97.2	Very high	18 Å²	18	50.4 Å²	50.4	9%	0.092	28%	0.275	C	S	.	.	H	α-helix	trans	-60.7	-25.8	179.7	-166.1	62	0	0	0	112.6	T65 L71 R72 T73 L78 W96 F252	T65-I69 HydrophobicContact CG2-CB 4.22Å; T65-I69 HydrophobicContact CG2-CD1 4.23Å; T65-I69 HydrophobicContact CG2-CG1 4.48Å; T65-I69 WeakPolarHBondContact O-CB 3.47Å; T65-I69 WeakPolarHBondContact O-CG2 3.42Å; T65-I69 PolarHBondContact O-N 2.95Å; I69-L71 PolarHBondContact O-N 2.89Å; I69-R72 HydrophobicContact CD1-CB 4.27Å; I69-R72 WeakPolarHBondContact O-CA 3.47Å; I69-R72 WeakPolarHBondContact O-CB 3.34Å; I69-R72 PolarHBondContact O-N 2.92Å; I69-T73 HydrophobicContact CG1-CG2 4.2Å; I69-T73 PolarHBondContact O-N 3.13Å; I69-L78 HydrophobicContact CG1-CD2 4.49Å; I69-W96 HydrophobicContact CD1-CH2 4.12Å; I69-W96 HydrophobicContact CD1-CZ2 4.19Å; I69-F252 HydrophobicContact CB-CD2 4.43Å; I69-F252 HydrophobicContact CB-CE2 4.35Å; I69-F252 HydrophobicContact CG1-CE2 4.34Å; I69-F252 HydrophobicContact CG2-CD2 3.67Å; I69-F252 HydrophobicContact CG2-CE2 4.06Å; I69-F252 HydrophobicContact CG2-CG 4.25Å
70	H	96.8	Very high	97.3	Very high	101 Å²	101	45.6 Å²	45.6	47%	0.468	24%	0.242	S	C	.	.	H	α-helix	trans	-56.7	-32.7	177.6	68.3	-87.7	0	0	0	112.7	E67 K68 R72 T73 A74	E67-H70 PolarHBondContact O-CE1 2.97Å; E67-H70 PolarHBondContact O-ND1 3.48Å; K68-H70 PolarHBondContact O-N 3.29Å; K68-H70 VanDerWaalsContact O-N 3.13Å; H70-R72 VanDerWaalsContact C-N 3.26Å; H70-R72 PolarHBondContact O-N 3.13Å; H70-T73 VanDerWaalsContact CA-OG1 3.3Å; H70-T73 WeakPolarHBondContact CA-OG1 3.42Å; H70-T73 PolarHBondContact O-N 3.13Å; H70-T73 PolarHBondContact O-OG1 2.86Å; H70-A74 PolarHBondContact O-N 3.29Å
71	L	97.1	Very high	97.3	Very high	23 Å²	23	43.5 Å²	43.5	12%	0.12	23%	0.225	C	C	.	.	H	α-helix	trans	-60	-38	174.2	-62.3	174.7	0	0	0	111	K68 I69 H75 W117 E120	K68-L71 HydrophobicContact CB-CD1 4.32Å; K68-L71 HydrophobicContact CD-CD1 4.32Å; K68-L71 WeakPolarHBondContact O-CB 3.12Å; K68-L71 WeakPolarHBondContact O-CG 3.27Å; K68-L71 PolarHBondContact O-N 3.07Å; K68-L71 VanDerWaalsContact O-N 3.13Å; I69-L71 PolarHBondContact O-N 2.89Å; L71-H75 PolarHBondContact O-CD2 2.76Å; L71-H75 VanDerWaalsContact O-CD2 3.27Å; L71-W117 HydrophobicContact CB-CE3 3.78Å; L71-W117 HydrophobicContact CB-CZ3 4.44Å; L71-E120 HydrophobicContact CD1-CB 4.41Å
72	R	96.3	Very high	97.3	Very high	7 Å²	7	43.5 Å²	43.5	3%	0.026	23%	0.225	C	C	.	.	H	α-helix	trans	-78.7	-40.9	175.5	-178.5	58.9	-179.1	-133.9	-0.9	112.7	I69 H70 A74 H75 S76 W96 Y98 W117	I69-R72 HydrophobicContact CD1-CB 4.27Å; I69-R72 WeakPolarHBondContact O-CA 3.47Å; I69-R72 WeakPolarHBondContact O-CB 3.34Å; I69-R72 PolarHBondContact O-N 2.92Å; H70-R72 VanDerWaalsContact C-N 3.26Å; H70-R72 PolarHBondContact O-N 3.13Å; R72-A74 PolarHBondContact O-N 2.9Å; R72-H75 PolarHBondContact O-N 2.82Å; R72-S76 PolarHBondContact NE-OG 2.88Å; R72-S76 VanDerWaalsContact NE-OG 3.08Å; R72-S76 PolarHBondContact O-N 3.27Å; R72-W96 HydrophobicContact CB-CH2 4.08Å; R72-W96 HydrophobicContact CG-CH2 3.32Å; R72-W96 HydrophobicContact CG-CZ2 3.64Å; R72-W96 HydrophobicContact CG-CZ3 3.94Å; R72-Y98 PolarHBondContact NH2-OH 3.43Å; R72-Y98 VanDerWaalsContact NH2-OH 3.09Å; R72-W117 HydrophobicContact CB-CE3 4.16Å; R72-W117 HydrophobicContact CB-CH2 3.56Å; R72-W117 HydrophobicContact CB-CZ2 4.14Å; R72-W117 HydrophobicContact CB-CZ3 3.59Å; R72-W117 HydrophobicContact CG-CH2 4.16Å; R72-W117 HydrophobicContact CG-CZ2 4.39Å
73	T	96.8	Very high	97.3	Very high	59 Å²	59	43 Å²	43	36%	0.362	22%	0.223	S	C	.	.	H	α-helix	trans	-69.6	-18.3	-177.5	60.5	0	0	0	0	112.8	I69 H70 H75 S76 L78 W96	I69-T73 HydrophobicContact CG1-CG2 4.2Å; I69-T73 PolarHBondContact O-N 3.13Å; H70-T73 VanDerWaalsContact CA-OG1 3.3Å; H70-T73 WeakPolarHBondContact CA-OG1 3.42Å; H70-T73 PolarHBondContact O-N 3.13Å; H70-T73 PolarHBondContact O-OG1 2.86Å; T73-H75 PolarHBondContact O-N 2.95Å; T73-S76 WeakPolarHBondContact CA-O 3.28Å; T73-L78 HydrophobicContact CG2-CB 3.92Å; T73-L78 HydrophobicContact CG2-CD2 4.09Å; T73-W96 HydrophobicContact CG2-CH2 4.04Å; T73-W96 HydrophobicContact CG2-CZ3 4.07Å
74	A	95.8	Very high	97.3	Very high	80 Å²	80	37 Å²	37	66%	0.661	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.7	167.7	0	0	0	0	0	113.1	H70 R72	H70-A74 PolarHBondContact O-N 3.29Å; R72-A74 PolarHBondContact O-N 2.9Å
75	H	94.4	Very high	97.1	Very high	72 Å²	72	40.1 Å²	40.1	33%	0.333	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115	-19.8	-178.6	-59.7	-82.4	0	0	0	114.4	L71 R72 T73 V107 V111 D114	L71-H75 PolarHBondContact O-CD2 2.76Å; L71-H75 VanDerWaalsContact O-CD2 3.27Å; R72-H75 PolarHBondContact O-N 2.82Å; T73-H75 PolarHBondContact O-N 2.95Å; H75-V107 HydrophobicContact CB-CG1 4.1Å; H75-V107 VanDerWaalsContact O-CG1 3.25Å; H75-V107 WeakPolarHBondContact O-CG1 3.46Å; H75-V107 WeakPolarHBondContact O-CG2 3.5Å; H75-V111 HydrophobicContact CB-CG2 3.46Å; H75-V111 VanDerWaalsContact CB-CG2 3.46Å; H75-D114 IonicContact NE2-OD2 3.72Å
76	S	95.1	Very high	97.1	Very high	7 Å²	7	46.7 Å²	46.7	5%	0.049	24%	0.237	C	C	.	.	S	Bend	trans	-133.4	138.8	-172.8	-62.5	0	0	0	0	110.9	R72 T73 L78 W96 Y98 V107	R72-S76 PolarHBondContact NE-OG 2.88Å; R72-S76 VanDerWaalsContact NE-OG 3.08Å; R72-S76 PolarHBondContact O-N 3.27Å; T73-S76 WeakPolarHBondContact CA-O 3.28Å; S76-L78 PolarHBondContact O-N 3.4Å; S76-W96 VanDerWaalsContact CB-CZ3 3.49Å; S76-W96 WeakPolarHBondContact O-CZ3 3.44Å; S76-Y98 PolarHBondContact OG-OH 2.89Å; S76-Y98 VanDerWaalsContact OG-OH 3.14Å; S76-V107 WeakPolarHBondContact OG-CG1 3.43Å
77	Q	97.1	Very high	96.9	Very high	106 Å²	106	46 Å²	46	50%	0.495	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	107.9	173.9	-173.4	177.5	13.7	0	0	110.2	W96 Q97	Q77-W96 WeakPolarHBondContact O-CA 3.29Å; Q77-Q97 HydrophobicContact CB-CB 4.37Å; Q77-Q97 HydrophobicContact CG-CB 4.4Å; Q77-Q97 PolarHBondContact O-N 3.27Å; Q77-Q97 VanDerWaalsContact OE1-NE2 3.13Å
78	L	98.3	Very high	96.5	Very high	18 Å²	18	42.4 Å²	42.4	9%	0.094	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.2	172	-175.6	62.7	0	0	0	109.1	I69 T73 S76 H94 W96 P254	I69-L78 HydrophobicContact CG1-CD2 4.49Å; T73-L78 HydrophobicContact CG2-CB 3.92Å; T73-L78 HydrophobicContact CG2-CD2 4.09Å; S76-L78 PolarHBondContact O-N 3.4Å; L78-H94 HydrophobicContact CD1-CB 4.37Å; L78-W96 HydrophobicContact CB-CE3 3.94Å; L78-W96 HydrophobicContact CB-CH2 4.05Å; L78-W96 HydrophobicContact CB-CZ3 3.53Å; L78-W96 HydrophobicContact CD1-CD2 4.14Å; L78-W96 HydrophobicContact CD1-CE3 4.08Å; L78-W96 HydrophobicContact CD1-CH2 3.86Å; L78-W96 HydrophobicContact CD1-CZ2 3.93Å; L78-W96 HydrophobicContact CD1-CZ3 3.97Å; L78-W96 HydrophobicContact CG-CH2 4.37Å; L78-W96 HydrophobicContact CG-CZ3 4.28Å; L78-P254 HydrophobicContact CB-CG 4.22Å; L78-P254 HydrophobicContact CD2-CG 4.18Å; L78-P254 HydrophobicContact CG-CG 4.11Å
79	I	98.4	Very high	96.3	Very high	13 Å²	13	45.9 Å²	45.9	7%	0.067	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	-46.2	172.7	-64.7	-53.5	0	0	0	110.2	Y46 I95 Q97 L145 M255	Y46-I79 HydrophobicContact CD1-CG1 4.22Å; Y46-I79 HydrophobicContact CE1-CD1 4.39Å; Y46-I79 HydrophobicContact CE1-CG1 4.18Å; I79-I95 HydrophobicContact CB-CB 3.95Å; I79-I95 HydrophobicContact CB-CG2 3.83Å; I79-I95 WeakPolarHBondContact CB-O 3.21Å; I79-I95 HydrophobicContact CG1-CG2 3.97Å; I79-I95 HydrophobicContact CG2-CB 4.31Å; I79-I95 HydrophobicContact CG2-CG2 4.19Å; I79-I95 PolarHBondContact N-O 2.96Å; I79-Q97 HydrophobicContact CD1-CB 3.8Å; I79-Q97 HydrophobicContact CG1-CB 3.93Å; I79-L145 HydrophobicContact CD1-CD2 3.8Å; I79-L145 HydrophobicContact CG1-CD2 4.09Å; I79-L145 HydrophobicContact CG2-CD1 4.48Å; I79-L145 HydrophobicContact CG2-CD2 3.65Å; I79-M255 HydrophobicContact CG2-CE 3.65Å; I79-M255 HydrophobicContact CG2-SD 3.78Å; I79-M255 VanDerWaalsContact O-CG 3.29Å; I79-M255 WeakPolarHBondContact O-CG 3.08Å
80	G	98.2	Very high	96.3	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.7	161.4	178.8	0	0	0	0	0	112.3	W82 H94 I95 S253	G80-W82 VanDerWaalsContact CA-CH2 3.43Å; G80-W82 VanDerWaalsContact O-CZ3 3.25Å; G80-W82 WeakPolarHBondContact O-CZ3 3.29Å; G80-H94 VanDerWaalsContact O-CA 3.25Å; G80-H94 WeakPolarHBondContact O-CA 3.47Å; G80-H94 WeakPolarHBondContact O-CB 3.48Å; G80-I95 PolarHBondContact O-N 2.91Å; G80-S253 WeakPolarHBondContact CA-OG 3.39Å
81	C	97.9	Very high	96.4	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.007	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.5	174.5	54.1	0	0	0	0	110.9	F92 F93 H94 C250 F252 S253	C81-F92 HydrophobicContact CB-CE1 4.46Å; C81-F92 HydrophobicContact CB-CE2 4Å; C81-F92 HydrophobicContact CB-CZ 3.63Å; C81-F93 CarbonylContact C-O 3.56Å; C81-F93 WeakPolarHBondContact CA-O 3.3Å; C81-H94 HydrophobicContact CB-CB 3.87Å; C81-C250 PolarHBondContact O-N 3.31Å; C81-F252 HydrophobicContact CB-CE2 4.31Å; C81-F252 WeakPolarHBondContact SG-CD2 3.42Å; C81-F252 WeakPolarHBondContact SG-CE2 3.49Å; C81-S253 PolarHBondContact N-OG 3.37Å; C81-S253 WeakPolarHBondContact O-CB 3.48Å; C81-S253 PolarHBondContact O-OG 3.04Å; C81-S253 WeakPolarHBondContact SG-CA 3.29Å; C81-S253 VanDerWaalsContact SG-CB 3.52Å
82	W	98.4	Very high	96.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	151	-173.2	-56.7	-99.8	0	0	0	111.7	G80 F92 F93 I95 F155 L206 M247 F248 P249 M255	G80-W82 VanDerWaalsContact CA-CH2 3.43Å; G80-W82 VanDerWaalsContact O-CZ3 3.25Å; G80-W82 WeakPolarHBondContact O-CZ3 3.29Å; W82-F92 WeakPolarHBondContact O-CA 3.38Å; W82-F93 HydrophobicContact CD2-CD1 4.41Å; W82-F93 AromaticContact CE3-CD1 3.55Å; W82-F93 HydrophobicContact CE3-CD1 3.55Å; W82-F93 AromaticContact CE3-CE1 3.92Å; W82-F93 HydrophobicContact CE3-CE1 3.92Å; W82-F93 HydrophobicContact CZ3-CD1 4Å; W82-F93 AromaticContact CZ3-CE1 3.89Å; W82-F93 HydrophobicContact CZ3-CE1 3.89Å; W82-F93 PolarHBondContact N-O 3.27Å; W82-F93 PolarHBondContact O-N 3.01Å; W82-I95 HydrophobicContact CH2-CD1 4.03Å; W82-I95 HydrophobicContact CH2-CG1 4.49Å; W82-I95 HydrophobicContact CZ3-CD1 3.9Å; W82-I95 HydrophobicContact CZ3-CG1 3.95Å; W82-F155 AromaticContact CD1-CD2 3.58Å; W82-F155 AromaticContact CD1-CG 3.77Å; W82-F155 AromaticContact CE2-CD1 3.95Å; W82-F155 AromaticContact CZ2-CD1 3.98Å; W82-F155 HydrophobicContact CZ2-CD1 3.98Å; W82-F155 AromaticContact CZ2-CE1 3.91Å; W82-F155 HydrophobicContact CZ2-CE1 3.91Å; W82-F155 HydrophobicContact CZ2-CZ 4.42Å; W82-F155 AromaticContact NE1-CD1 3.5Å; W82-F155 AromaticContact NE1-CD2 3.12Å; W82-F155 AromaticContact NE1-CE1 3.71Å; W82-F155 AromaticContact NE1-CE2 3.4Å; W82-F155 AromaticContact NE1-CG 3.17Å; W82-F155 AromaticContact NE1-CZ 3.67Å; W82-L206 HydrophobicContact CH2-CD2 4.26Å; W82-L206 HydrophobicContact CZ2-CD2 4.41Å; W82-M247 HydrophobicContact CB-CB 3.67Å; W82-M247 HydrophobicContact CB-SD 4.35Å; W82-M247 HydrophobicContact CD2-CE 4.33Å; W82-M247 HydrophobicContact CG-CB 4.11Å; W82-M247 HydrophobicContact CG-CE 4.27Å; W82-F248 CarbonylContact C-O 3.56Å; W82-F248 WeakPolarHBondContact CA-O 3.23Å; W82-F248 WeakPolarHBondContact CB-O 3.21Å; W82-P249 VanDerWaalsContact CD1-CA 3.41Å; W82-M255 HydrophobicContact CH2-SD 4.19Å; W82-M255 HydrophobicContact CZ2-CB 3.94Å; W82-M255 HydrophobicContact CZ2-SD 4.1Å
83	T	98.1	Very high	96.6	Very high	31 Å²	31	44.4 Å²	44.4	19%	0.19	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	139.1	161.9	49.8	0	0	0	0	109.6	L62 M247 F248	L62-T83 HydrophobicContact CD1-CG2 3.65Å; L62-T83 HydrophobicContact CD2-CG2 3.54Å; L62-T83 HydrophobicContact CG-CG2 4.24Å; T83-M247 CarbonylContact O-C 3.53Å; T83-M247 WeakPolarHBondContact O-CA 3.25Å; T83-F248 PolarHBondContact N-O 3.42Å; T83-F248 PolarHBondContact O-N 3.03Å
84	V	97.9	Very high	96.7	Very high	6 Å²	6	42 Å²	42	4%	0.036	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	126.2	177.4	-177.7	0	0	0	0	110	G88 K91 Q245 M247	V84-G88 VanDerWaalsContact CB-O 3.29Å; V84-G88 WeakPolarHBondContact CB-O 3.39Å; V84-G88 WeakPolarHBondContact CG1-O 3.33Å; V84-K91 HydrophobicContact CB-CB 4Å; V84-K91 HydrophobicContact CG2-CB 3.75Å; V84-K91 PolarHBondContact N-O 3.38Å; V84-Q245 HydrophobicContact CG1-CB 3.9Å; V84-M247 HydrophobicContact CG2-CG 4.14Å; V84-M247 HydrophobicContact CG2-SD 4.37Å
85	E	95.5	Very high	96.8	Very high	83 Å²	83	38.1 Å²	38.1	39%	0.388	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	-49.1	178.8	-172.9	63.6	-154	0	0	111.5	L89 L246 F248	E85-L89 WeakPolarHBondContact O-CD2 3.46Å; E85-L246 PolarHBondContact N-O 3.4Å; E85-F248 HydrophobicContact CB-CD2 3.66Å; E85-F248 HydrophobicContact CB-CE2 3.45Å; E85-F248 VanDerWaalsContact CB-CE2 3.45Å; E85-F248 HydrophobicContact CG-CD2 4.29Å; E85-F248 HydrophobicContact CG-CE2 3.7Å
86	Y	96.4	Very high	97	Very high	139 Å²	139	35 Å²	35	55%	0.545	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	141.5	179.3	-56.3	-54.6	0	0	0	110.8	Q245 L246	Y86-Q245 CarbonylContact O-C 3.51Å; Y86-Q245 WeakPolarHBondContact O-CA 3.37Å; Y86-Q245 WeakPolarHBondContact O-CB 3.43Å; Y86-L246 HydrophobicContact CD2-CB 3.85Å; Y86-L246 HydrophobicContact CD2-CD2 3.53Å; Y86-L246 HydrophobicContact CD2-CG 4.32Å; Y86-L246 HydrophobicContact CE2-CD2 3.82Å; Y86-L246 HydrophobicContact CG-CB 4.43Å; Y86-L246 PolarHBondContact N-O 2.99Å; Y86-L246 PolarHBondContact O-N 3.41Å
87	G	93.9	Very high	97.1	Very high	63 Å²	63	36.3 Å²	36.3	65%	0.649	19%	0.193	S	C	*	.	S	Bend	trans	85.1	5.5	-179.9	0	0	0	0	0	114.9
88	G	89.8	Confident	97.1	Very high	16 Å²	16	31.4 Å²	31.4	17%	0.165	17%	0.17	C	C	.	.	S	Bend	trans	166.9	76.2	174.1	0	0	0	0	0	114.1	V84 K91	V84-G88 VanDerWaalsContact CB-O 3.29Å; V84-G88 WeakPolarHBondContact CB-O 3.39Å; V84-G88 WeakPolarHBondContact CG1-O 3.33Å; G88-K91 WeakPolarHBondContact O-CB 3.46Å; G88-K91 WeakPolarHBondContact O-CG 3.36Å
89	L	93.9	Very high	96.9	Very high	120 Å²	120	34.1 Å²	34.1	63%	0.628	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	153.8	-179.9	-66.7	174.8	0	0	0	113.1	E85 K91	E85-L89 WeakPolarHBondContact O-CD2 3.46Å; L89-K91 PolarHBondContact O-N 2.99Å
90	N	96.9	Very high	96.7	Very high	47 Å²	47	35.1 Å²	35.1	25%	0.251	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	29.2	179.2	-53.9	-60.8	0	0	0	113.9	I53 N58	I53-N90 PolarHBondContact N-O 2.87Å; I53-N90 WeakPolarHBondContact O-CB 3.18Å; N58-N90 PolarHBondContact ND2-OD1 3.24Å
91	K	98.3	Very high	96.4	Very high	65 Å²	65	39 Å²	39	28%	0.283	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	138.5	174.7	-66.7	179.4	-179.4	178.9	0	111.6	T50 Y51 V84 G88 L89	T50-K91 HydrophobicContact CG2-CB 4.17Å; T50-K91 HydrophobicContact CG2-CD 3.96Å; T50-K91 HydrophobicContact CG2-CG 4.26Å; Y51-K91 CarbonylContact O-C 3.53Å; Y51-K91 VanDerWaalsContact O-CA 3.26Å; Y51-K91 WeakPolarHBondContact O-CA 3.37Å; V84-K91 HydrophobicContact CB-CB 4Å; V84-K91 HydrophobicContact CG2-CB 3.75Å; V84-K91 PolarHBondContact N-O 3.38Å; G88-K91 WeakPolarHBondContact O-CB 3.46Å; G88-K91 WeakPolarHBondContact O-CG 3.36Å; L89-K91 PolarHBondContact O-N 2.99Å
92	F	98.5	Very high	96.3	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.018	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	121	168.9	179.6	-100.4	0	0	0	108.5	T50 Y51 I53 F61 L62 T65 C81 W82 H94 C250 F252	T50-F92 CarbonylContact C-O 3.43Å; T50-F92 WeakPolarHBondContact CA-O 3.48Å; Y51-F92 HydrophobicContact CD2-CD1 4.31Å; Y51-F92 PolarHBondContact N-O 3.29Å; Y51-F92 PolarHBondContact O-N 3.31Å; I53-F92 HydrophobicContact CD1-CB 3.93Å; F61-F92 HydrophobicContact CE1-CB 3.94Å; F61-F92 AromaticContact CE1-CD1 3.99Å; F61-F92 HydrophobicContact CE1-CD1 3.99Å; F61-F92 HydrophobicContact CE1-CD2 4.17Å; F61-F92 AromaticContact CE1-CG 3.79Å; F61-F92 HydrophobicContact CE1-CG 3.79Å; F61-F92 HydrophobicContact CZ-CD1 4.25Å; F61-F92 HydrophobicContact CZ-CG 4.48Å; L62-F92 HydrophobicContact CD2-CD2 3.83Å; L62-F92 HydrophobicContact CD2-CE2 4.22Å; T65-F92 HydrophobicContact CG2-CE1 4.41Å; T65-F92 HydrophobicContact CG2-CE2 4.47Å; T65-F92 HydrophobicContact CG2-CZ 3.89Å; C81-F92 HydrophobicContact CB-CE1 4.46Å; C81-F92 HydrophobicContact CB-CE2 4Å; C81-F92 HydrophobicContact CB-CZ 3.63Å; W82-F92 WeakPolarHBondContact O-CA 3.38Å; F92-H94 AromaticContact CD1-ND1 3.3Å; F92-H94 VanDerWaalsContact CD1-ND1 3.3Å; F92-H94 WeakPolarHBondContact CD1-ND1 3.26Å; F92-H94 HydrophobicContact CE1-CB 4.17Å; F92-H94 AromaticContact CE1-CE1 3.91Å; F92-H94 AromaticContact CE1-CG 3.9Å; F92-H94 AromaticContact CE1-ND1 3.1Å; F92-H94 WeakPolarHBondContact CE1-ND1 3.34Å; F92-C250 VanDerWaalsContact CE2-SG 3.58Å; F92-F252 HydrophobicContact CE2-CZ 4.06Å; F92-F252 HydrophobicContact CZ-CE2 4.28Å; F92-F252 HydrophobicContact CZ-CZ 4.16Å
93	F	98.6	Very high	96.1	Very high	2 Å²	2	46.5 Å²	46.5	1%	0.009	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	136.7	-178.4	173.1	-106.3	0	0	0	109.7	F48 R49 C81 W82 I95 L157 M247	F48-F93 HydrophobicContact CB-CE2 3.89Å; F48-F93 HydrophobicContact CB-CZ 4.34Å; F48-F93 HydrophobicContact CD1-CZ 4.27Å; F48-F93 AromaticContact CD2-CE2 3.66Å; F48-F93 HydrophobicContact CD2-CE2 3.66Å; F48-F93 AromaticContact CD2-CZ 3.53Å; F48-F93 HydrophobicContact CD2-CZ 3.53Å; F48-F93 HydrophobicContact CE1-CZ 4.49Å; F48-F93 HydrophobicContact CE2-CE2 4.34Å; F48-F93 AromaticContact CE2-CZ 3.77Å; F48-F93 HydrophobicContact CE2-CZ 3.77Å; F48-F93 AromaticContact CG-CE2 3.83Å; F48-F93 HydrophobicContact CG-CE2 3.83Å; F48-F93 AromaticContact CG-CZ 3.79Å; F48-F93 HydrophobicContact CG-CZ 3.79Å; F48-F93 HydrophobicContact CZ-CZ 4.24Å; R49-F93 WeakPolarHBondContact O-CA 3.27Å; R49-F93 WeakPolarHBondContact O-CD2 3.47Å; C81-F93 CarbonylContact C-O 3.56Å; C81-F93 WeakPolarHBondContact CA-O 3.3Å; W82-F93 HydrophobicContact CD2-CD1 4.41Å; W82-F93 AromaticContact CE3-CD1 3.55Å; W82-F93 HydrophobicContact CE3-CD1 3.55Å; W82-F93 AromaticContact CE3-CE1 3.92Å; W82-F93 HydrophobicContact CE3-CE1 3.92Å; W82-F93 HydrophobicContact CZ3-CD1 4Å; W82-F93 AromaticContact CZ3-CE1 3.89Å; W82-F93 HydrophobicContact CZ3-CE1 3.89Å; W82-F93 PolarHBondContact N-O 3.27Å; W82-F93 PolarHBondContact O-N 3.01Å; F93-I95 HydrophobicContact CE1-CD1 3.77Å; F93-I95 HydrophobicContact CE1-CG1 3.68Å; F93-I95 HydrophobicContact CZ-CD1 3.85Å; F93-I95 HydrophobicContact CZ-CG1 3.57Å; F93-L157 HydrophobicContact CD2-CD2 4.49Å; F93-L157 HydrophobicContact CE1-CD2 4.17Å; F93-L157 HydrophobicContact CE2-CD2 3.93Å; F93-L157 HydrophobicContact CZ-CD1 4.43Å; F93-L157 HydrophobicContact CZ-CD2 3.77Å; F93-M247 HydrophobicContact CB-SD 4.15Å; F93-M247 HydrophobicContact CD1-CE 3.89Å; F93-M247 HydrophobicContact CD1-SD 3.62Å; F93-M247 HydrophobicContact CE1-CE 4.17Å; F93-M247 HydrophobicContact CE1-SD 4.37Å; F93-M247 HydrophobicContact CG-SD 4.09Å
94	H	98.6	Very high	96	Very high	8 Å²	8	47.6 Å²	47.6	4%	0.037	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	154.7	177	58.1	-95.6	0	0	0	112.7	R49 Y51 L78 G80 C81 F92 W96	R49-H94 WeakPolarHBondContact CB-NE2 3.37Å; R49-H94 VanDerWaalsContact CD-NE2 3.33Å; R49-H94 WeakPolarHBondContact CD-NE2 3.47Å; R49-H94 PolarHBondContact N-O 2.88Å; R49-H94 PolarHBondContact O-N 2.78Å; Y51-H94 AromaticContact CE2-CE1 3.66Å; Y51-H94 AromaticContact CZ-CE1 3.64Å; L78-H94 HydrophobicContact CD1-CB 4.37Å; G80-H94 VanDerWaalsContact O-CA 3.25Å; G80-H94 WeakPolarHBondContact O-CA 3.47Å; G80-H94 WeakPolarHBondContact O-CB 3.48Å; C81-H94 HydrophobicContact CB-CB 3.87Å; F92-H94 AromaticContact CD1-ND1 3.3Å; F92-H94 VanDerWaalsContact CD1-ND1 3.3Å; F92-H94 WeakPolarHBondContact CD1-ND1 3.26Å; F92-H94 HydrophobicContact CE1-CB 4.17Å; F92-H94 AromaticContact CE1-CE1 3.91Å; F92-H94 AromaticContact CE1-CG 3.9Å; F92-H94 AromaticContact CE1-ND1 3.1Å; F92-H94 WeakPolarHBondContact CE1-ND1 3.34Å; H94-W96 AromaticContact CD2-CD1 3.54Å; H94-W96 AromaticContact CD2-CE2 3.84Å; H94-W96 AromaticContact CD2-NE1 2.95Å; H94-W96 PolarHBondContact CD2-NE1 3.01Å; H94-W96 AromaticContact NE2-NE1 3.24Å; H94-W96 PolarHBondContact NE2-NE1 3.07Å
95	I	98.8	Very high	95.9	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.8	-175.6	-57.5	174.2	0	0	0	109.1	Y46 E47 F48 I79 G80 W82 F93 L206	Y46-I95 HydrophobicContact CD1-CG2 4.01Å; E47-I95 WeakPolarHBondContact O-CA 3.29Å; F48-I95 HydrophobicContact CD1-CB 4.21Å; F48-I95 HydrophobicContact CD1-CD1 4.07Å; F48-I95 HydrophobicContact CD1-CG1 3.59Å; F48-I95 HydrophobicContact CD1-CG2 3.88Å; F48-I95 HydrophobicContact CE1-CB 4.22Å; F48-I95 HydrophobicContact CE1-CD1 3.43Å; F48-I95 VanDerWaalsContact CE1-CD1 3.43Å; F48-I95 HydrophobicContact CE1-CG1 3.5Å; F48-I95 HydrophobicContact CE1-CG2 3.71Å; F48-I95 HydrophobicContact CG-CG1 4.32Å; F48-I95 HydrophobicContact CZ-CD1 3.7Å; F48-I95 HydrophobicContact CZ-CG1 4.15Å; I79-I95 HydrophobicContact CB-CB 3.95Å; I79-I95 HydrophobicContact CB-CG2 3.83Å; I79-I95 WeakPolarHBondContact CB-O 3.21Å; I79-I95 HydrophobicContact CG1-CG2 3.97Å; I79-I95 HydrophobicContact CG2-CB 4.31Å; I79-I95 HydrophobicContact CG2-CG2 4.19Å; I79-I95 PolarHBondContact N-O 2.96Å; G80-I95 PolarHBondContact O-N 2.91Å; W82-I95 HydrophobicContact CH2-CD1 4.03Å; W82-I95 HydrophobicContact CH2-CG1 4.49Å; W82-I95 HydrophobicContact CZ3-CD1 3.9Å; W82-I95 HydrophobicContact CZ3-CG1 3.95Å; F93-I95 HydrophobicContact CE1-CD1 3.77Å; F93-I95 HydrophobicContact CE1-CG1 3.68Å; F93-I95 HydrophobicContact CZ-CD1 3.85Å; F93-I95 HydrophobicContact CZ-CG1 3.57Å; I95-L206 HydrophobicContact CD1-CD2 4.16Å
96	W	98.4	Very high	96	Very high	7 Å²	7	49 Å²	49	3%	0.027	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	147.9	169.5	-58.4	95.2	0	0	0	110.6	Y46 E47 I69 R72 T73 S76 Q77 L78 H94 Y98	Y46-W96 CarbonylContact C-O 3.51Å; Y46-W96 VanDerWaalsContact CA-O 3.25Å; Y46-W96 WeakPolarHBondContact CA-O 3.36Å; E47-W96 HydrophobicContact CB-CB 4.34Å; E47-W96 PolarHBondContact N-O 2.81Å; E47-W96 PolarHBondContact O-N 3Å; I69-W96 HydrophobicContact CD1-CH2 4.12Å; I69-W96 HydrophobicContact CD1-CZ2 4.19Å; R72-W96 HydrophobicContact CB-CH2 4.08Å; R72-W96 HydrophobicContact CG-CH2 3.32Å; R72-W96 HydrophobicContact CG-CZ2 3.64Å; R72-W96 HydrophobicContact CG-CZ3 3.94Å; T73-W96 HydrophobicContact CG2-CH2 4.04Å; T73-W96 HydrophobicContact CG2-CZ3 4.07Å; S76-W96 VanDerWaalsContact CB-CZ3 3.49Å; S76-W96 WeakPolarHBondContact O-CZ3 3.44Å; Q77-W96 WeakPolarHBondContact O-CA 3.29Å; L78-W96 HydrophobicContact CB-CE3 3.94Å; L78-W96 HydrophobicContact CB-CH2 4.05Å; L78-W96 HydrophobicContact CB-CZ3 3.53Å; L78-W96 HydrophobicContact CD1-CD2 4.14Å; L78-W96 HydrophobicContact CD1-CE3 4.08Å; L78-W96 HydrophobicContact CD1-CH2 3.86Å; L78-W96 HydrophobicContact CD1-CZ2 3.93Å; L78-W96 HydrophobicContact CD1-CZ3 3.97Å; L78-W96 HydrophobicContact CG-CH2 4.37Å; L78-W96 HydrophobicContact CG-CZ3 4.28Å; H94-W96 AromaticContact CD2-CD1 3.54Å; H94-W96 AromaticContact CD2-CE2 3.84Å; H94-W96 AromaticContact CD2-NE1 2.95Å; H94-W96 PolarHBondContact CD2-NE1 3.01Å; H94-W96 AromaticContact NE2-NE1 3.24Å; H94-W96 PolarHBondContact NE2-NE1 3.07Å; W96-Y98 HydrophobicContact CB-CD2 4.42Å; W96-Y98 HydrophobicContact CB-CE2 3.68Å
97	Q	97.8	Very high	96	Very high	34 Å²	34	43.5 Å²	43.5	16%	0.159	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	139.8	171.9	-178.3	176.8	-56	0	0	110.6	T44 Y46 Q77 I79	T44-Q97 HydrophobicContact CG2-CG 3.45Å; T44-Q97 VanDerWaalsContact CG2-CG 3.45Å; Y46-Q97 HydrophobicContact CD1-CB 4.17Å; Y46-Q97 HydrophobicContact CD1-CG 4.38Å; Y46-Q97 HydrophobicContact CE1-CB 4.01Å; Y46-Q97 HydrophobicContact CE1-CG 3.92Å; Y46-Q97 PolarHBondContact OH-OE1 3.35Å; Q77-Q97 HydrophobicContact CB-CB 4.37Å; Q77-Q97 HydrophobicContact CG-CB 4.4Å; Q77-Q97 PolarHBondContact O-N 3.27Å; Q77-Q97 VanDerWaalsContact OE1-NE2 3.13Å; I79-Q97 HydrophobicContact CD1-CB 3.8Å; I79-Q97 HydrophobicContact CG1-CB 3.93Å
98	Y	97.1	Very high	96.1	Very high	3 Å²	3	45 Å²	45	1%	0.012	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	140.5	174.2	-64.7	-72.3	0	0	0	110.2	T44 F45 E47 R72 S76 W96 R104 V107	T44-Y98 CarbonylContact C-O 3.59Å; T44-Y98 VanDerWaalsContact CA-O 3.23Å; T44-Y98 WeakPolarHBondContact CA-O 3.38Å; F45-Y98 HydrophobicContact CD2-CD2 4.48Å; F45-Y98 AromaticContact CE2-CD2 3.75Å; F45-Y98 HydrophobicContact CE2-CD2 3.75Å; F45-Y98 HydrophobicContact CE2-CG 4.24Å; F45-Y98 HydrophobicContact CZ-CD2 4.08Å; F45-Y98 HydrophobicContact CZ-CG 4.14Å; F45-Y98 PolarHBondContact N-O 2.93Å; F45-Y98 PolarHBondContact O-N 3.32Å; E47-Y98 HydrophobicContact CB-CD2 4.38Å; E47-Y98 HydrophobicContact CB-CE2 4.09Å; E47-Y98 WeakPolarHBondContact OE2-CE2 3.37Å; R72-Y98 PolarHBondContact NH2-OH 3.43Å; R72-Y98 VanDerWaalsContact NH2-OH 3.09Å; S76-Y98 PolarHBondContact OG-OH 2.89Å; S76-Y98 VanDerWaalsContact OG-OH 3.14Å; W96-Y98 HydrophobicContact CB-CD2 4.42Å; W96-Y98 HydrophobicContact CB-CE2 3.68Å; Y98-R104 HydrophobicContact CD1-CB 3.75Å; Y98-R104 HydrophobicContact CD1-CG 4.03Å; Y98-R104 HydrophobicContact CD2-CB 4.17Å; Y98-R104 HydrophobicContact CD2-CG 3.91Å; Y98-R104 HydrophobicContact CE1-CB 4.18Å; Y98-R104 HydrophobicContact CE1-CG 4.01Å; Y98-R104 HydrophobicContact CE2-CG 3.86Å; Y98-R104 HydrophobicContact CG-CB 3.76Å; Y98-R104 HydrophobicContact CG-CG 4Å; Y98-V107 HydrophobicContact CE1-CB 4.4Å; Y98-V107 HydrophobicContact CE1-CG1 4.12Å
99	D	94.1	Very high	96.4	Very high	75 Å²	75	46.7 Å²	46.7	40%	0.401	26%	0.259	S	S	.	.	S	Bend	trans	-78.7	-23.2	179.7	-57.8	-40.9	0	0	0	112.7	R43 Q103	R43-D99 CarbonylContact C-O 3.54Å; R43-D99 VanDerWaalsContact C-O 3.32Å; R43-D99 VanDerWaalsContact CB-O 3.22Å; R43-D99 WeakPolarHBondContact CB-O 3.21Å; D99-Q103 PolarHBondContact OD2-NE2 3.43Å
100	S	93.2	Very high	96.5	Very high	33 Å²	33	43 Å²	43	23%	0.231	25%	0.246	C	C	.	.			trans	-167.7	162.7	179.3	61.3	0	0	0	0	112.7	F45 S102 Q103 R104	F45-S100 VanDerWaalsContact CE1-C 3.45Å; S100-S102 VanDerWaalsContact C-N 3.31Å; S100-S102 PolarHBondContact O-N 3.24Å; S100-S102 PolarHBondContact OG-OG 3.17Å; S100-Q103 PolarHBondContact O-N 3.01Å; S100-Q103 WeakPolarHBondContact OG-CB 3.35Å; S100-Q103 PolarHBondContact OG-N 2.8Å; S100-R104 PolarHBondContact O-N 3.37Å
101	Y	93	Very high	96.5	Very high	83 Å²	83	40.8 Å²	40.8	33%	0.325	23%	0.234	S	C	.	.	H	α-helix	trans	-65.1	-35.9	179.7	-72	-67.6	0	0	0	112.3	F45 R104 A105 V136 Y138 F197	F45-Y101 HydrophobicContact CD1-CD1 4.38Å; F45-Y101 HydrophobicContact CD1-CE1 4.2Å; F45-Y101 AromaticContact CE1-CD1 3.58Å; F45-Y101 HydrophobicContact CE1-CD1 3.58Å; F45-Y101 HydrophobicContact CE1-CD2 4.44Å; F45-Y101 AromaticContact CE1-CE1 3.77Å; F45-Y101 HydrophobicContact CE1-CE1 3.77Å; F45-Y101 AromaticContact CE1-CG 3.93Å; F45-Y101 HydrophobicContact CE1-CG 3.93Å; F45-Y101 HydrophobicContact CE2-CE1 4.28Å; F45-Y101 AromaticContact CZ-CD1 3.65Å; F45-Y101 HydrophobicContact CZ-CD1 3.65Å; F45-Y101 AromaticContact CZ-CE1 3.82Å; F45-Y101 HydrophobicContact CZ-CE1 3.82Å; F45-Y101 HydrophobicContact CZ-CG 4.41Å; Y101-R104 PolarHBondContact O-N 3.08Å; Y101-A105 WeakPolarHBondContact O-CB 3.38Å; Y101-A105 PolarHBondContact O-N 2.87Å; Y101-V136 HydrophobicContact CE1-CG1 3.98Å; Y101-V136 WeakPolarHBondContact OH-CG1 3.35Å; Y101-Y138 WeakPolarHBondContact CE2-OH 3.39Å; Y101-Y138 PolarHBondContact OH-OH 2.94Å; Y101-F197 HydrophobicContact CE1-CD2 4.45Å; Y101-F197 HydrophobicContact CE1-CE2 4.1Å; Y101-F197 AromaticContact CZ-CE2 3.89Å; Y101-F197 WeakPolarHBondContact OH-CE2 3.47Å
102	S	94.6	Very high	96.2	Very high	88 Å²	88	40.6 Å²	40.6	62%	0.615	24%	0.244	S	C	*	.	H	α-helix	trans	-66.2	-43.2	176.2	52.9	0	0	0	0	111.7	S100 A105 A106	S100-S102 VanDerWaalsContact C-N 3.31Å; S100-S102 PolarHBondContact O-N 3.24Å; S100-S102 PolarHBondContact OG-OG 3.17Å; S102-A105 PolarHBondContact O-N 3.03Å; S102-A106 WeakPolarHBondContact O-CB 3.37Å; S102-A106 PolarHBondContact O-N 3.32Å
103	Q	95.1	Very high	96.1	Very high	70 Å²	70	48 Å²	48	33%	0.327	28%	0.279	S	S	.	.	H	α-helix	trans	-59.8	-47	172.7	-175	-157.3	44.2	0	0	110.7	D99 S100 A105 A106 V107	D99-Q103 PolarHBondContact OD2-NE2 3.43Å; S100-Q103 PolarHBondContact O-N 3.01Å; S100-Q103 WeakPolarHBondContact OG-CB 3.35Å; S100-Q103 PolarHBondContact OG-N 2.8Å; Q103-A105 VanDerWaalsContact C-N 3.32Å; Q103-A105 PolarHBondContact O-N 2.71Å; Q103-A106 PolarHBondContact O-N 2.84Å; Q103-V107 HydrophobicContact CG-CG2 4.44Å; Q103-V107 WeakPolarHBondContact O-CB 3.37Å; Q103-V107 WeakPolarHBondContact O-CG2 2.92Å; Q103-V107 PolarHBondContact O-N 3.38Å
104	R	95.6	Very high	96	Very high	53 Å²	53	49.4 Å²	49.4	20%	0.2	29%	0.287	C	S	.	.	H	α-helix	trans	-58.5	-43.6	176.4	-177.8	176.3	175.1	-85.3	4.8	111.8	F45 E47 Y98 S100 Y101 V107 R108	F45-R104 HydrophobicContact CZ-CB 3.85Å; F45-R104 VanDerWaalsContact CZ-CD 3.48Å; F45-R104 HydrophobicContact CZ-CG 4.27Å; E47-R104 IonicContact OE1-CZ 3.86Å; E47-R104 IonicContact OE1-NE 3.42Å; E47-R104 IonicContact OE1-NH2 3.14Å; E47-R104 PolarHBondContact OE1-NH2 2.84Å; E47-R104 IonicContact OE2-CZ 2.83Å; E47-R104 IonicContact OE2-NE 3.08Å; E47-R104 PolarHBondContact OE2-NE 3.27Å; E47-R104 IonicContact OE2-NH2 2.69Å; E47-R104 PolarHBondContact OE2-NH2 3.27Å; E47-R104 VanDerWaalsContact OE2-NH2 3.14Å; Y98-R104 HydrophobicContact CD1-CB 3.75Å; Y98-R104 HydrophobicContact CD1-CG 4.03Å; Y98-R104 HydrophobicContact CD2-CB 4.17Å; Y98-R104 HydrophobicContact CD2-CG 3.91Å; Y98-R104 HydrophobicContact CE1-CB 4.18Å; Y98-R104 HydrophobicContact CE1-CG 4.01Å; Y98-R104 HydrophobicContact CE2-CG 3.86Å; Y98-R104 HydrophobicContact CG-CB 3.76Å; Y98-R104 HydrophobicContact CG-CG 4Å; S100-R104 PolarHBondContact O-N 3.37Å; Y101-R104 PolarHBondContact O-N 3.08Å; R104-V107 PolarHBondContact O-N 2.89Å; R104-R108 HydrophobicContact CG-CG 4.35Å; R104-R108 WeakPolarHBondContact O-CB 3.4Å; R104-R108 VanDerWaalsContact O-CG 3.28Å; R104-R108 WeakPolarHBondContact O-CG 3.19Å; R104-R108 PolarHBondContact O-N 2.94Å
105	A	96.2	Very high	95.9	Very high	58 Å²	58	53.8 Å²	53.8	48%	0.479	32%	0.316	S	S	.	.	H	α-helix	trans	-61.8	-45.9	178.1	0	0	0	0	0	111.8	Y101 S102 Q103 R108 A109	Y101-A105 WeakPolarHBondContact O-CB 3.38Å; Y101-A105 PolarHBondContact O-N 2.87Å; S102-A105 PolarHBondContact O-N 3.03Å; Q103-A105 VanDerWaalsContact C-N 3.32Å; Q103-A105 PolarHBondContact O-N 2.71Å; A105-R108 PolarHBondContact O-N 2.97Å; A105-A109 WeakPolarHBondContact O-CB 3.43Å; A105-A109 PolarHBondContact O-N 2.86Å
106	A	96.9	Very high	95.8	Very high	62 Å²	62	55.8 Å²	55.8	51%	0.512	33%	0.33	S	S	.	.	H	α-helix	trans	-61.4	-45.5	176.4	0	0	0	0	0	112	S102 Q103 R108 A109 A110	S102-A106 WeakPolarHBondContact O-CB 3.37Å; S102-A106 PolarHBondContact O-N 3.32Å; Q103-A106 PolarHBondContact O-N 2.84Å; A106-R108 PolarHBondContact O-N 3.14Å; A106-A109 PolarHBondContact O-N 3.09Å; A106-A110 PolarHBondContact O-N 2.93Å
107	V	96.8	Very high	95.7	Very high	23 Å²	23	56.1 Å²	56.1	14%	0.139	33%	0.331	C	S	.	.	H	α-helix	trans	-59.6	-44.9	175.3	165.4	0	0	0	0	111.3	H75 S76 Y98 Q103 R104 A109 A110 V111	H75-V107 HydrophobicContact CB-CG1 4.1Å; H75-V107 VanDerWaalsContact O-CG1 3.25Å; H75-V107 WeakPolarHBondContact O-CG1 3.46Å; H75-V107 WeakPolarHBondContact O-CG2 3.5Å; S76-V107 WeakPolarHBondContact OG-CG1 3.43Å; Y98-V107 HydrophobicContact CE1-CB 4.4Å; Y98-V107 HydrophobicContact CE1-CG1 4.12Å; Q103-V107 HydrophobicContact CG-CG2 4.44Å; Q103-V107 WeakPolarHBondContact O-CB 3.37Å; Q103-V107 WeakPolarHBondContact O-CG2 2.92Å; Q103-V107 PolarHBondContact O-N 3.38Å; R104-V107 PolarHBondContact O-N 2.89Å; V107-A109 VanDerWaalsContact C-N 3.34Å; V107-A109 PolarHBondContact O-N 3.08Å; V107-A110 PolarHBondContact O-N 2.98Å; V107-V111 HydrophobicContact CG1-CG2 4.37Å; V107-V111 WeakPolarHBondContact O-CB 3.39Å; V107-V111 VanDerWaalsContact O-CG2 3.25Å; V107-V111 WeakPolarHBondContact O-CG2 3.4Å; V107-V111 PolarHBondContact O-N 3.24Å
108	R	95.8	Very high	95.7	Very high	94 Å²	94	58 Å²	58	36%	0.355	34%	0.341	S	S	.	.	H	α-helix	trans	-63.9	-38.8	177.5	-75.5	-63.5	-53.2	179.1	9.6	112.2	R104 A105 A106 A112	R104-R108 HydrophobicContact CG-CG 4.35Å; R104-R108 WeakPolarHBondContact O-CB 3.4Å; R104-R108 VanDerWaalsContact O-CG 3.28Å; R104-R108 WeakPolarHBondContact O-CG 3.19Å; R104-R108 PolarHBondContact O-N 2.94Å; A105-R108 PolarHBondContact O-N 2.97Å; A106-R108 PolarHBondContact O-N 3.14Å; R108-A112 WeakPolarHBondContact O-CB 3.45Å; R108-A112 PolarHBondContact O-N 2.98Å; R108-A112 VanDerWaalsContact O-N 3.07Å
109	A	97.1	Very high	95.7	Very high	51 Å²	51	60.9 Å²	60.9	42%	0.421	36%	0.362	S	S	.	.	H	α-helix	trans	-65.1	-45.3	175.8	0	0	0	0	0	111.5	A105 A106 V107 A112 Q113	A105-A109 WeakPolarHBondContact O-CB 3.43Å; A105-A109 PolarHBondContact O-N 2.86Å; A106-A109 PolarHBondContact O-N 3.09Å; V107-A109 VanDerWaalsContact C-N 3.34Å; V107-A109 PolarHBondContact O-N 3.08Å; A109-A112 PolarHBondContact O-N 2.92Å; A109-Q113 WeakPolarHBondContact O-CG 3.27Å; A109-Q113 PolarHBondContact O-N 2.95Å
110	A	96.3	Very high	95.9	Very high	43 Å²	43	60 Å²	60	36%	0.355	36%	0.355	S	S	.	.	H	α-helix	trans	-61.5	-48.8	177.1	0	0	0	0	0	111.9	A106 V107 A112 Q113 D114	A106-A110 PolarHBondContact O-N 2.93Å; V107-A110 PolarHBondContact O-N 2.98Å; A110-A112 VanDerWaalsContact C-N 3.25Å; A110-A112 PolarHBondContact O-N 3.31Å; A110-Q113 PolarHBondContact O-N 3.03Å; A110-D114 PolarHBondContact O-N 3.3Å
111	V	95.1	Very high	96.1	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.006	35%	0.346	C	S	.	.	H	α-helix	trans	-63.9	-30.8	179.3	173.8	0	0	0	0	112.2	H75 V107 Q113 D114 W117	H75-V111 HydrophobicContact CB-CG2 3.46Å; H75-V111 VanDerWaalsContact CB-CG2 3.46Å; V107-V111 HydrophobicContact CG1-CG2 4.37Å; V107-V111 WeakPolarHBondContact O-CB 3.39Å; V107-V111 VanDerWaalsContact O-CG2 3.25Å; V107-V111 WeakPolarHBondContact O-CG2 3.4Å; V107-V111 PolarHBondContact O-N 3.24Å; V111-Q113 PolarHBondContact O-N 3Å; V111-D114 PolarHBondContact O-N 3.27Å; V111-W117 HydrophobicContact CG1-CD2 4.18Å; V111-W117 HydrophobicContact CG1-CG 3.74Å; V111-W117 VanDerWaalsContact CG1-NE1 3.27Å
112	A	93.8	Very high	96.3	Very high	61 Å²	61	57.1 Å²	57.1	50%	0.504	34%	0.342	S	S	.	.	H	α-helix	trans	-69.8	-19.2	175.8	0	0	0	0	0	113.1	R108 A109 A110	R108-A112 WeakPolarHBondContact O-CB 3.45Å; R108-A112 PolarHBondContact O-N 2.98Å; R108-A112 VanDerWaalsContact O-N 3.07Å; A109-A112 PolarHBondContact O-N 2.92Å; A110-A112 VanDerWaalsContact C-N 3.25Å; A110-A112 PolarHBondContact O-N 3.31Å
113	Q	95.2	Very high	96.5	Very high	159 Å²	159	56 Å²	56	74%	0.743	33%	0.334	S	S	*	.	H	α-helix	trans	-97.5	-7.9	178.1	-65.6	177.1	7.4	0	0	113	A109 A110 V111 P115	A109-Q113 WeakPolarHBondContact O-CG 3.27Å; A109-Q113 PolarHBondContact O-N 2.95Å; A110-Q113 PolarHBondContact O-N 3.03Å; V111-Q113 PolarHBondContact O-N 3Å; Q113-P115 WeakPolarHBondContact O-CD 3.32Å
114	D	96.1	Very high	96.6	Very high	32 Å²	32	58 Å²	58	17%	0.171	34%	0.342	C	S	.	.			trans	-74.4	109.4	176.4	177.3	-9.3	0	0	0	110.6	H75 A110 V111 S116 W117 I118	H75-D114 IonicContact NE2-OD2 3.72Å; A110-D114 PolarHBondContact O-N 3.3Å; V111-D114 PolarHBondContact O-N 3.27Å; D114-S116 VanDerWaalsContact C-N 3.29Å; D114-S116 PolarHBondContact O-N 3.26Å; D114-S116 WeakPolarHBondContact OD1-CA 3.31Å; D114-S116 WeakPolarHBondContact OD1-CB 3.37Å; D114-S116 PolarHBondContact OD1-N 2.88Å; D114-W117 HydrophobicContact CB-CB 3.89Å; D114-W117 PolarHBondContact O-N 3Å; D114-W117 PolarHBondContact OD1-N 2.79Å; D114-W117 VanDerWaalsContact OD1-N 3.13Å; D114-I118 WeakPolarHBondContact O-CG1 3.5Å; D114-I118 PolarHBondContact O-N 2.88Å; D114-I118 VanDerWaalsContact O-N 3.1Å
115	P	96.8	Very high	96.8	Very high	99 Å²	99	55.6 Å²	55.6	64%	0.643	33%	0.334	S	S	*	.	H	α-helix	trans	-65.1	-31.9	-177.8	-19.4	34.2	0	0	0	113	Q113 S119	Q113-P115 WeakPolarHBondContact O-CD 3.32Å; P115-S119 VanDerWaalsContact O-CB 3.24Å; P115-S119 WeakPolarHBondContact O-CB 3.17Å; P115-S119 PolarHBondContact O-N 3.37Å; P115-S119 PolarHBondContact O-OG 3.21Å
116	S	97.4	Very high	96.8	Very high	43 Å²	43	56.8 Å²	56.8	30%	0.301	33%	0.331	S	S	.	.	H	α-helix	trans	-69.6	-44.5	177.6	-85.5	0	0	0	0	110.3	D114 I118 E120	D114-S116 VanDerWaalsContact C-N 3.29Å; D114-S116 PolarHBondContact O-N 3.26Å; D114-S116 WeakPolarHBondContact OD1-CA 3.31Å; D114-S116 WeakPolarHBondContact OD1-CB 3.37Å; D114-S116 PolarHBondContact OD1-N 2.88Å; S116-I118 VanDerWaalsContact C-N 3.32Å; S116-I118 PolarHBondContact O-N 3.19Å; S116-E120 VanDerWaalsContact CB-OE1 3.27Å; S116-E120 WeakPolarHBondContact CB-OE1 3.38Å; S116-E120 WeakPolarHBondContact O-CA 3.25Å; S116-E120 WeakPolarHBondContact O-CB 3.43Å; S116-E120 WeakPolarHBondContact O-CG 3.44Å; S116-E120 PolarHBondContact O-N 2.95Å; S116-E120 PolarHBondContact OG-OE1 3.34Å
117	W	97	Very high	96.9	Very high	14 Å²	14	57.6 Å²	57.6	5%	0.053	33%	0.331	C	S	.	.	I	π-helix	trans	-58.9	-44.1	174.4	176.4	-111.6	0	0	0	112.5	L71 R72 V111 D114 Y121 I122	L71-W117 HydrophobicContact CB-CE3 3.78Å; L71-W117 HydrophobicContact CB-CZ3 4.44Å; R72-W117 HydrophobicContact CB-CE3 4.16Å; R72-W117 HydrophobicContact CB-CH2 3.56Å; R72-W117 HydrophobicContact CB-CZ2 4.14Å; R72-W117 HydrophobicContact CB-CZ3 3.59Å; R72-W117 HydrophobicContact CG-CH2 4.16Å; R72-W117 HydrophobicContact CG-CZ2 4.39Å; V111-W117 HydrophobicContact CG1-CD2 4.18Å; V111-W117 HydrophobicContact CG1-CG 3.74Å; V111-W117 VanDerWaalsContact CG1-NE1 3.27Å; D114-W117 HydrophobicContact CB-CB 3.89Å; D114-W117 PolarHBondContact O-N 3Å; D114-W117 PolarHBondContact OD1-N 2.79Å; D114-W117 VanDerWaalsContact OD1-N 3.13Å; W117-Y121 HydrophobicContact CD2-CD1 4.25Å; W117-Y121 AromaticContact CE3-CD1 3.8Å; W117-Y121 HydrophobicContact CE3-CD1 3.8Å; W117-Y121 AromaticContact CE3-CG 3.99Å; W117-Y121 HydrophobicContact CE3-CG 3.99Å; W117-Y121 AromaticContact CH2-CD1 3.03Å; W117-Y121 HydrophobicContact CH2-CD1 3.03Å; W117-Y121 AromaticContact CH2-CE1 3.18Å; W117-Y121 HydrophobicContact CH2-CE1 3.18Å; W117-Y121 AromaticContact CH2-CG 3.87Å; W117-Y121 HydrophobicContact CH2-CG 3.87Å; W117-Y121 AromaticContact CZ2-CD1 3.52Å; W117-Y121 HydrophobicContact CZ2-CD1 3.52Å; W117-Y121 AromaticContact CZ2-CE1 3.76Å; W117-Y121 HydrophobicContact CZ2-CE1 3.76Å; W117-Y121 AromaticContact CZ3-CD1 3.17Å; W117-Y121 HydrophobicContact CZ3-CD1 3.17Å; W117-Y121 HydrophobicContact CZ3-CD2 4.35Å; W117-Y121 AromaticContact CZ3-CE1 3.73Å; W117-Y121 HydrophobicContact CZ3-CE1 3.73Å; W117-Y121 AromaticContact CZ3-CG 3.5Å; W117-Y121 HydrophobicContact CZ3-CG 3.5Å; W117-Y121 WeakPolarHBondContact O-CB 3.42Å; W117-Y121 PolarHBondContact O-N 2.86Å; W117-I122 HydrophobicContact CD2-CG1 4.16Å; W117-I122 HydrophobicContact CG-CG1 4.3Å; W117-I122 HydrophobicContact CZ2-CD1 3.68Å; W117-I122 HydrophobicContact CZ2-CG1 4.01Å; W117-I122 PolarHBondContact O-N 2.82Å
118	I	97	Very high	97	Very high	72 Å²	72	57.4 Å²	57.4	37%	0.369	33%	0.33	S	S	.	.	I	π-helix	trans	-67.9	-52.7	-179.3	-63.4	-60.4	0	0	0	111.4	D114 S116 I122 S123	D114-I118 WeakPolarHBondContact O-CG1 3.5Å; D114-I118 PolarHBondContact O-N 2.88Å; D114-I118 VanDerWaalsContact O-N 3.1Å; S116-I118 VanDerWaalsContact C-N 3.32Å; S116-I118 PolarHBondContact O-N 3.19Å; I118-I122 PolarHBondContact O-N 3.18Å; I118-S123 WeakPolarHBondContact O-CB 3.25Å; I118-S123 PolarHBondContact O-N 3.21Å; I118-S123 PolarHBondContact O-OG 2.97Å
119	S	97.6	Very high	97.1	Very high	65 Å²	65	54 Å²	54	46%	0.455	32%	0.318	S	S	.	.	I	π-helix	trans	-79.5	-36	-172.2	66	0	0	0	0	113.5	P115 S123	P115-S119 VanDerWaalsContact O-CB 3.24Å; P115-S119 WeakPolarHBondContact O-CB 3.17Å; P115-S119 PolarHBondContact O-N 3.37Å; P115-S119 PolarHBondContact O-OG 3.21Å; S119-S123 PolarHBondContact O-OG 2.96Å
120	E	97.9	Very high	97.2	Very high	55 Å²	55	56.2 Å²	56.2	26%	0.257	33%	0.326	S	S	.	.	I	π-helix	trans	-91.4	-27.4	-174	-56.3	-178.3	-134.4	0	0	113.2	K68 L71 S116 K124	K68-E120 HydrophobicContact CD-CB 4.27Å; K68-E120 IonicContact NZ-OE2 3.59Å; K68-E120 PolarHBondContact NZ-OE2 2.91Å; L71-E120 HydrophobicContact CD1-CB 4.41Å; S116-E120 VanDerWaalsContact CB-OE1 3.27Å; S116-E120 WeakPolarHBondContact CB-OE1 3.38Å; S116-E120 WeakPolarHBondContact O-CA 3.25Å; S116-E120 WeakPolarHBondContact O-CB 3.43Å; S116-E120 WeakPolarHBondContact O-CG 3.44Å; S116-E120 PolarHBondContact O-N 2.95Å; S116-E120 PolarHBondContact OG-OE1 3.34Å; E120-K124 WeakPolarHBondContact O-CD 3.39Å
121	Y	97.9	Very high	97.3	Very high	10 Å²	10	56.2 Å²	56.2	4%	0.039	33%	0.326	C	S	.	.	I	π-helix	trans	-116.3	-65.5	-179.5	-175	-102	0	0	0	113.4	L64 T65 K68 W117 S123 K124 A125	L64-Y121 HydrophobicContact CD1-CD2 4.43Å; L64-Y121 HydrophobicContact CD2-CD2 4.23Å; L64-Y121 HydrophobicContact CD2-CE2 4.44Å; L64-Y121 HydrophobicContact CG-CD2 3.87Å; L64-Y121 HydrophobicContact CG-CE2 4.14Å; T65-Y121 HydrophobicContact CG2-CE2 4.37Å; T65-Y121 PolarHBondContact OG1-OH 2.93Å; K68-Y121 HydrophobicContact CB-CD2 3.78Å; K68-Y121 HydrophobicContact CB-CG 4.3Å; W117-Y121 HydrophobicContact CD2-CD1 4.25Å; W117-Y121 AromaticContact CE3-CD1 3.8Å; W117-Y121 HydrophobicContact CE3-CD1 3.8Å; W117-Y121 AromaticContact CE3-CG 3.99Å; W117-Y121 HydrophobicContact CE3-CG 3.99Å; W117-Y121 AromaticContact CH2-CD1 3.03Å; W117-Y121 HydrophobicContact CH2-CD1 3.03Å; W117-Y121 AromaticContact CH2-CE1 3.18Å; W117-Y121 HydrophobicContact CH2-CE1 3.18Å; W117-Y121 AromaticContact CH2-CG 3.87Å; W117-Y121 HydrophobicContact CH2-CG 3.87Å; W117-Y121 AromaticContact CZ2-CD1 3.52Å; W117-Y121 HydrophobicContact CZ2-CD1 3.52Å; W117-Y121 AromaticContact CZ2-CE1 3.76Å; W117-Y121 HydrophobicContact CZ2-CE1 3.76Å; W117-Y121 AromaticContact CZ3-CD1 3.17Å; W117-Y121 HydrophobicContact CZ3-CD1 3.17Å; W117-Y121 HydrophobicContact CZ3-CD2 4.35Å; W117-Y121 AromaticContact CZ3-CE1 3.73Å; W117-Y121 HydrophobicContact CZ3-CE1 3.73Å; W117-Y121 AromaticContact CZ3-CG 3.5Å; W117-Y121 HydrophobicContact CZ3-CG 3.5Å; W117-Y121 WeakPolarHBondContact O-CB 3.42Å; W117-Y121 PolarHBondContact O-N 2.86Å; Y121-S123 PolarHBondContact O-N 3.17Å; Y121-K124 PolarHBondContact O-N 3.34Å; Y121-K124 VanDerWaalsContact O-N 3.1Å; Y121-A125 HydrophobicContact CD1-CB 4.26Å; Y121-A125 HydrophobicContact CD2-CB 4.34Å; Y121-A125 HydrophobicContact CE1-CB 4.01Å; Y121-A125 HydrophobicContact CE2-CB 4.05Å; Y121-A125 HydrophobicContact CG-CB 4.47Å; Y121-A125 VanDerWaalsContact O-CB 3.24Å; Y121-A125 WeakPolarHBondContact O-CB 3.48Å; Y121-A125 PolarHBondContact O-N 3.23Å
122	I	96.9	Very high	97.4	Very high	46 Å²	46	60 Å²	60	24%	0.236	34%	0.344	C	S	.	.	I	π-helix	trans	-60.3	-47.4	-167.6	-70.5	-71.6	0	0	0	112.4	W117 I118 K124 A125 L126	W117-I122 HydrophobicContact CD2-CG1 4.16Å; W117-I122 HydrophobicContact CG-CG1 4.3Å; W117-I122 HydrophobicContact CZ2-CD1 3.68Å; W117-I122 HydrophobicContact CZ2-CG1 4.01Å; W117-I122 PolarHBondContact O-N 2.82Å; I118-I122 PolarHBondContact O-N 3.18Å; I122-K124 PolarHBondContact O-N 3.09Å; I122-A125 PolarHBondContact O-N 3.02Å; I122-L126 HydrophobicContact CG2-CD1 3.62Å; I122-L126 HydrophobicContact CG2-CG 4.04Å; I122-L126 WeakPolarHBondContact O-CB 3.45Å; I122-L126 WeakPolarHBondContact O-CG 3.17Å; I122-L126 PolarHBondContact O-N 3.31Å
123	S	97.7	Very high	97.6	Very high	65 Å²	65	62.2 Å²	62.2	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-58.9	-30.1	-180	70.4	0	0	0	0	112.9	I118 S119 Y121 P127	I118-S123 WeakPolarHBondContact O-CB 3.25Å; I118-S123 PolarHBondContact O-N 3.21Å; I118-S123 PolarHBondContact O-OG 2.97Å; S119-S123 PolarHBondContact O-OG 2.96Å; Y121-S123 PolarHBondContact O-N 3.17Å; S123-P127 VanDerWaalsContact O-CD 3.27Å; S123-P127 WeakPolarHBondContact O-CD 3.4Å; S123-P127 WeakPolarHBondContact O-CG 3.1Å
124	K	98.4	Very high	97.6	Very high	112 Å²	112	58.3 Å²	58.3	49%	0.487	33%	0.332	S	S	.	.	H	α-helix	trans	-93.6	-33.5	-178.1	-58.8	-177.4	-169	171.1	0	112.7	L64 E120 Y121 I122 L128	L64-K124 HydrophobicContact CD1-CD 4.44Å; L64-K124 HydrophobicContact CD2-CB 3.67Å; E120-K124 WeakPolarHBondContact O-CD 3.39Å; Y121-K124 PolarHBondContact O-N 3.34Å; Y121-K124 VanDerWaalsContact O-N 3.1Å; I122-K124 PolarHBondContact O-N 3.09Å; K124-L128 WeakPolarHBondContact O-CG 3.12Å
125	A	98.1	Very high	97.7	Very high	3 Å²	3	58 Å²	58	3%	0.025	33%	0.329	C	S	.	.	H	α-helix	trans	-78.2	-41.4	-177.2	0	0	0	0	0	112.1	F61 L64 Y121 I122 L128	F61-A125 HydrophobicContact CD2-CB 4.47Å; F61-A125 HydrophobicContact CE2-CB 4.2Å; L64-A125 HydrophobicContact CD2-CB 3.87Å; Y121-A125 HydrophobicContact CD1-CB 4.26Å; Y121-A125 HydrophobicContact CD2-CB 4.34Å; Y121-A125 HydrophobicContact CE1-CB 4.01Å; Y121-A125 HydrophobicContact CE2-CB 4.05Å; Y121-A125 HydrophobicContact CG-CB 4.47Å; Y121-A125 VanDerWaalsContact O-CB 3.24Å; Y121-A125 WeakPolarHBondContact O-CB 3.48Å; Y121-A125 PolarHBondContact O-N 3.23Å; I122-A125 PolarHBondContact O-N 3.02Å; A125-L128 WeakPolarHBondContact O-CB 3.45Å; A125-L128 PolarHBondContact O-N 2.96Å
126	L	97.6	Very high	97.8	Very high	82 Å²	82	53.8 Å²	53.8	43%	0.429	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-56.7	-44.1	-176.7	-73.4	178.1	0	0	0	113.6	I122 L128 L129	I122-L126 HydrophobicContact CG2-CD1 3.62Å; I122-L126 HydrophobicContact CG2-CG 4.04Å; I122-L126 WeakPolarHBondContact O-CB 3.45Å; I122-L126 WeakPolarHBondContact O-CG 3.17Å; I122-L126 PolarHBondContact O-N 3.31Å; L126-L128 PolarHBondContact O-N 3.26Å; L126-L128 VanDerWaalsContact O-N 3.13Å; L126-L129 PolarHBondContact O-N 3Å; L126-L129 VanDerWaalsContact O-N 3.11Å
127	P	98.3	Very high	97.7	Very high	79 Å²	79	51.7 Å²	51.7	51%	0.513	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-64.5	-13.9	176.7	-23.2	35.3	0	0	0	115	R54 S123	R54-P127 WeakPolarHBondContact CD-O 3.34Å; R54-P127 PolarHBondContact NH1-O 3.34Å; S123-P127 VanDerWaalsContact O-CD 3.27Å; S123-P127 WeakPolarHBondContact O-CD 3.4Å; S123-P127 WeakPolarHBondContact O-CG 3.1Å
128	L	98.6	Very high	97.7	Very high	20 Å²	20	52.1 Å²	52.1	11%	0.105	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-87	-10.1	178.1	-47.3	179.4	0	0	0	111.9	I53 R54 Q57 F61 L64 K124 A125 L126	I53-L128 WeakPolarHBondContact CG2-O 3.35Å; R54-L128 WeakPolarHBondContact CB-O 3.24Å; R54-L128 PolarHBondContact N-O 3.2Å; Q57-L128 HydrophobicContact CB-CB 4.13Å; Q57-L128 HydrophobicContact CB-CD2 4.04Å; Q57-L128 HydrophobicContact CG-CD2 3.94Å; F61-L128 HydrophobicContact CB-CB 4.26Å; F61-L128 HydrophobicContact CB-CD1 3.88Å; F61-L128 HydrophobicContact CD2-CB 4.23Å; F61-L128 HydrophobicContact CD2-CD1 4.26Å; L64-L128 HydrophobicContact CD2-CD1 4.38Å; K124-L128 WeakPolarHBondContact O-CG 3.12Å; A125-L128 WeakPolarHBondContact O-CB 3.45Å; A125-L128 PolarHBondContact O-N 2.96Å; L126-L128 PolarHBondContact O-N 3.26Å; L126-L128 VanDerWaalsContact O-N 3.13Å
129	L	98.5	Very high	97.6	Very high	23 Å²	23	49.2 Å²	49.2	12%	0.12	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	147.6	-175.6	-57.2	-177.3	0	0	0	111.6	Y51 S52 I53 F61 L126 Q132	Y51-L129 HydrophobicContact CD2-CD1 3.79Å; Y51-L129 HydrophobicContact CE2-CD1 4.31Å; Y51-L129 HydrophobicContact CG-CD1 3.96Å; S52-L129 CarbonylContact O-C 3.52Å; S52-L129 WeakPolarHBondContact O-CA 3.3Å; I53-L129 HydrophobicContact CB-CD2 4.32Å; I53-L129 HydrophobicContact CG1-CD2 3.81Å; I53-L129 HydrophobicContact CG2-CD2 4.48Å; F61-L129 HydrophobicContact CD2-CD2 3.79Å; F61-L129 HydrophobicContact CD2-CG 4.49Å; F61-L129 HydrophobicContact CE2-CD1 4.35Å; F61-L129 HydrophobicContact CE2-CD2 3.62Å; F61-L129 HydrophobicContact CE2-CG 4.22Å; F61-L129 HydrophobicContact CG-CD2 4.46Å; F61-L129 HydrophobicContact CZ-CD2 4.18Å; L126-L129 PolarHBondContact O-N 3Å; L126-L129 VanDerWaalsContact O-N 3.11Å; L129-Q132 HydrophobicContact CD1-CG 3.8Å
130	T	98.3	Very high	97.3	Very high	96 Å²	96	46.2 Å²	46.2	59%	0.589	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	-28.7	170.5	56.3	0	0	0	0	112.3	S52 R54	S52-T130 VanDerWaalsContact CB-OG1 3.29Å; S52-T130 WeakPolarHBondContact CB-OG1 3.13Å; S52-T130 PolarHBondContact O-N 2.87Å; S52-T130 PolarHBondContact O-OG1 3.06Å; R54-T130 HydrophobicContact CB-CG2 4.43Å; R54-T130 HydrophobicContact CG-CG2 3.55Å
131	A	98.3	Very high	96.9	Very high	43 Å²	43	47.1 Å²	47.1	36%	0.355	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	157.2	178.5	0	0	0	0	0	112	S52	S52-A131 PolarHBondContact N-O 3.5Å; S52-A131 PolarHBondContact O-N 2.85Å
132	Q	98.1	Very high	96.5	Very high	82 Å²	82	49.7 Å²	49.7	38%	0.383	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	129.4	172.4	-62.3	177.8	56.5	0	0	109.3	Y51 L129	Y51-Q132 HydrophobicContact CD1-CB 3.79Å; Y51-Q132 HydrophobicContact CD1-CG 3.53Å; Y51-Q132 HydrophobicContact CE1-CB 3.91Å; Y51-Q132 HydrophobicContact CE1-CG 3.74Å; Y51-Q132 HydrophobicContact CG-CG 4.14Å; L129-Q132 HydrophobicContact CD1-CG 3.8Å
133	D	97.5	Very high	96.4	Very high	107 Å²	107	47.8 Å²	47.8	57%	0.572	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	147.9	171.4	-84.3	-65.5	0	0	0	110	R49 T50	R49-D133 VanDerWaalsContact CA-O 3.29Å; R49-D133 WeakPolarHBondContact CA-O 3.2Å; T50-D133 PolarHBondContact N-O 2.86Å; T50-D133 PolarHBondContact O-N 2.84Å
134	N	96.6	Very high	96.2	Very high	77 Å²	77	50.9 Å²	50.9	41%	0.412	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	141.7	169.5	74.6	-69.9	0	0	0	111.8	F48 R49	F48-N134 CarbonylContact O-C 3.58Å; F48-N134 VanDerWaalsContact O-CA 3.23Å; F48-N134 WeakPolarHBondContact O-CA 3.16Å; R49-N134 HydrophobicContact CG-CB 3.97Å
135	E	98	Very high	96.1	Very high	26 Å²	26	47.6 Å²	47.6	12%	0.121	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	144.8	174.4	-66.2	178.2	-140.8	0	0	108.3	E47 F48 L137 F197 R202 H204	E47-E135 WeakPolarHBondContact CA-O 3.28Å; F48-E135 HydrophobicContact CB-CB 4.35Å; F48-E135 PolarHBondContact N-O 2.99Å; F48-E135 PolarHBondContact O-N 2.92Å; E135-L137 HydrophobicContact CB-CD1 3.73Å; E135-L137 HydrophobicContact CB-CG 4.32Å; E135-L137 WeakPolarHBondContact O-CD1 3.49Å; E135-F197 WeakPolarHBondContact CA-O 3.44Å; E135-R202 IonicContact OE1-CZ 3.84Å; E135-R202 IonicContact OE1-NH1 3.98Å; E135-R202 PolarHBondContact OE1-NH1 3.02Å; E135-R202 VanDerWaalsContact OE2-CD 3.31Å; E135-R202 WeakPolarHBondContact OE2-CD 3.32Å; E135-R202 IonicContact OE2-NH1 3.69Å; E135-H204 IonicContact OE1-CE1 2.84Å; E135-H204 IonicContact OE1-NE2 2.84Å; E135-H204 IonicContact OE2-CD2 3.83Å; E135-H204 IonicContact OE2-CE1 3.87Å; E135-H204 IonicContact OE2-NE2 3.72Å; E135-H204 PolarHBondContact OE2-NE2 3.43Å
136	V	97.5	Very high	96.1	Very high	9 Å²	9	51.5 Å²	51.5	6%	0.055	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.9	169	174.7	0	0	0	0	107.7	F45 Y101 E196 F197	F45-V136 HydrophobicContact CB-CG1 4.25Å; F45-V136 HydrophobicContact CD2-CG1 3.46Å; F45-V136 VanDerWaalsContact CD2-CG1 3.46Å; F45-V136 HydrophobicContact CE2-CG1 3.93Å; F45-V136 HydrophobicContact CE2-CG2 4.4Å; F45-V136 HydrophobicContact CG-CG1 3.97Å; Y101-V136 HydrophobicContact CE1-CG1 3.98Å; Y101-V136 WeakPolarHBondContact OH-CG1 3.35Å; V136-E196 HydrophobicContact CG1-CB 4.4Å; V136-E196 PolarHBondContact O-N 2.85Å; V136-F197 HydrophobicContact CB-CB 3.96Å; V136-F197 HydrophobicContact CB-CD2 3.9Å; V136-F197 HydrophobicContact CB-CG 4.41Å; V136-F197 HydrophobicContact CG1-CD2 4.23Å; V136-F197 HydrophobicContact CG2-CB 4.26Å; V136-F197 HydrophobicContact CG2-CD2 4.25Å; V136-F197 PolarHBondContact N-O 2.93Å; V136-F197 PolarHBondContact O-N 3.23Å; V136-F197 VanDerWaalsContact O-N 3.07Å
137	L	96.8	Very high	96	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	158.9	-172.1	-50	94.7	0	0	0	110.7	F45 Y46 F48 E135 F193 H194 H204	F45-L137 CarbonylContact C-O 3.57Å; F45-L137 WeakPolarHBondContact CA-O 3.11Å; F45-L137 WeakPolarHBondContact CB-O 3.33Å; Y46-L137 PolarHBondContact N-O 2.86Å; Y46-L137 PolarHBondContact O-N 2.76Å; F48-L137 HydrophobicContact CB-CD1 3.59Å; F48-L137 HydrophobicContact CD1-CD1 3.61Å; F48-L137 HydrophobicContact CD2-CD1 3.91Å; F48-L137 HydrophobicContact CD2-CD2 4.14Å; F48-L137 HydrophobicContact CE1-CD1 4.25Å; F48-L137 HydrophobicContact CE2-CD2 4.22Å; F48-L137 HydrophobicContact CG-CD1 3.42Å; F48-L137 VanDerWaalsContact CG-CD1 3.42Å; F48-L137 HydrophobicContact CG-CD2 4.47Å; E135-L137 HydrophobicContact CB-CD1 3.73Å; E135-L137 HydrophobicContact CB-CG 4.32Å; E135-L137 WeakPolarHBondContact O-CD1 3.49Å; L137-F193 HydrophobicContact CB-CB 4.01Å; L137-F193 HydrophobicContact CD2-CB 3.85Å; L137-H194 WeakPolarHBondContact CA-O 3.25Å; L137-H194 WeakPolarHBondContact CB-O 3.38Å; L137-H204 WeakPolarHBondContact CD2-CD2 3.3Å
138	Y	95.4	Very high	95.9	Very high	22 Å²	22	49.6 Å²	49.6	9%	0.086	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	159.5	166.6	-65.3	-89.1	0	0	0	110.1	T44 F45 Y101 F193 H194 E196	T44-Y138 WeakPolarHBondContact O-CD1 3.2Å; F45-Y138 HydrophobicContact CB-CD1 3.77Å; F45-Y138 HydrophobicContact CB-CE1 3.56Å; F45-Y138 HydrophobicContact CB-CG 4.33Å; Y101-Y138 WeakPolarHBondContact CE2-OH 3.39Å; Y101-Y138 PolarHBondContact OH-OH 2.94Å; Y138-F193 CarbonylContact O-C 3.55Å; Y138-F193 WeakPolarHBondContact O-CA 3.09Å; Y138-H194 PolarHBondContact N-O 2.84Å; Y138-H194 PolarHBondContact O-CD2 2.86Å; Y138-H194 PolarHBondContact O-N 3.44Å; Y138-E196 HydrophobicContact CD2-CB 3.95Å; Y138-E196 HydrophobicContact CE2-CB 3.74Å; Y138-E196 HydrophobicContact CE2-CG 3.86Å
139	L	94.9	Very high	95.8	Very high	12 Å²	12	52.4 Å²	52.4	6%	0.063	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	142.4	167.4	-71.7	164.4	0	0	0	110.1	Y46 L145 A192 F193	Y46-L139 HydrophobicContact CD2-CG 4.36Å; Y46-L139 HydrophobicContact CE2-CD1 3.78Å; Y46-L139 HydrophobicContact CE2-CG 3.69Å; L139-L145 HydrophobicContact CD1-CB 4.4Å; L139-A192 WeakPolarHBondContact CA-O 3.42Å; L139-A192 WeakPolarHBondContact CD2-O 3.32Å; L139-F193 HydrophobicContact CD2-CD1 3.76Å; L139-F193 HydrophobicContact CD2-CE1 3.56Å; L139-F193 HydrophobicContact CD2-CE2 4.47Å; L139-F193 HydrophobicContact CD2-CG 4.32Å; L139-F193 HydrophobicContact CD2-CZ 3.96Å; L139-F193 HydrophobicContact CG-CD1 4.2Å; L139-F193 HydrophobicContact CG-CE1 4.13Å
140	V	92.2	Very high	95.6	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.006	30%	0.301	C	S	.	.			trans	-65.4	149.3	166.1	-60.4	0	0	0	0	109.2	W142 S143 W170 A192 H194	V140-W142 VanDerWaalsContact C-N 3.28Å; V140-W142 HydrophobicContact CG2-CD2 3.81Å; V140-W142 HydrophobicContact CG2-CE3 4.3Å; V140-W142 HydrophobicContact CG2-CG 4.36Å; V140-W142 HydrophobicContact CG2-CH2 4.04Å; V140-W142 HydrophobicContact CG2-CZ2 3.54Å; V140-W142 HydrophobicContact CG2-CZ3 4.39Å; V140-W142 PolarHBondContact O-N 2.81Å; V140-S143 WeakPolarHBondContact O-CB 3.36Å; V140-S143 PolarHBondContact O-N 2.76Å; V140-W170 HydrophobicContact CG1-CH2 4.17Å; V140-W170 HydrophobicContact CG1-CZ3 4.46Å; V140-A192 HydrophobicContact CG2-CB 3.69Å; V140-A192 PolarHBondContact N-O 2.82Å; V140-H194 HydrophobicContact CG1-CB 4.01Å
141	P	89.1	Confident	95.3	Very high	74 Å²	74	59.5 Å²	59.5	48%	0.481	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-36.4	-164.4	-30.5	36.1	0	0	0	116	R144	P141-R144 PolarHBondContact O-NH1 2.78Å
142	W	90.8	Very high	95	Very high	65 Å²	65	58.7 Å²	58.7	25%	0.246	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-9.9	-179.8	54.3	-103.6	0	0	0	113.9	V140 F174 Q175 M178 L189 A192	V140-W142 VanDerWaalsContact C-N 3.28Å; V140-W142 HydrophobicContact CG2-CD2 3.81Å; V140-W142 HydrophobicContact CG2-CE3 4.3Å; V140-W142 HydrophobicContact CG2-CG 4.36Å; V140-W142 HydrophobicContact CG2-CH2 4.04Å; V140-W142 HydrophobicContact CG2-CZ2 3.54Å; V140-W142 HydrophobicContact CG2-CZ3 4.39Å; V140-W142 PolarHBondContact O-N 2.81Å; W142-F174 HydrophobicContact CH2-CD1 4.45Å; W142-F174 HydrophobicContact CH2-CE1 4.29Å; W142-F174 AromaticContact CZ2-CD1 3.71Å; W142-F174 HydrophobicContact CZ2-CD1 3.71Å; W142-F174 AromaticContact CZ2-CE1 3.93Å; W142-F174 HydrophobicContact CZ2-CE1 3.93Å; W142-Q175 HydrophobicContact CB-CG 4.49Å; W142-Q175 HydrophobicContact CD2-CB 3.99Å; W142-Q175 HydrophobicContact CD2-CG 3.59Å; W142-Q175 HydrophobicContact CE3-CG 3.96Å; W142-Q175 HydrophobicContact CG-CB 4.24Å; W142-Q175 VanDerWaalsContact CG-CD 3.4Å; W142-Q175 HydrophobicContact CG-CG 3.83Å; W142-Q175 VanDerWaalsContact CG-OE1 3.25Å; W142-Q175 HydrophobicContact CZ2-CB 3.88Å; W142-Q175 HydrophobicContact CZ2-CG 4.2Å; W142-Q175 HydrophobicContact CZ3-CG 4.43Å; W142-M178 HydrophobicContact CH2-CB 4.02Å; W142-M178 HydrophobicContact CH2-CG 3.95Å; W142-L189 HydrophobicContact CH2-CD2 4.14Å; W142-L189 HydrophobicContact CZ3-CD2 3.82Å; W142-A192 HydrophobicContact CH2-CB 3.75Å; W142-A192 HydrophobicContact CZ2-CB 4.3Å; W142-A192 HydrophobicContact CZ3-CB 4.3Å
143	S	94.1	Very high	95	Very high	5 Å²	5	55.8 Å²	55.8	4%	0.035	30%	0.297	C	S	.	.			trans	-92.5	152.3	-177	-164	0	0	0	0	111.8	V140 A192	V140-S143 WeakPolarHBondContact O-CB 3.36Å; V140-S143 PolarHBondContact O-N 2.76Å; S143-A192 PolarHBondContact OG-N 3.38Å
144	R	94.1	Very high	95	Very high	131 Å²	131	51 Å²	51	49%	0.494	27%	0.272	S	S	.	.			trans	-137.3	143.1	172.3	-62.7	-65.5	-178.1	-87.9	-0.2	107.3	P141 K146 L190	P141-R144 PolarHBondContact O-NH1 2.78Å; R144-K146 PolarHBondContact O-N 2.87Å; R144-L190 VanDerWaalsContact O-O 3.11Å
145	L	96.2	Very high	95.1	Very high	42 Å²	42	47.3 Å²	47.3	22%	0.22	25%	0.252	C	S	.	.			trans	-71.4	126.7	173.4	-172.3	60.8	0	0	0	109.7	Y46 I79 L139 L190 F193 M255	Y46-L145 HydrophobicContact CE1-CD2 3.73Å; I79-L145 HydrophobicContact CD1-CD2 3.8Å; I79-L145 HydrophobicContact CG1-CD2 4.09Å; I79-L145 HydrophobicContact CG2-CD1 4.48Å; I79-L145 HydrophobicContact CG2-CD2 3.65Å; L139-L145 HydrophobicContact CD1-CB 4.4Å; L145-L190 CarbonylContact C-O 3.6Å; L145-L190 VanDerWaalsContact CA-O 3.27Å; L145-L190 WeakPolarHBondContact CA-O 3.3Å; L145-F193 HydrophobicContact CD1-CZ 3.95Å; L145-M255 HydrophobicContact CD1-CE 3.88Å; L145-M255 HydrophobicContact CD2-CE 4.24Å; L145-M255 HydrophobicContact CG-CE 3.99Å
146	K	96.6	Very high	95.2	Very high	85 Å²	85	46.2 Å²	46.2	37%	0.37	25%	0.247	S	C	.	.			trans	-118.6	150.3	-179.9	-56.1	174.3	-165.6	161	0	110.2	R144 D182 L190 M255	R144-K146 PolarHBondContact O-N 2.87Å; K146-D182 IonicContact NZ-OD2 2.86Å; K146-L190 HydrophobicContact CB-CD2 4.42Å; K146-L190 PolarHBondContact N-O 2.92Å; K146-M255 WeakPolarHBondContact O-CE 3.3Å
147	S	96.3	Very high	95.2	Very high	98 Å²	98	46 Å²	46	69%	0.685	25%	0.246	S	C	*	.			trans	-71.5	151.6	167.3	-58.7	0	0	0	0	110.9
148	P	96.8	Very high	95.3	Very high	23 Å²	23	46.6 Å²	46.6	15%	0.149	25%	0.249	C	C	.	.			trans	-52.6	147	167.4	-25.4	34.7	0	0	0	111.7	Q150 F155 L190 W208 M255	P148-Q150 PolarHBondContact O-N 2.85Å; P148-F155 HydrophobicContact CB-CZ 4.48Å; P148-F155 HydrophobicContact CG-CE1 3.96Å; P148-F155 HydrophobicContact CG-CZ 3.67Å; P148-L190 HydrophobicContact CG-CD1 4.19Å; P148-W208 HydrophobicContact CB-CG 4.26Å; P148-M255 HydrophobicContact CG-CB 4.18Å; P148-M255 HydrophobicContact CG-CG 4.34Å
149	P	95.3	Very high	95.4	Very high	80 Å²	80	46 Å²	46	52%	0.519	25%	0.248	S	C	.	.	S	Bend	trans	-62.5	-28.4	179.1	-23.6	34.8	0	0	0	114.3	K188 W208	P149-K188 HydrophobicContact CG-CB 4.19Å; P149-K188 HydrophobicContact CG-CD 4.28Å; P149-K188 HydrophobicContact CG-CG 3.88Å; P149-W208 HydrophobicContact CB-CZ3 4.38Å; P149-W208 HydrophobicContact CG-CD2 4.38Å; P149-W208 HydrophobicContact CG-CE3 3.81Å; P149-W208 HydrophobicContact CG-CZ3 3.9Å
150	Q	94	Very high	95.6	Very high	103 Å²	103	46.2 Å²	46.2	48%	0.481	25%	0.249	S	C	.	.	S	Bend	trans	-151.3	166.4	179.1	64	-173.8	29.1	0	0	110	P148 W208	P148-Q150 PolarHBondContact O-N 2.85Å; Q150-W208 HydrophobicContact CG-CH2 3.63Å; Q150-W208 HydrophobicContact CG-CZ2 3.49Å; Q150-W208 VanDerWaalsContact CG-CZ2 3.49Å
151	Q	92.8	Very high	95.9	Very high	164 Å²	164	47.9 Å²	47.9	77%	0.766	26%	0.256	S	S	*	.	S	Bend	trans	-66.5	148.2	170.7	-69.2	-173.7	4.3	0	0	111	K256	Q151-K256 WeakPolarHBondContact CA-O 3.41Å
152	G	92.9	Very high	96.2	Very high	27 Å²	27	44.4 Å²	44.4	28%	0.278	23%	0.234	S	C	.	.	S	Bend	trans	83.4	-152	-176.7	0	0	0	0	0	113	W208 K256	G152-W208 PolarHBondContact O-NE1 3.22Å; G152-K256 WeakPolarHBondContact CA-OXT 3.31Å; G152-K256 PolarHBondContact N-OXT 2.89Å
153	G	97	Very high	96.4	Very high	20 Å²	20	47.1 Å²	47.1	21%	0.206	24%	0.244	C	C	.	.			trans	81.1	-174.1	-175.8	0	0	0	0	0	114	F209 E210 P249	G153-F209 CarbonylContact C-O 3.59Å; G153-F209 WeakPolarHBondContact CA-O 3.4Å; G153-E210 WeakPolarHBondContact CA-O 3.42Å; G153-P249 WeakPolarHBondContact O-CD 3.3Å
154	V	98.3	Very high	96.3	Very high	6 Å²	6	51.5 Å²	51.5	4%	0.036	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	153.4	-179.7	-58.5	0	0	0	0	109.9	F209 S211 L246 F248	V154-F209 HydrophobicContact CG2-CB 3.94Å; V154-F209 PolarHBondContact N-O 3.1Å; V154-F209 PolarHBondContact O-N 2.96Å; V154-S211 VanDerWaalsContact CG2-C 3.41Å; V154-S211 WeakPolarHBondContact CG2-O 3.4Å; V154-L246 HydrophobicContact CB-CD1 4.26Å; V154-L246 HydrophobicContact CB-CG 4.45Å; V154-L246 HydrophobicContact CG2-CD1 3.93Å; V154-F248 HydrophobicContact CG1-CD1 3.95Å; V154-F248 HydrophobicContact CG1-CE1 3.52Å; V154-F248 HydrophobicContact CG1-CE2 4.48Å; V154-F248 HydrophobicContact CG1-CZ 3.82Å
155	F	98.7	Very high	95.9	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	144.8	-176.9	-66.2	-109.7	0	0	0	109.7	W82 P148 L190 L206 W207 W208 L246 M247 P249 M255	W82-F155 AromaticContact CD1-CD2 3.58Å; W82-F155 AromaticContact CD1-CG 3.77Å; W82-F155 AromaticContact CE2-CD1 3.95Å; W82-F155 AromaticContact CZ2-CD1 3.98Å; W82-F155 HydrophobicContact CZ2-CD1 3.98Å; W82-F155 AromaticContact CZ2-CE1 3.91Å; W82-F155 HydrophobicContact CZ2-CE1 3.91Å; W82-F155 HydrophobicContact CZ2-CZ 4.42Å; W82-F155 AromaticContact NE1-CD1 3.5Å; W82-F155 AromaticContact NE1-CD2 3.12Å; W82-F155 AromaticContact NE1-CE1 3.71Å; W82-F155 AromaticContact NE1-CE2 3.4Å; W82-F155 AromaticContact NE1-CG 3.17Å; W82-F155 AromaticContact NE1-CZ 3.67Å; P148-F155 HydrophobicContact CB-CZ 4.48Å; P148-F155 HydrophobicContact CG-CE1 3.96Å; P148-F155 HydrophobicContact CG-CZ 3.67Å; F155-L190 HydrophobicContact CD1-CD1 3.87Å; F155-L190 HydrophobicContact CE1-CD1 3.44Å; F155-L190 VanDerWaalsContact CE1-CD1 3.44Å; F155-L206 HydrophobicContact CB-CD1 4.37Å; F155-L206 HydrophobicContact CD1-CD1 4.21Å; F155-L206 HydrophobicContact CD1-CG 4.48Å; F155-W207 CarbonylContact C-O 3.54Å; F155-W207 WeakPolarHBondContact CA-O 3.26Å; F155-W208 AromaticContact CE1-CD1 3.96Å; F155-W208 AromaticContact CE2-CD1 3.81Å; F155-W208 AromaticContact CZ-CD1 3.65Å; F155-L246 CarbonylContact O-C 3.55Å; F155-L246 WeakPolarHBondContact O-CA 3.37Å; F155-M247 HydrophobicContact CB-CB 4.46Å; F155-M247 HydrophobicContact CB-CE 3.97Å; F155-M247 PolarHBondContact N-O 3.15Å; F155-M247 PolarHBondContact O-N 3.32Å; F155-P249 HydrophobicContact CD2-CB 4.47Å; F155-P249 HydrophobicContact CD2-CG 4.4Å; F155-P249 HydrophobicContact CE2-CB 3.96Å; F155-P249 HydrophobicContact CE2-CG 3.92Å; F155-M255 HydrophobicContact CE1-CB 4.36Å; F155-M255 HydrophobicContact CZ-CB 4.21Å
156	E	98.6	Very high	95.3	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.019	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	125.1	169.9	-175	178.2	-172.1	0	0	108.8	V158 W207 F209 R215 R219 N244 Q245 L246	E156-V158 HydrophobicContact CG-CG2 3.78Å; E156-W207 HydrophobicContact CB-CB 4.22Å; E156-W207 PolarHBondContact N-O 3.45Å; E156-W207 PolarHBondContact O-N 2.65Å; E156-F209 HydrophobicContact CB-CD2 4.45Å; E156-F209 HydrophobicContact CB-CE2 3.8Å; E156-R215 VanDerWaalsContact CD-NH2 3.28Å; E156-R215 IonicContact OE1-CZ 3.49Å; E156-R215 IonicContact OE1-NE 2.88Å; E156-R215 IonicContact OE1-NH2 3.23Å; E156-R215 PolarHBondContact OE1-NH2 2.8Å; E156-R215 IonicContact OE2-CZ 3.65Å; E156-R215 IonicContact OE2-NE 3.07Å; E156-R215 PolarHBondContact OE2-NE 2.82Å; E156-R215 IonicContact OE2-NH2 3.87Å; E156-R215 PolarHBondContact OE2-NH2 2.92Å; E156-R219 IonicContact OE1-NH1 3.62Å; E156-N244 HydrophobicContact CG-CB 4.17Å; E156-N244 VanDerWaalsContact OE1-CB 3.23Å; E156-N244 WeakPolarHBondContact OE1-CB 3.24Å; E156-N244 PolarHBondContact OE1-ND2 3.03Å; E156-Q245 VanDerWaalsContact CA-O 3.32Å; E156-Q245 WeakPolarHBondContact CA-O 3.47Å; E156-L246 HydrophobicContact CB-CD1 4.49Å
157	L	98.6	Very high	94.6	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	113.3	166.2	-169.5	73.1	0	0	0	108.1	F48 F93 H204 L206 N244 Q245 M247	F48-L157 HydrophobicContact CE2-CD1 4.05Å; F48-L157 HydrophobicContact CE2-CD2 4.46Å; F93-L157 HydrophobicContact CD2-CD2 4.49Å; F93-L157 HydrophobicContact CE1-CD2 4.17Å; F93-L157 HydrophobicContact CE2-CD2 3.93Å; F93-L157 HydrophobicContact CZ-CD1 4.43Å; F93-L157 HydrophobicContact CZ-CD2 3.77Å; L157-H204 HydrophobicContact CD1-CB 4.04Å; L157-L206 HydrophobicContact CD1-CB 4.25Å; L157-L206 HydrophobicContact CD1-CD1 4.14Å; L157-N244 CarbonylContact O-C 3.52Å; L157-N244 VanDerWaalsContact O-CA 3.3Å; L157-N244 WeakPolarHBondContact O-CA 3.43Å; L157-Q245 HydrophobicContact CB-CG 3.91Å; L157-Q245 PolarHBondContact N-O 2.95Å; L157-Q245 PolarHBondContact O-N 3.08Å; L157-M247 HydrophobicContact CB-CE 3.77Å; L157-M247 HydrophobicContact CB-SD 4.05Å
158	V	98.6	Very high	94.1	Very high	13 Å²	13	43 Å²	43	8%	0.079	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	121.8	173.2	-167.3	0	0	0	0	108.4	E156 F160 H204 A205 R243 N244	E156-V158 HydrophobicContact CG-CG2 3.78Å; V158-F160 HydrophobicContact CB-CE2 3.78Å; V158-F160 HydrophobicContact CB-CZ 3.92Å; V158-F160 HydrophobicContact CG1-CD2 4.28Å; V158-F160 HydrophobicContact CG1-CE1 3.83Å; V158-F160 HydrophobicContact CG1-CE2 3.55Å; V158-F160 HydrophobicContact CG1-CZ 3.3Å; V158-H204 CarbonylContact O-C 3.5Å; V158-H204 VanDerWaalsContact O-CA 3.28Å; V158-H204 WeakPolarHBondContact O-CA 3.35Å; V158-A205 PolarHBondContact N-O 2.98Å; V158-A205 PolarHBondContact O-N 2.86Å; V158-R243 CarbonylContact C-O 3.59Å; V158-R243 WeakPolarHBondContact CA-O 3.42Å; V158-N244 HydrophobicContact CG1-CB 4.38Å; V158-N244 HydrophobicContact CG2-CB 4.09Å
159	T	98.4	Very high	93.7	Very high	10 Å²	10	45.6 Å²	45.6	6%	0.061	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	126.8	176.6	-53.9	0	0	0	0	109.4	R202 V203 H204 Q242 R243	T159-R202 HydrophobicContact CG2-CG 3.48Å; T159-R202 VanDerWaalsContact CG2-CG 3.48Å; T159-V203 CarbonylContact C-O 3.56Å; T159-V203 WeakPolarHBondContact CA-O 3.45Å; T159-H204 PolarHBondContact OG1-CE1 2.88Å; T159-H204 VanDerWaalsContact OG1-CE1 3.27Å; T159-H204 PolarHBondContact OG1-ND1 2.97Å; T159-Q242 CarbonylContact O-C 3.59Å; T159-Q242 VanDerWaalsContact O-CA 3.25Å; T159-Q242 WeakPolarHBondContact O-CA 3.27Å; T159-R243 PolarHBondContact N-O 2.94Å; T159-R243 PolarHBondContact O-N 2.99Å
160	F	98.2	Very high	93.6	Very high	16 Å²	16	42.1 Å²	42.1	7%	0.07	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	129.4	178.3	-56.5	-88.2	0	0	0	109.1	V158 M162 F174 M178 R202 V203 A205 L239 Q242	V158-F160 HydrophobicContact CB-CE2 3.78Å; V158-F160 HydrophobicContact CB-CZ 3.92Å; V158-F160 HydrophobicContact CG1-CD2 4.28Å; V158-F160 HydrophobicContact CG1-CE1 3.83Å; V158-F160 HydrophobicContact CG1-CE2 3.55Å; V158-F160 HydrophobicContact CG1-CZ 3.3Å; F160-M162 HydrophobicContact CB-SD 3.77Å; F160-F174 HydrophobicContact CD1-CE2 4.38Å; F160-F174 AromaticContact CD2-CE2 3.71Å; F160-F174 HydrophobicContact CD2-CE2 3.71Å; F160-F174 AromaticContact CD2-CZ 3.93Å; F160-F174 HydrophobicContact CD2-CZ 3.93Å; F160-F174 HydrophobicContact CE1-CE2 4.34Å; F160-F174 AromaticContact CE2-CE2 3.67Å; F160-F174 HydrophobicContact CE2-CE2 3.67Å; F160-F174 AromaticContact CE2-CZ 3.87Å; F160-F174 HydrophobicContact CE2-CZ 3.87Å; F160-F174 HydrophobicContact CG-CE2 4.07Å; F160-F174 AromaticContact CZ-CE2 4Å; F160-F174 HydrophobicContact CZ-CE2 4Å; F160-M178 HydrophobicContact CZ-CE 4.08Å; F160-R202 CarbonylContact O-C 3.32Å; F160-R202 WeakPolarHBondContact O-CA 3.46Å; F160-V203 HydrophobicContact CB-CB 4.35Å; F160-V203 PolarHBondContact N-O 3.4Å; F160-V203 PolarHBondContact O-N 3.02Å; F160-A205 HydrophobicContact CE2-CB 3.95Å; F160-L239 HydrophobicContact CB-CD1 3.62Å; F160-L239 HydrophobicContact CD1-CD1 3.86Å; F160-L239 HydrophobicContact CD1-CD2 4.31Å; F160-L239 HydrophobicContact CG-CD1 4.23Å; F160-Q242 HydrophobicContact CD1-CB 3.91Å; F160-Q242 HydrophobicContact CE1-CB 4.34Å; F160-Q242 VanDerWaalsContact CE1-OE1 3.25Å
161	Q	97.9	Very high	93.5	Very high	36 Å²	36	37.5 Å²	37.5	17%	0.168	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	102.1	166.5	-174.6	58.8	48.3	0	0	108.2	L200 L239 D240 S241	Q161-L200 PolarHBondContact NE2-O 3.31Å; Q161-L239 WeakPolarHBondContact O-CD1 3.36Å; Q161-D240 HydrophobicContact CG-CB 4.39Å; Q161-D240 PolarHBondContact O-N 3.48Å; Q161-S241 WeakPolarHBondContact CB-OG 3.37Å; Q161-S241 PolarHBondContact N-O 2.85Å; Q161-S241 PolarHBondContact O-N 3.22Å
162	M	96.4	Very high	93.7	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	151.7	-179	-52.9	-56.6	-70.6	0	0	110.4	F160 W170 N201 V203 H238 L239	F160-M162 HydrophobicContact CB-SD 3.77Å; M162-W170 HydrophobicContact CB-CD2 4.44Å; M162-W170 HydrophobicContact CB-CG 4.29Å; M162-W170 HydrophobicContact CE-CB 3.5Å; M162-W170 HydrophobicContact CE-CD2 3.78Å; M162-W170 HydrophobicContact CE-CE3 4.03Å; M162-W170 HydrophobicContact CE-CG 3.53Å; M162-W170 HydrophobicContact CG-CD2 4.15Å; M162-W170 HydrophobicContact CG-CG 4.39Å; M162-N201 WeakPolarHBondContact CB-O 3.17Å; M162-N201 PolarHBondContact N-O 2.9Å; M162-N201 WeakPolarHBondContact O-CB 3.34Å; M162-V203 HydrophobicContact CG-CB 4.27Å; M162-V203 HydrophobicContact CG-CG2 3.62Å; M162-H238 HydrophobicContact CE-CB 4.17Å; M162-L239 HydrophobicContact SD-CD1 3.61Å
163	R	94.8	Very high	93.9	Very high	123 Å²	123	32.3 Å²	32.3	46%	0.464	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-64.4	145.8	168.6	-71.5	178.2	-176	171.3	2.8	110.4	A237 H238 D240	R163-A237 PolarHBondContact NH1-O 3Å; R163-H238 PolarHBondContact N-O 3.23Å; R163-D240 WeakPolarHBondContact CG-OD1 3.36Å; R163-D240 IonicContact NE-OD1 2.67Å; R163-D240 PolarHBondContact NE-OD1 3.18Å; R163-D240 VanDerWaalsContact NE-OD1 3.08Å
164	P	91.3	Very high	93.9	Very high	97 Å²	97	31.3 Å²	31.3	63%	0.63	21%	0.212	S	C	*	.	S	Bend	trans	-55.2	153.7	173.8	-25	34.3	0	0	0	113
165	G	85.7	Confident	93.9	Very high	49 Å²	49	34.7 Å²	34.7	51%	0.505	23%	0.227	S	C	.	.	S	Bend	trans	126.2	-12.1	-173.7	0	0	0	0	0	113.2	V169	G165-V169 WeakPolarHBondContact O-CG2 3.21Å
166	G	84	Confident	93.9	Very high	15 Å²	15	37 Å²	37	16%	0.155	25%	0.246	C	C	.	.			trans	71	-177.7	172.1	0	0	0	0	0	114.5	A168 V169 W170	G166-A168 PolarHBondContact O-N 2.71Å; G166-V169 PolarHBondContact O-N 2.93Å; G166-W170 PolarHBondContact O-N 3.02Å; G166-W170 PolarHBondContact O-NE1 3.04Å; G166-W170 VanDerWaalsContact O-NE1 3.13Å
167	P	82.9	Confident	93.8	Very high	24 Å²	24	36.9 Å²	36.9	16%	0.156	25%	0.246	C	C	.	.	H	α-helix	trans	-58.4	-21.8	-176.8	-24.3	33	0	0	0	114.4	V169 W170 G171	P167-V169 PolarHBondContact O-N 2.67Å; P167-W170 HydrophobicContact CB-CH2 4Å; P167-W170 HydrophobicContact CB-CZ2 4.1Å; P167-W170 HydrophobicContact CB-CZ3 4.44Å; P167-W170 HydrophobicContact CG-CH2 3.8Å; P167-W170 HydrophobicContact CG-CZ2 3.68Å; P167-G171 WeakPolarHBondContact O-CA 3.34Å; P167-G171 PolarHBondContact O-N 2.76Å
168	A	84.8	Confident	93.8	Very high	89 Å²	89	37.3 Å²	37.3	74%	0.736	25%	0.248	S	C	*	.	H	α-helix	trans	-63.6	-30.2	175	0	0	0	0	0	112.8	G166	G166-A168 PolarHBondContact O-N 2.71Å
169	V	88.8	Confident	93.8	Very high	78 Å²	78	39.3 Å²	39.3	47%	0.473	26%	0.263	S	S	.	.	H	α-helix	trans	-88.5	-49.8	-179	173.3	0	0	0	0	111.4	G165 G166 P167	G165-V169 WeakPolarHBondContact O-CG2 3.21Å; G166-V169 PolarHBondContact O-N 2.93Å; P167-V169 PolarHBondContact O-N 2.67Å
170	W	93.1	Very high	93.7	Very high	6 Å²	6	39.8 Å²	39.8	2%	0.023	27%	0.268	C	S	.	.	H	α-helix	trans	-104.3	-12.4	-172.1	54.5	-109.1	0	0	0	114.2	V140 M162 G166 P167 G172 A173 F174 V203 H238	V140-W170 HydrophobicContact CG1-CH2 4.17Å; V140-W170 HydrophobicContact CG1-CZ3 4.46Å; M162-W170 HydrophobicContact CB-CD2 4.44Å; M162-W170 HydrophobicContact CB-CG 4.29Å; M162-W170 HydrophobicContact CE-CB 3.5Å; M162-W170 HydrophobicContact CE-CD2 3.78Å; M162-W170 HydrophobicContact CE-CE3 4.03Å; M162-W170 HydrophobicContact CE-CG 3.53Å; M162-W170 HydrophobicContact CG-CD2 4.15Å; M162-W170 HydrophobicContact CG-CG 4.39Å; G166-W170 PolarHBondContact O-N 3.02Å; G166-W170 PolarHBondContact O-NE1 3.04Å; G166-W170 VanDerWaalsContact O-NE1 3.13Å; P167-W170 HydrophobicContact CB-CH2 4Å; P167-W170 HydrophobicContact CB-CZ2 4.1Å; P167-W170 HydrophobicContact CB-CZ3 4.44Å; P167-W170 HydrophobicContact CG-CH2 3.8Å; P167-W170 HydrophobicContact CG-CZ2 3.68Å; W170-G172 PolarHBondContact O-N 3.5Å; W170-A173 PolarHBondContact O-N 3.34Å; W170-F174 HydrophobicContact CE3-CB 3.87Å; W170-F174 HydrophobicContact CE3-CD1 4.38Å; W170-F174 HydrophobicContact CE3-CG 4.27Å; W170-F174 HydrophobicContact CZ3-CB 4.36Å; W170-F174 HydrophobicContact CZ3-CD1 4.05Å; W170-F174 HydrophobicContact CZ3-CG 4.39Å; W170-F174 VanDerWaalsContact O-CB 3.24Å; W170-F174 WeakPolarHBondContact O-CB 3.29Å; W170-F174 PolarHBondContact O-N 2.95Å; W170-V203 HydrophobicContact CH2-CG2 3.41Å; W170-V203 VanDerWaalsContact CH2-CG2 3.41Å; W170-V203 HydrophobicContact CZ2-CG2 3.69Å; W170-V203 HydrophobicContact CZ3-CG2 3.9Å; W170-H238 HydrophobicContact CB-CB 3.66Å
171	G	92.8	Very high	93.7	Very high	7 Å²	7	40.9 Å²	40.9	7%	0.072	27%	0.273	C	S	.	.	H	α-helix	trans	-63.1	-42.3	-167.1	0	0	0	0	0	114.2	P167 Q175	P167-G171 WeakPolarHBondContact O-CA 3.34Å; P167-G171 PolarHBondContact O-N 2.76Å; G171-Q175 VanDerWaalsContact O-CB 3.28Å; G171-Q175 WeakPolarHBondContact O-CB 3.36Å; G171-Q175 PolarHBondContact O-N 3.01Å
172	G	95.7	Very high	93.7	Very high	56 Å²	56	40.4 Å²	40.4	58%	0.577	27%	0.272	S	S	*	.	H	α-helix	trans	-66.1	-46.9	178.1	0	0	0	0	0	112.6	W170 Q175 A176	W170-G172 PolarHBondContact O-N 3.5Å; G172-Q175 PolarHBondContact O-N 2.94Å; G172-A176 WeakPolarHBondContact O-CB 3.43Å; G172-A176 PolarHBondContact O-N 2.87Å
173	A	97.1	Very high	93.6	Very high	25 Å²	25	44.6 Å²	44.6	21%	0.207	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-41.2	177.5	0	0	0	0	0	111.8	W170 A176 A177	W170-A173 PolarHBondContact O-N 3.34Å; A173-A176 PolarHBondContact O-N 2.96Å; A173-A177 PolarHBondContact O-N 3.07Å
174	F	97.6	Very high	93.6	Very high	0 Å²	0	41 Å²	41	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-65.2	-45.3	176.4	-176.5	-109.8	0	0	0	111.8	W142 F160 W170 A176 A177 M178 A192 V203 S235	W142-F174 HydrophobicContact CH2-CD1 4.45Å; W142-F174 HydrophobicContact CH2-CE1 4.29Å; W142-F174 AromaticContact CZ2-CD1 3.71Å; W142-F174 HydrophobicContact CZ2-CD1 3.71Å; W142-F174 AromaticContact CZ2-CE1 3.93Å; W142-F174 HydrophobicContact CZ2-CE1 3.93Å; F160-F174 HydrophobicContact CD1-CE2 4.38Å; F160-F174 AromaticContact CD2-CE2 3.71Å; F160-F174 HydrophobicContact CD2-CE2 3.71Å; F160-F174 AromaticContact CD2-CZ 3.93Å; F160-F174 HydrophobicContact CD2-CZ 3.93Å; F160-F174 HydrophobicContact CE1-CE2 4.34Å; F160-F174 AromaticContact CE2-CE2 3.67Å; F160-F174 HydrophobicContact CE2-CE2 3.67Å; F160-F174 AromaticContact CE2-CZ 3.87Å; F160-F174 HydrophobicContact CE2-CZ 3.87Å; F160-F174 HydrophobicContact CG-CE2 4.07Å; F160-F174 AromaticContact CZ-CE2 4Å; F160-F174 HydrophobicContact CZ-CE2 4Å; W170-F174 HydrophobicContact CE3-CB 3.87Å; W170-F174 HydrophobicContact CE3-CD1 4.38Å; W170-F174 HydrophobicContact CE3-CG 4.27Å; W170-F174 HydrophobicContact CZ3-CB 4.36Å; W170-F174 HydrophobicContact CZ3-CD1 4.05Å; W170-F174 HydrophobicContact CZ3-CG 4.39Å; W170-F174 VanDerWaalsContact O-CB 3.24Å; W170-F174 WeakPolarHBondContact O-CB 3.29Å; W170-F174 PolarHBondContact O-N 2.95Å; F174-A176 VanDerWaalsContact C-N 3.32Å; F174-A176 PolarHBondContact O-N 2.87Å; F174-A177 PolarHBondContact O-N 3.14Å; F174-M178 HydrophobicContact CD1-CG 4.27Å; F174-M178 HydrophobicContact CD2-CE 4.44Å; F174-M178 HydrophobicContact CD2-CG 4.49Å; F174-M178 HydrophobicContact CE1-CG 3.83Å; F174-M178 HydrophobicContact CE1-SD 4.29Å; F174-M178 HydrophobicContact CE2-CE 3.87Å; F174-M178 HydrophobicContact CE2-CG 4.11Å; F174-M178 HydrophobicContact CE2-SD 3.89Å; F174-M178 HydrophobicContact CZ-CE 4.24Å; F174-M178 HydrophobicContact CZ-CG 3.75Å; F174-M178 HydrophobicContact CZ-SD 3.62Å; F174-M178 WeakPolarHBondContact O-CG 3.23Å; F174-M178 PolarHBondContact O-N 3.44Å; F174-A192 HydrophobicContact CE1-CB 4.27Å; F174-V203 HydrophobicContact CD1-CG1 4.25Å; F174-V203 HydrophobicContact CE1-CG1 3.49Å; F174-V203 VanDerWaalsContact CE1-CG1 3.49Å; F174-V203 HydrophobicContact CE2-CG1 4.39Å; F174-V203 HydrophobicContact CZ-CG1 3.57Å; F174-S235 WeakPolarHBondContact CA-OG 3.23Å
175	Q	97.8	Very high	93.8	Very high	76 Å²	76	38.2 Å²	38.2	36%	0.355	29%	0.288	S	S	.	.	H	α-helix	trans	-56.2	-47.5	174.4	-174.3	177	-11.5	0	0	111.2	W142 G171 G172 A177 M178 S179	W142-Q175 HydrophobicContact CB-CG 4.49Å; W142-Q175 HydrophobicContact CD2-CB 3.99Å; W142-Q175 HydrophobicContact CD2-CG 3.59Å; W142-Q175 HydrophobicContact CE3-CG 3.96Å; W142-Q175 HydrophobicContact CG-CB 4.24Å; W142-Q175 VanDerWaalsContact CG-CD 3.4Å; W142-Q175 HydrophobicContact CG-CG 3.83Å; W142-Q175 VanDerWaalsContact CG-OE1 3.25Å; W142-Q175 HydrophobicContact CZ2-CB 3.88Å; W142-Q175 HydrophobicContact CZ2-CG 4.2Å; W142-Q175 HydrophobicContact CZ3-CG 4.43Å; G171-Q175 VanDerWaalsContact O-CB 3.28Å; G171-Q175 WeakPolarHBondContact O-CB 3.36Å; G171-Q175 PolarHBondContact O-N 3.01Å; G172-Q175 PolarHBondContact O-N 2.94Å; Q175-A177 VanDerWaalsContact C-N 3.31Å; Q175-A177 PolarHBondContact O-N 3.17Å; Q175-M178 PolarHBondContact O-N 3.13Å; Q175-S179 WeakPolarHBondContact O-CB 3.28Å; Q175-S179 PolarHBondContact O-N 3.15Å; Q175-S179 PolarHBondContact O-OG 2.98Å
176	A	98.1	Very high	94.4	Very high	49 Å²	49	37 Å²	37	41%	0.405	27%	0.268	S	S	.	.	H	α-helix	trans	-59	-42.8	178.5	0	0	0	0	0	111.9	G172 A173 F174 S179 A180	G172-A176 WeakPolarHBondContact O-CB 3.43Å; G172-A176 PolarHBondContact O-N 2.87Å; A173-A176 PolarHBondContact O-N 2.96Å; F174-A176 VanDerWaalsContact C-N 3.32Å; F174-A176 PolarHBondContact O-N 2.87Å; A176-S179 PolarHBondContact O-N 3.22Å; A176-A180 VanDerWaalsContact O-CB 3.29Å; A176-A180 WeakPolarHBondContact O-CB 3.46Å; A176-A180 PolarHBondContact O-N 3.09Å
177	A	98.1	Very high	95	Very high	2 Å²	2	36.6 Å²	36.6	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-43.2	176.8	0	0	0	0	0	112.5	A173 F174 Q175 H181 A231 V232	A173-A177 PolarHBondContact O-N 3.07Å; F174-A177 PolarHBondContact O-N 3.14Å; Q175-A177 VanDerWaalsContact C-N 3.31Å; Q175-A177 PolarHBondContact O-N 3.17Å; A177-H181 PolarHBondContact O-N 2.96Å; A177-H181 PolarHBondContact O-ND1 3.42Å; A177-A231 HydrophobicContact CB-CB 4.5Å; A177-V232 HydrophobicContact CB-CG2 4.4Å
178	M	98.1	Very high	95.7	Very high	11 Å²	11	38.9 Å²	38.9	5%	0.054	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-44.4	177.1	-59.6	-64.2	91.5	0	0	111.4	W142 F160 F174 Q175 A180 H181 D182 L189 A205 W207	W142-M178 HydrophobicContact CH2-CB 4.02Å; W142-M178 HydrophobicContact CH2-CG 3.95Å; F160-M178 HydrophobicContact CZ-CE 4.08Å; F174-M178 HydrophobicContact CD1-CG 4.27Å; F174-M178 HydrophobicContact CD2-CE 4.44Å; F174-M178 HydrophobicContact CD2-CG 4.49Å; F174-M178 HydrophobicContact CE1-CG 3.83Å; F174-M178 HydrophobicContact CE1-SD 4.29Å; F174-M178 HydrophobicContact CE2-CE 3.87Å; F174-M178 HydrophobicContact CE2-CG 4.11Å; F174-M178 HydrophobicContact CE2-SD 3.89Å; F174-M178 HydrophobicContact CZ-CE 4.24Å; F174-M178 HydrophobicContact CZ-CG 3.75Å; F174-M178 HydrophobicContact CZ-SD 3.62Å; F174-M178 WeakPolarHBondContact O-CG 3.23Å; F174-M178 PolarHBondContact O-N 3.44Å; Q175-M178 PolarHBondContact O-N 3.13Å; M178-A180 VanDerWaalsContact C-N 3.34Å; M178-A180 PolarHBondContact O-N 3.37Å; M178-H181 PolarHBondContact O-N 3.05Å; M178-H181 VanDerWaalsContact O-N 3.15Å; M178-D182 PolarHBondContact O-N 3.41Å; M178-L189 HydrophobicContact CB-CD2 4.07Å; M178-A205 HydrophobicContact SD-CB 3.79Å; M178-W207 HydrophobicContact CB-CZ2 4.37Å; M178-W207 HydrophobicContact CE-CZ2 4.26Å; M178-W207 WeakPolarHBondContact O-CH2 3.36Å; M178-W207 HydrophobicContact SD-CZ2 3.56Å; M178-W207 VanDerWaalsContact SD-CZ2 3.56Å
179	S	97.6	Very high	96.4	Very high	55 Å²	55	35 Å²	35	39%	0.385	24%	0.239	S	C	.	.	H	α-helix	trans	-64.7	-35.7	177.9	-65.5	0	0	0	0	113	Q175 A176 H181 D182 A183	Q175-S179 WeakPolarHBondContact O-CB 3.28Å; Q175-S179 PolarHBondContact O-N 3.15Å; Q175-S179 PolarHBondContact O-OG 2.98Å; A176-S179 PolarHBondContact O-N 3.22Å; S179-H181 PolarHBondContact O-N 2.85Å; S179-D182 PolarHBondContact O-N 3.46Å; S179-A183 VanDerWaalsContact O-CB 3.3Å; S179-A183 WeakPolarHBondContact O-CB 3.18Å; S179-A183 PolarHBondContact O-N 3.1Å
180	A	97.9	Very high	96.8	Very high	20 Å²	20	31.3 Å²	31.3	17%	0.165	22%	0.216	C	C	.	.	H	α-helix	trans	-64	-26.3	175.6	0	0	0	0	0	112.7	A176 M178 P184 V228 A231	A176-A180 VanDerWaalsContact O-CB 3.29Å; A176-A180 WeakPolarHBondContact O-CB 3.46Å; A176-A180 PolarHBondContact O-N 3.09Å; M178-A180 VanDerWaalsContact C-N 3.34Å; M178-A180 PolarHBondContact O-N 3.37Å; A180-P184 WeakPolarHBondContact O-CD 3.25Å; A180-P184 VanDerWaalsContact O-CG 3.29Å; A180-P184 WeakPolarHBondContact O-CG 3.25Å; A180-V228 HydrophobicContact CB-CG2 4.2Å; A180-V228 VanDerWaalsContact O-CG2 3.31Å; A180-V228 WeakPolarHBondContact O-CG2 3.47Å; A180-A231 HydrophobicContact CB-CB 3.9Å
181	H	97.9	Very high	97.1	Very high	39 Å²	39	31 Å²	31	18%	0.181	22%	0.215	C	C	.	.	H	α-helix	trans	-83.3	-47.9	171.9	-70.6	85.8	0	0	0	112.5	A177 M178 S179 Y186 W207 V228	A177-H181 PolarHBondContact O-N 2.96Å; A177-H181 PolarHBondContact O-ND1 3.42Å; M178-H181 PolarHBondContact O-N 3.05Å; M178-H181 VanDerWaalsContact O-N 3.15Å; S179-H181 PolarHBondContact O-N 2.85Å; H181-Y186 WeakPolarHBondContact O-CB 3.44Å; H181-Y186 PolarHBondContact O-N 2.79Å; H181-W207 HydrophobicContact CB-CH2 3.61Å; H181-W207 HydrophobicContact CB-CZ2 4.33Å; H181-W207 HydrophobicContact CB-CZ3 4.1Å; H181-V228 VanDerWaalsContact CE1-CG1 3.4Å; H181-V228 WeakPolarHBondContact CE1-CG1 3.13Å; H181-V228 WeakPolarHBondContact NE2-CG1 3.09Å
182	D	97	Very high	97.3	Very high	26 Å²	26	30.7 Å²	30.7	14%	0.139	21%	0.212	C	C	.	.	H	α-helix	trans	-66.8	-47.7	-175.4	-173	7.9	0	0	0	111.8	K146 M178 S179 G185 G187 K188 L189 W207	K146-D182 IonicContact NZ-OD2 2.86Å; M178-D182 PolarHBondContact O-N 3.41Å; S179-D182 PolarHBondContact O-N 3.46Å; D182-G185 PolarHBondContact O-N 3.19Å; D182-G187 WeakPolarHBondContact CA-O 3.43Å; D182-K188 IonicContact OD1-NZ 3.8Å; D182-K188 PolarHBondContact OD1-NZ 2.85Å; D182-K188 IonicContact OD2-NZ 3.75Å; D182-L189 HydrophobicContact CB-CB 4.23Å; D182-W207 HydrophobicContact CB-CH2 4.33Å; D182-W207 HydrophobicContact CB-CZ3 4.09Å
183	A	95.6	Very high	97.4	Very high	90 Å²	90	28 Å²	28	74%	0.744	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-40.9	-170.3	0	0	0	0	0	114.7	S179 G185	S179-A183 VanDerWaalsContact O-CB 3.3Å; S179-A183 WeakPolarHBondContact O-CB 3.18Å; S179-A183 PolarHBondContact O-N 3.1Å; A183-G185 VanDerWaalsContact C-N 3.27Å; A183-G185 PolarHBondContact O-N 3.28Å
184	P	94.5	Very high	97.3	Very high	47 Å²	47	27.5 Å²	27.5	31%	0.305	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-2.5	175.2	-15.1	33	0	0	0	114.4	A180 Y186	A180-P184 WeakPolarHBondContact O-CD 3.25Å; A180-P184 VanDerWaalsContact O-CG 3.29Å; A180-P184 WeakPolarHBondContact O-CG 3.25Å; P184-Y186 HydrophobicContact CB-CD2 4.08Å; P184-Y186 HydrophobicContact CB-CE2 3.8Å; P184-Y186 HydrophobicContact CG-CD2 4.25Å; P184-Y186 HydrophobicContact CG-CE2 4.04Å
185	G	95.4	Very high	97.1	Very high	39 Å²	39	27.8 Å²	27.8	40%	0.402	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.6	27.7	-179.2	0	0	0	0	0	115	D182 A183 G187	D182-G185 PolarHBondContact O-N 3.19Å; A183-G185 VanDerWaalsContact C-N 3.27Å; A183-G185 PolarHBondContact O-N 3.28Å; G185-G187 PolarHBondContact O-N 3.35Å; G185-G187 VanDerWaalsContact O-N 3.1Å
186	Y	97.4	Very high	96.9	Very high	22 Å²	22	25.4 Å²	25.4	9%	0.086	17%	0.168	C	C	.	.	S	Bend	trans	-79.9	24.4	173.2	-58.4	-51.3	0	0	0	113.4	H181 P184 F209 C218 R221 A222 D225 V228	H181-Y186 WeakPolarHBondContact O-CB 3.44Å; H181-Y186 PolarHBondContact O-N 2.79Å; P184-Y186 HydrophobicContact CB-CD2 4.08Å; P184-Y186 HydrophobicContact CB-CE2 3.8Å; P184-Y186 HydrophobicContact CG-CD2 4.25Å; P184-Y186 HydrophobicContact CG-CE2 4.04Å; Y186-F209 WeakPolarHBondContact O-CE1 3.37Å; Y186-C218 WeakPolarHBondContact CD1-O 3.33Å; Y186-R221 HydrophobicContact CD1-CB 4.14Å; Y186-R221 HydrophobicContact CE1-CB 3.56Å; Y186-A222 HydrophobicContact CD1-CB 4.18Å; Y186-A222 HydrophobicContact CD2-CB 3.79Å; Y186-A222 HydrophobicContact CE2-CB 4.25Å; Y186-A222 HydrophobicContact CG-CB 3.76Å; Y186-D225 HydrophobicContact CE2-CB 4Å; Y186-D225 WeakPolarHBondContact CE2-OD2 3.23Å; Y186-D225 PolarHBondContact OH-OD2 3.43Å; Y186-V228 HydrophobicContact CD2-CG2 3.86Å; Y186-V228 HydrophobicContact CE2-CG2 3.71Å
187	G	97.1	Very high	96.8	Very high	7 Å²	7	28 Å²	28	7%	0.072	17%	0.171	C	C	.	.	S	Bend	trans	128.4	154	-172.4	0	0	0	0	0	111.1	D182 G185 F209	D182-G187 WeakPolarHBondContact CA-O 3.43Å; G185-G187 PolarHBondContact O-N 3.35Å; G185-G187 VanDerWaalsContact O-N 3.1Å; G187-F209 VanDerWaalsContact CA-CE1 3.42Å
188	K	98.2	Very high	96.7	Very high	72 Å²	72	30.3 Å²	30.3	31%	0.313	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.1	177.9	-170.3	75.1	-161.2	152	0	110.9	P149 D182 L190 W207 W208	P149-K188 HydrophobicContact CG-CB 4.19Å; P149-K188 HydrophobicContact CG-CD 4.28Å; P149-K188 HydrophobicContact CG-CG 3.88Å; D182-K188 IonicContact OD1-NZ 3.8Å; D182-K188 PolarHBondContact OD1-NZ 2.85Å; D182-K188 IonicContact OD2-NZ 3.75Å; K188-L190 HydrophobicContact CG-CD2 4.04Å; K188-L190 PolarHBondContact O-N 2.8Å; K188-W207 VanDerWaalsContact C-CE3 3.46Å; K188-W207 CarbonylContact O-C 3.53Å; K188-W207 VanDerWaalsContact O-CA 3.31Å; K188-W207 WeakPolarHBondContact O-CA 3.4Å; K188-W208 HydrophobicContact CB-CB 4.37Å; K188-W208 HydrophobicContact CB-CE3 4.23Å; K188-W208 PolarHBondContact N-O 2.93Å; K188-W208 PolarHBondContact O-N 3.28Å
189	L	98.6	Very high	96.5	Very high	8 Å²	8	34 Å²	34	4%	0.042	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	116.2	173.3	-176.3	71.2	0	0	0	109.7	W142 M178 D182 A205 W207	W142-L189 HydrophobicContact CH2-CD2 4.14Å; W142-L189 HydrophobicContact CZ3-CD2 3.82Å; M178-L189 HydrophobicContact CB-CD2 4.07Å; D182-L189 HydrophobicContact CB-CB 4.23Å; L189-A205 HydrophobicContact CD1-CB 3.99Å; L189-W207 HydrophobicContact CB-CD2 4.44Å; L189-W207 HydrophobicContact CB-CE3 3.99Å; L189-W207 HydrophobicContact CB-CH2 3.83Å; L189-W207 HydrophobicContact CB-CZ2 4.33Å; L189-W207 HydrophobicContact CB-CZ3 3.66Å; L189-W207 HydrophobicContact CD1-CD2 4.06Å; L189-W207 HydrophobicContact CD1-CE3 4.45Å; L189-W207 HydrophobicContact CD1-CH2 4.17Å; L189-W207 HydrophobicContact CD1-CZ2 3.78Å; L189-W207 HydrophobicContact CG-CH2 4.48Å
190	L	98.4	Very high	96.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-29.8	177.7	-59.8	-170	0	0	0	112.9	R144 L145 K146 P148 F155 K188 L206 W208	R144-L190 VanDerWaalsContact O-O 3.11Å; L145-L190 CarbonylContact C-O 3.6Å; L145-L190 VanDerWaalsContact CA-O 3.27Å; L145-L190 WeakPolarHBondContact CA-O 3.3Å; K146-L190 HydrophobicContact CB-CD2 4.42Å; K146-L190 PolarHBondContact N-O 2.92Å; P148-L190 HydrophobicContact CG-CD1 4.19Å; F155-L190 HydrophobicContact CD1-CD1 3.87Å; F155-L190 HydrophobicContact CE1-CD1 3.44Å; F155-L190 VanDerWaalsContact CE1-CD1 3.44Å; K188-L190 HydrophobicContact CG-CD2 4.04Å; K188-L190 PolarHBondContact O-N 2.8Å; L190-L206 HydrophobicContact CB-CD2 4.33Å; L190-L206 HydrophobicContact CB-CG 4.31Å; L190-L206 HydrophobicContact CD1-CD2 4.41Å; L190-L206 HydrophobicContact CD1-CG 4.48Å; L190-L206 PolarHBondContact N-O 2.98Å; L190-W208 HydrophobicContact CD1-CB 3.87Å; L190-W208 HydrophobicContact CD2-CB 4.16Å; L190-W208 HydrophobicContact CG-CB 3.99Å
191	G	98.2	Very high	96.1	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-177.2	149.4	177.5	0	0	0	0	0	111.9	L206	G191-L206 PolarHBondContact N-O 3.44Å; G191-L206 PolarHBondContact O-N 3.45Å
192	A	97.8	Very high	96.1	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	127.2	172.3	0	0	0	0	0	109.4	L139 V140 W142 S143 F174 H204	L139-A192 WeakPolarHBondContact CA-O 3.42Å; L139-A192 WeakPolarHBondContact CD2-O 3.32Å; V140-A192 HydrophobicContact CG2-CB 3.69Å; V140-A192 PolarHBondContact N-O 2.82Å; W142-A192 HydrophobicContact CH2-CB 3.75Å; W142-A192 HydrophobicContact CZ2-CB 4.3Å; W142-A192 HydrophobicContact CZ3-CB 4.3Å; S143-A192 PolarHBondContact OG-N 3.38Å; F174-A192 HydrophobicContact CE1-CB 4.27Å; A192-H204 CarbonylContact C-O 3.52Å; A192-H204 VanDerWaalsContact CA-O 3.26Å; A192-H204 WeakPolarHBondContact CA-O 3.15Å
193	F	96.9	Very high	96.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	144.5	-168.2	-51.9	-99.1	0	0	0	109.9	Y46 F48 L137 Y138 L139 L145 V203 H204 L206	Y46-F193 HydrophobicContact CD1-CE1 4.13Å; Y46-F193 AromaticContact CD2-CD1 3.85Å; Y46-F193 HydrophobicContact CD2-CD1 3.85Å; Y46-F193 AromaticContact CD2-CE1 3.69Å; Y46-F193 HydrophobicContact CD2-CE1 3.69Å; Y46-F193 HydrophobicContact CE1-CE1 4.48Å; Y46-F193 HydrophobicContact CE2-CD1 4.48Å; Y46-F193 HydrophobicContact CE2-CE1 4.08Å; Y46-F193 HydrophobicContact CG-CD1 4.09Å; Y46-F193 AromaticContact CG-CE1 3.72Å; Y46-F193 HydrophobicContact CG-CE1 3.72Å; F48-F193 HydrophobicContact CE1-CD1 4.16Å; F48-F193 HydrophobicContact CE1-CD2 4.35Å; F48-F193 HydrophobicContact CE1-CE1 4.19Å; F48-F193 HydrophobicContact CE1-CE2 4.39Å; F48-F193 HydrophobicContact CE1-CG 4.23Å; F48-F193 HydrophobicContact CE1-CZ 4.29Å; F48-F193 HydrophobicContact CE2-CD2 4.42Å; F48-F193 HydrophobicContact CZ-CB 4.33Å; F48-F193 HydrophobicContact CZ-CD1 4.16Å; F48-F193 AromaticContact CZ-CD2 3.58Å; F48-F193 HydrophobicContact CZ-CD2 3.58Å; F48-F193 HydrophobicContact CZ-CE1 4.34Å; F48-F193 AromaticContact CZ-CE2 3.79Å; F48-F193 HydrophobicContact CZ-CE2 3.79Å; F48-F193 AromaticContact CZ-CG 3.77Å; F48-F193 HydrophobicContact CZ-CG 3.77Å; F48-F193 HydrophobicContact CZ-CZ 4.15Å; L137-F193 HydrophobicContact CB-CB 4.01Å; L137-F193 HydrophobicContact CD2-CB 3.85Å; Y138-F193 CarbonylContact O-C 3.55Å; Y138-F193 WeakPolarHBondContact O-CA 3.09Å; L139-F193 HydrophobicContact CD2-CD1 3.76Å; L139-F193 HydrophobicContact CD2-CE1 3.56Å; L139-F193 HydrophobicContact CD2-CE2 4.47Å; L139-F193 HydrophobicContact CD2-CG 4.32Å; L139-F193 HydrophobicContact CD2-CZ 3.96Å; L139-F193 HydrophobicContact CG-CD1 4.2Å; L139-F193 HydrophobicContact CG-CE1 4.13Å; L145-F193 HydrophobicContact CD1-CZ 3.95Å; F193-V203 CarbonylContact O-C 3.41Å; F193-V203 WeakPolarHBondContact O-CA 3.22Å; F193-V203 WeakPolarHBondContact O-CG1 3.46Å; F193-H204 PolarHBondContact N-O 3.41Å; F193-H204 PolarHBondContact O-N 3.35Å; F193-L206 HydrophobicContact CE2-CB 4.29Å
194	H	94.4	Very high	96.2	Very high	15 Å²	15	32.3 Å²	32.3	7%	0.069	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	143.8	172.1	77.2	101.3	0	0	0	110.6	Q40 L137 Y138 V140 R202 V203	Q40-H194 PolarHBondContact NE2-NE2 3.45Å; L137-H194 WeakPolarHBondContact CA-O 3.25Å; L137-H194 WeakPolarHBondContact CB-O 3.38Å; Y138-H194 PolarHBondContact N-O 2.84Å; Y138-H194 PolarHBondContact O-CD2 2.86Å; Y138-H194 PolarHBondContact O-N 3.44Å; V140-H194 HydrophobicContact CG1-CB 4.01Å; H194-R202 WeakPolarHBondContact CA-O 3.43Å; H194-V203 HydrophobicContact CB-CG2 4.23Å
195	S	94.9	Very high	96.4	Very high	6 Å²	6	30 Å²	30	4%	0.042	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	129.6	-174.4	59.5	0	0	0	0	112.5	L199 R202	S195-L199 WeakPolarHBondContact CB-O 3.35Å; S195-L199 PolarHBondContact OG-O 3.46Å; S195-R202 PolarHBondContact N-O 3.44Å; S195-R202 PolarHBondContact OG-N 3.01Å; S195-R202 PolarHBondContact OG-O 2.88Å
196	E	94	Very high	96.6	Very high	25 Å²	25	28.2 Å²	28.2	12%	0.117	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-46.9	164	179.2	62.9	-160.7	0	0	110.8	V136 Y138 L200	V136-E196 HydrophobicContact CG1-CB 4.4Å; V136-E196 PolarHBondContact O-N 2.85Å; Y138-E196 HydrophobicContact CD2-CB 3.95Å; Y138-E196 HydrophobicContact CE2-CB 3.74Å; Y138-E196 HydrophobicContact CE2-CG 3.86Å; E196-L200 WeakPolarHBondContact O-CD2 3.35Å
197	F	94.9	Very high	96.7	Very high	103 Å²	103	27.8 Å²	27.8	45%	0.452	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	143.1	174	-65.5	-85.8	0	0	0	111.1	Y101 E135 V136	Y101-F197 HydrophobicContact CE1-CD2 4.45Å; Y101-F197 HydrophobicContact CE1-CE2 4.1Å; Y101-F197 AromaticContact CZ-CE2 3.89Å; Y101-F197 WeakPolarHBondContact OH-CE2 3.47Å; E135-F197 WeakPolarHBondContact CA-O 3.44Å; V136-F197 HydrophobicContact CB-CB 3.96Å; V136-F197 HydrophobicContact CB-CD2 3.9Å; V136-F197 HydrophobicContact CB-CG 4.41Å; V136-F197 HydrophobicContact CG1-CD2 4.23Å; V136-F197 HydrophobicContact CG2-CB 4.26Å; V136-F197 HydrophobicContact CG2-CD2 4.25Å; V136-F197 PolarHBondContact N-O 2.93Å; V136-F197 PolarHBondContact O-N 3.23Å; V136-F197 VanDerWaalsContact O-N 3.07Å
198	G	94.9	Very high	96.7	Very high	51 Å²	51	28 Å²	28	53%	0.526	15%	0.147	S	C	.	.	S	Bend	trans	115.9	-145.8	-170.3	0	0	0	0	0	110	L200	G198-L200 PolarHBondContact O-N 2.84Å
199	L	94.3	Very high	96.8	Very high	90 Å²	90	24.8 Å²	24.8	47%	0.471	13%	0.133	S	C	.	.	S	Bend	trans	-76.4	120.3	171.7	-171.6	66	0	0	0	109.5	S195 R202	S195-L199 WeakPolarHBondContact CB-O 3.35Å; S195-L199 PolarHBondContact OG-O 3.46Å; L199-R202 VanDerWaalsContact CB-NH2 3.3Å; L199-R202 WeakPolarHBondContact O-CB 3.26Å
200	L	93.9	Very high	96.7	Very high	100 Å²	100	29.6 Å²	29.6	52%	0.524	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	160.9	-177.8	-61	-179.1	0	0	0	113.1	Q161 E196 G198 R202	Q161-L200 PolarHBondContact NE2-O 3.31Å; E196-L200 WeakPolarHBondContact O-CD2 3.35Å; G198-L200 PolarHBondContact O-N 2.84Å; L200-R202 PolarHBondContact O-N 3.21Å
201	N	94.6	Very high	96.7	Very high	53 Å²	53	31.7 Å²	31.7	28%	0.283	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	23.4	-174.2	-48.8	-70.1	0	0	0	113.3	M162	M162-N201 WeakPolarHBondContact CB-O 3.17Å; M162-N201 PolarHBondContact N-O 2.9Å; M162-N201 WeakPolarHBondContact O-CB 3.34Å
202	R	96.8	Very high	96.7	Very high	36 Å²	36	33.2 Å²	33.2	14%	0.136	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132.5	177	-174.7	178.6	-73.3	-169.1	1.6	109.7	E135 T159 F160 H194 S195 L199 L200 H204	E135-R202 IonicContact OE1-CZ 3.84Å; E135-R202 IonicContact OE1-NH1 3.98Å; E135-R202 PolarHBondContact OE1-NH1 3.02Å; E135-R202 VanDerWaalsContact OE2-CD 3.31Å; E135-R202 WeakPolarHBondContact OE2-CD 3.32Å; E135-R202 IonicContact OE2-NH1 3.69Å; T159-R202 HydrophobicContact CG2-CG 3.48Å; T159-R202 VanDerWaalsContact CG2-CG 3.48Å; F160-R202 CarbonylContact O-C 3.32Å; F160-R202 WeakPolarHBondContact O-CA 3.46Å; H194-R202 WeakPolarHBondContact CA-O 3.43Å; S195-R202 PolarHBondContact N-O 3.44Å; S195-R202 PolarHBondContact OG-N 3.01Å; S195-R202 PolarHBondContact OG-O 2.88Å; L199-R202 VanDerWaalsContact CB-NH2 3.3Å; L199-R202 WeakPolarHBondContact O-CB 3.26Å; L200-R202 PolarHBondContact O-N 3.21Å; R202-H204 VanDerWaalsContact CD-NE2 3.27Å; R202-H204 WeakPolarHBondContact CD-NE2 3.42Å
203	V	97.5	Very high	96.7	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	134.9	174.5	-178.2	0	0	0	0	108.7	T159 F160 M162 W170 F174 F193 H194	T159-V203 CarbonylContact C-O 3.56Å; T159-V203 WeakPolarHBondContact CA-O 3.45Å; F160-V203 HydrophobicContact CB-CB 4.35Å; F160-V203 PolarHBondContact N-O 3.4Å; F160-V203 PolarHBondContact O-N 3.02Å; M162-V203 HydrophobicContact CG-CB 4.27Å; M162-V203 HydrophobicContact CG-CG2 3.62Å; W170-V203 HydrophobicContact CH2-CG2 3.41Å; W170-V203 VanDerWaalsContact CH2-CG2 3.41Å; W170-V203 HydrophobicContact CZ2-CG2 3.69Å; W170-V203 HydrophobicContact CZ3-CG2 3.9Å; F174-V203 HydrophobicContact CD1-CG1 4.25Å; F174-V203 HydrophobicContact CE1-CG1 3.49Å; F174-V203 VanDerWaalsContact CE1-CG1 3.49Å; F174-V203 HydrophobicContact CE2-CG1 4.39Å; F174-V203 HydrophobicContact CZ-CG1 3.57Å; F193-V203 CarbonylContact O-C 3.41Å; F193-V203 WeakPolarHBondContact O-CA 3.22Å; F193-V203 WeakPolarHBondContact O-CG1 3.46Å; H194-V203 HydrophobicContact CB-CG2 4.23Å
204	H	98.5	Very high	96.7	Very high	4 Å²	4	41.6 Å²	41.6	2%	0.019	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	132.4	174.4	-60.6	-95.1	0	0	0	109.9	F48 E135 L137 L157 V158 T159 A192 F193 R202	F48-H204 HydrophobicContact CE2-CB 3.84Å; F48-H204 AromaticContact CE2-CG 3.91Å; E135-H204 IonicContact OE1-CE1 2.84Å; E135-H204 IonicContact OE1-NE2 2.84Å; E135-H204 IonicContact OE2-CD2 3.83Å; E135-H204 IonicContact OE2-CE1 3.87Å; E135-H204 IonicContact OE2-NE2 3.72Å; E135-H204 PolarHBondContact OE2-NE2 3.43Å; L137-H204 WeakPolarHBondContact CD2-CD2 3.3Å; L157-H204 HydrophobicContact CD1-CB 4.04Å; V158-H204 CarbonylContact O-C 3.5Å; V158-H204 VanDerWaalsContact O-CA 3.28Å; V158-H204 WeakPolarHBondContact O-CA 3.35Å; T159-H204 PolarHBondContact OG1-CE1 2.88Å; T159-H204 VanDerWaalsContact OG1-CE1 3.27Å; T159-H204 PolarHBondContact OG1-ND1 2.97Å; A192-H204 CarbonylContact C-O 3.52Å; A192-H204 VanDerWaalsContact CA-O 3.26Å; A192-H204 WeakPolarHBondContact CA-O 3.15Å; F193-H204 PolarHBondContact N-O 3.41Å; F193-H204 PolarHBondContact O-N 3.35Å; R202-H204 VanDerWaalsContact CD-NE2 3.27Å; R202-H204 WeakPolarHBondContact CD-NE2 3.42Å
205	A	98.6	Very high	96.9	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.2	169.1	0	0	0	0	0	109.2	V158 F160 M178 L189	V158-A205 PolarHBondContact N-O 2.98Å; V158-A205 PolarHBondContact O-N 2.86Å; F160-A205 HydrophobicContact CE2-CB 3.95Å; M178-A205 HydrophobicContact SD-CB 3.79Å; L189-A205 HydrophobicContact CD1-CB 3.99Å
206	L	98.8	Very high	97	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	120.1	175.1	-177.6	66	0	0	0	109.1	W82 I95 F155 L157 L190 G191 F193 M247	W82-L206 HydrophobicContact CH2-CD2 4.26Å; W82-L206 HydrophobicContact CZ2-CD2 4.41Å; I95-L206 HydrophobicContact CD1-CD2 4.16Å; F155-L206 HydrophobicContact CB-CD1 4.37Å; F155-L206 HydrophobicContact CD1-CD1 4.21Å; F155-L206 HydrophobicContact CD1-CG 4.48Å; L157-L206 HydrophobicContact CD1-CB 4.25Å; L157-L206 HydrophobicContact CD1-CD1 4.14Å; L190-L206 HydrophobicContact CB-CD2 4.33Å; L190-L206 HydrophobicContact CB-CG 4.31Å; L190-L206 HydrophobicContact CD1-CD2 4.41Å; L190-L206 HydrophobicContact CD1-CG 4.48Å; L190-L206 PolarHBondContact N-O 2.98Å; G191-L206 PolarHBondContact N-O 3.44Å; G191-L206 PolarHBondContact O-N 3.45Å; F193-L206 HydrophobicContact CE2-CB 4.29Å; L206-M247 HydrophobicContact CD1-CE 3.8Å
207	W	98.7	Very high	97.2	Very high	14 Å²	14	49.2 Å²	49.2	5%	0.053	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	152	-178.7	-64.2	88.9	0	0	0	111.3	F155 E156 M178 H181 D182 K188 L189 F209	F155-W207 CarbonylContact C-O 3.54Å; F155-W207 WeakPolarHBondContact CA-O 3.26Å; E156-W207 HydrophobicContact CB-CB 4.22Å; E156-W207 PolarHBondContact N-O 3.45Å; E156-W207 PolarHBondContact O-N 2.65Å; M178-W207 HydrophobicContact CB-CZ2 4.37Å; M178-W207 HydrophobicContact CE-CZ2 4.26Å; M178-W207 WeakPolarHBondContact O-CH2 3.36Å; M178-W207 HydrophobicContact SD-CZ2 3.56Å; M178-W207 VanDerWaalsContact SD-CZ2 3.56Å; H181-W207 HydrophobicContact CB-CH2 3.61Å; H181-W207 HydrophobicContact CB-CZ2 4.33Å; H181-W207 HydrophobicContact CB-CZ3 4.1Å; D182-W207 HydrophobicContact CB-CH2 4.33Å; D182-W207 HydrophobicContact CB-CZ3 4.09Å; K188-W207 VanDerWaalsContact C-CE3 3.46Å; K188-W207 CarbonylContact O-C 3.53Å; K188-W207 VanDerWaalsContact O-CA 3.31Å; K188-W207 WeakPolarHBondContact O-CA 3.4Å; L189-W207 HydrophobicContact CB-CD2 4.44Å; L189-W207 HydrophobicContact CB-CE3 3.99Å; L189-W207 HydrophobicContact CB-CH2 3.83Å; L189-W207 HydrophobicContact CB-CZ2 4.33Å; L189-W207 HydrophobicContact CB-CZ3 3.66Å; L189-W207 HydrophobicContact CD1-CD2 4.06Å; L189-W207 HydrophobicContact CD1-CE3 4.45Å; L189-W207 HydrophobicContact CD1-CH2 4.17Å; L189-W207 HydrophobicContact CD1-CZ2 3.78Å; L189-W207 HydrophobicContact CG-CH2 4.48Å; W207-F209 HydrophobicContact CB-CD2 4.44Å; W207-F209 HydrophobicContact CB-CE2 3.6Å; W207-F209 HydrophobicContact CB-CZ 4.09Å
208	W	98.6	Very high	97.3	Very high	12 Å²	12	44.4 Å²	44.4	5%	0.045	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.5	170.5	177.7	93.8	0	0	0	111.3	P148 P149 Q150 G152 F155 K188 L190 E210	P148-W208 HydrophobicContact CB-CG 4.26Å; P149-W208 HydrophobicContact CB-CZ3 4.38Å; P149-W208 HydrophobicContact CG-CD2 4.38Å; P149-W208 HydrophobicContact CG-CE3 3.81Å; P149-W208 HydrophobicContact CG-CZ3 3.9Å; Q150-W208 HydrophobicContact CG-CH2 3.63Å; Q150-W208 HydrophobicContact CG-CZ2 3.49Å; Q150-W208 VanDerWaalsContact CG-CZ2 3.49Å; G152-W208 PolarHBondContact O-NE1 3.22Å; F155-W208 AromaticContact CE1-CD1 3.96Å; F155-W208 AromaticContact CE2-CD1 3.81Å; F155-W208 AromaticContact CZ-CD1 3.65Å; K188-W208 HydrophobicContact CB-CB 4.37Å; K188-W208 HydrophobicContact CB-CE3 4.23Å; K188-W208 PolarHBondContact N-O 2.93Å; K188-W208 PolarHBondContact O-N 3.28Å; L190-W208 HydrophobicContact CD1-CB 3.87Å; L190-W208 HydrophobicContact CD2-CB 4.16Å; L190-W208 HydrophobicContact CG-CB 3.99Å; W208-E210 HydrophobicContact CH2-CB 4.26Å; W208-E210 HydrophobicContact CH2-CG 3.5Å; W208-E210 HydrophobicContact CZ2-CG 4.43Å; W208-E210 HydrophobicContact CZ3-CG 3.89Å
209	F	98.5	Very high	97.4	Very high	4 Å²	4	46 Å²	46	2%	0.018	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	152.9	176	-56.8	-93.2	0	0	0	110.4	G153 V154 E156 Y186 G187 W207 S211 R215 C218	G153-F209 CarbonylContact C-O 3.59Å; G153-F209 WeakPolarHBondContact CA-O 3.4Å; V154-F209 HydrophobicContact CG2-CB 3.94Å; V154-F209 PolarHBondContact N-O 3.1Å; V154-F209 PolarHBondContact O-N 2.96Å; E156-F209 HydrophobicContact CB-CD2 4.45Å; E156-F209 HydrophobicContact CB-CE2 3.8Å; Y186-F209 WeakPolarHBondContact O-CE1 3.37Å; G187-F209 VanDerWaalsContact CA-CE1 3.42Å; W207-F209 HydrophobicContact CB-CD2 4.44Å; W207-F209 HydrophobicContact CB-CE2 3.6Å; W207-F209 HydrophobicContact CB-CZ 4.09Å; F209-S211 VanDerWaalsContact C-N 3.31Å; F209-S211 PolarHBondContact O-N 2.95Å; F209-R215 HydrophobicContact CB-CB 3.84Å; F209-R215 HydrophobicContact CB-CG 4.48Å; F209-R215 HydrophobicContact CD1-CB 3.66Å; F209-R215 HydrophobicContact CD1-CG 3.79Å; F209-R215 HydrophobicContact CD2-CB 3.9Å; F209-R215 HydrophobicContact CD2-CG 3.57Å; F209-R215 HydrophobicContact CE1-CB 4.12Å; F209-R215 HydrophobicContact CE1-CG 3.77Å; F209-R215 HydrophobicContact CE2-CB 4.36Å; F209-R215 HydrophobicContact CE2-CG 3.56Å; F209-R215 HydrophobicContact CG-CB 3.52Å; F209-R215 HydrophobicContact CG-CG 3.69Å; F209-R215 HydrophobicContact CZ-CB 4.46Å; F209-R215 HydrophobicContact CZ-CG 3.67Å; F209-C218 HydrophobicContact CE1-CB 4.26Å
210	E	97.9	Very high	97.5	Very high	108 Å²	108	48.3 Å²	48.3	51%	0.505	25%	0.245	S	C	.	.	S	Bend	trans	-61.5	-36.5	177.4	-68.1	178.2	-172.2	0	0	113.5	G153 W208 H214	G153-E210 WeakPolarHBondContact CA-O 3.42Å; W208-E210 HydrophobicContact CH2-CB 4.26Å; W208-E210 HydrophobicContact CH2-CG 3.5Å; W208-E210 HydrophobicContact CZ2-CG 4.43Å; W208-E210 HydrophobicContact CZ3-CG 3.89Å; E210-H214 HydrophobicContact CB-CB 4.15Å; E210-H214 PolarHBondContact N-ND1 3.41Å
211	S	97.8	Very high	97.6	Very high	44 Å²	44	48.7 Å²	48.7	31%	0.308	24%	0.24	S	C	.	.			trans	-158.6	169.9	178.9	72	0	0	0	0	110.9	V154 F209 D213 H214 R215	V154-S211 VanDerWaalsContact CG2-C 3.41Å; V154-S211 WeakPolarHBondContact CG2-O 3.4Å; F209-S211 VanDerWaalsContact C-N 3.31Å; F209-S211 PolarHBondContact O-N 2.95Å; S211-D213 VanDerWaalsContact C-N 3.26Å; S211-D213 PolarHBondContact O-N 2.87Å; S211-D213 PolarHBondContact OG-N 3.37Å; S211-H214 PolarHBondContact O-N 3.36Å; S211-H214 WeakPolarHBondContact OG-CB 3.21Å; S211-H214 PolarHBondContact OG-N 2.81Å; S211-R215 WeakPolarHBondContact O-CB 3.31Å; S211-R215 PolarHBondContact O-N 3.4Å
212	A	97.7	Very high	97.7	Very high	32 Å²	32	46.3 Å²	46.3	26%	0.264	23%	0.227	S	C	.	.	H	α-helix	trans	-61.3	-37	173.4	0	0	0	0	0	111.9	R215 A216 L246	A212-R215 WeakPolarHBondContact O-CB 3.29Å; A212-R215 PolarHBondContact O-N 3.05Å; A212-A216 PolarHBondContact O-N 3.03Å; A212-L246 HydrophobicContact CB-CD2 3.83Å
213	D	98.1	Very high	97.7	Very high	132 Å²	132	50.4 Å²	50.4	71%	0.706	25%	0.248	S	C	*	.	H	α-helix	trans	-71	-43.7	178.1	-63.7	-26.9	0	0	0	111.6	S211 R215 A216 E217	S211-D213 VanDerWaalsContact C-N 3.26Å; S211-D213 PolarHBondContact O-N 2.87Å; S211-D213 PolarHBondContact OG-N 3.37Å; D213-R215 VanDerWaalsContact C-N 3.26Å; D213-R215 PolarHBondContact O-N 2.86Å; D213-A216 WeakPolarHBondContact O-CA 3.43Å; D213-A216 WeakPolarHBondContact O-CB 3.44Å; D213-A216 PolarHBondContact O-N 3.27Å; D213-E217 PolarHBondContact O-N 2.86Å
214	H	97.7	Very high	97.5	Very high	44 Å²	44	55.7 Å²	55.7	20%	0.204	28%	0.28	C	S	.	.	H	α-helix	trans	-57.6	-42.8	172.7	175.6	-107.5	0	0	0	110.7	E210 S211 A216 E217 C218	E210-H214 HydrophobicContact CB-CB 4.15Å; E210-H214 PolarHBondContact N-ND1 3.41Å; S211-H214 PolarHBondContact O-N 3.36Å; S211-H214 WeakPolarHBondContact OG-CB 3.21Å; S211-H214 PolarHBondContact OG-N 2.81Å; H214-A216 VanDerWaalsContact C-N 3.32Å; H214-A216 PolarHBondContact O-N 3.35Å; H214-E217 PolarHBondContact O-N 3.16Å; H214-C218 PolarHBondContact CE1-SG 2.84Å; H214-C218 PolarHBondContact NE2-SG 3.04Å; H214-C218 WeakPolarHBondContact O-CB 3.39Å; H214-C218 PolarHBondContact O-N 3.37Å; H214-C218 PolarHBondContact O-SG 2.93Å
215	R	97.6	Very high	97.5	Very high	45 Å²	45	56.4 Å²	56.4	17%	0.17	28%	0.284	C	S	.	.	H	α-helix	trans	-59.6	-41.2	174.1	-175.8	-92.5	177.1	-161.3	0.5	112.2	E156 F209 S211 A212 D213 R219 N244 L246	E156-R215 VanDerWaalsContact CD-NH2 3.28Å; E156-R215 IonicContact OE1-CZ 3.49Å; E156-R215 IonicContact OE1-NE 2.88Å; E156-R215 IonicContact OE1-NH2 3.23Å; E156-R215 PolarHBondContact OE1-NH2 2.8Å; E156-R215 IonicContact OE2-CZ 3.65Å; E156-R215 IonicContact OE2-NE 3.07Å; E156-R215 PolarHBondContact OE2-NE 2.82Å; E156-R215 IonicContact OE2-NH2 3.87Å; E156-R215 PolarHBondContact OE2-NH2 2.92Å; F209-R215 HydrophobicContact CB-CB 3.84Å; F209-R215 HydrophobicContact CB-CG 4.48Å; F209-R215 HydrophobicContact CD1-CB 3.66Å; F209-R215 HydrophobicContact CD1-CG 3.79Å; F209-R215 HydrophobicContact CD2-CB 3.9Å; F209-R215 HydrophobicContact CD2-CG 3.57Å; F209-R215 HydrophobicContact CE1-CB 4.12Å; F209-R215 HydrophobicContact CE1-CG 3.77Å; F209-R215 HydrophobicContact CE2-CB 4.36Å; F209-R215 HydrophobicContact CE2-CG 3.56Å; F209-R215 HydrophobicContact CG-CB 3.52Å; F209-R215 HydrophobicContact CG-CG 3.69Å; F209-R215 HydrophobicContact CZ-CB 4.46Å; F209-R215 HydrophobicContact CZ-CG 3.67Å; S211-R215 WeakPolarHBondContact O-CB 3.31Å; S211-R215 PolarHBondContact O-N 3.4Å; A212-R215 WeakPolarHBondContact O-CB 3.29Å; A212-R215 PolarHBondContact O-N 3.05Å; D213-R215 VanDerWaalsContact C-N 3.26Å; D213-R215 PolarHBondContact O-N 2.86Å; R215-R219 WeakPolarHBondContact O-CG 3.38Å; R215-R219 PolarHBondContact O-N 3.06Å; R215-N244 PolarHBondContact NH2-ND2 2.98Å; R215-L246 HydrophobicContact CG-CD1 4.37Å
216	A	97.5	Very high	97.4	Very high	54 Å²	54	60.2 Å²	60.2	45%	0.446	32%	0.316	S	S	.	.	H	α-helix	trans	-65.8	-44.9	177.2	0	0	0	0	0	111.8	A212 D213 H214 R219 H220	A212-A216 PolarHBondContact O-N 3.03Å; D213-A216 WeakPolarHBondContact O-CA 3.43Å; D213-A216 WeakPolarHBondContact O-CB 3.44Å; D213-A216 PolarHBondContact O-N 3.27Å; H214-A216 VanDerWaalsContact C-N 3.32Å; H214-A216 PolarHBondContact O-N 3.35Å; A216-R219 PolarHBondContact O-N 3.39Å; A216-H220 PolarHBondContact O-N 3.4Å
217	E	97.8	Very high	97.4	Very high	108 Å²	108	68 Å²	68	51%	0.505	35%	0.345	S	S	.	.	H	α-helix	trans	-62.3	-49.7	177.2	-169.4	-163.6	149.1	0	0	111.8	D213 H214 R219 H220 R221	D213-E217 PolarHBondContact O-N 2.86Å; H214-E217 PolarHBondContact O-N 3.16Å; E217-R219 PolarHBondContact O-N 3.19Å; E217-H220 WeakPolarHBondContact O-CB 3.44Å; E217-H220 PolarHBondContact O-N 2.97Å; E217-H220 VanDerWaalsContact O-N 3.09Å; E217-R221 PolarHBondContact O-N 3.23Å
218	C	97.8	Very high	97.3	Very high	1 Å²	1	67.5 Å²	67.5	1%	0.007	34%	0.344	C	S	.	.	H	α-helix	trans	-52.2	-44.7	176.7	-77	0	0	0	0	111.3	Y186 F209 H214 R221 A222	Y186-C218 WeakPolarHBondContact CD1-O 3.33Å; F209-C218 HydrophobicContact CE1-CB 4.26Å; H214-C218 PolarHBondContact CE1-SG 2.84Å; H214-C218 PolarHBondContact NE2-SG 3.04Å; H214-C218 WeakPolarHBondContact O-CB 3.39Å; H214-C218 PolarHBondContact O-N 3.37Å; H214-C218 PolarHBondContact O-SG 2.93Å; C218-R221 PolarHBondContact O-N 3.4Å; C218-A222 VanDerWaalsContact O-CB 3.24Å; C218-A222 WeakPolarHBondContact O-CB 3.41Å; C218-A222 PolarHBondContact O-N 3.37Å
219	R	96.1	Very high	97.3	Very high	85 Å²	85	69.7 Å²	69.7	32%	0.321	36%	0.358	S	S	.	.	H	α-helix	trans	-68.2	-41.7	178.5	-77.6	-171.6	68.4	101.9	9.9	113.2	E156 R215 A216 E217 R221 A222 H223	E156-R219 IonicContact OE1-NH1 3.62Å; R215-R219 WeakPolarHBondContact O-CG 3.38Å; R215-R219 PolarHBondContact O-N 3.06Å; A216-R219 PolarHBondContact O-N 3.39Å; E217-R219 PolarHBondContact O-N 3.19Å; R219-R221 VanDerWaalsContact C-N 3.29Å; R219-R221 PolarHBondContact O-N 3.49Å; R219-A222 PolarHBondContact O-N 2.8Å; R219-H223 PolarHBondContact NH2-NE2 3.22Å; R219-H223 PolarHBondContact O-CD2 2.95Å; R219-H223 PolarHBondContact O-N 2.84Å
220	H	96.8	Very high	97.3	Very high	138 Å²	138	71.8 Å²	71.8	64%	0.639	38%	0.377	S	S	*	.	H	α-helix	trans	-57.2	-47.1	176.3	-177.1	72.3	0	0	0	110.8	A216 E217 H223	A216-H220 PolarHBondContact O-N 3.4Å; E217-H220 WeakPolarHBondContact O-CB 3.44Å; E217-H220 PolarHBondContact O-N 2.97Å; E217-H220 VanDerWaalsContact O-N 3.09Å; H220-H223 PolarHBondContact O-N 3.31Å
221	R	97.3	Very high	97.3	Very high	108 Å²	108	67.3 Å²	67.3	41%	0.408	36%	0.358	S	S	.	.	H	α-helix	trans	-63.6	-48.1	176.2	-67.2	171.8	55.3	-156.8	-8.1	111.9	Y186 E217 C218 R219 H223 T224 D225	Y186-R221 HydrophobicContact CD1-CB 4.14Å; Y186-R221 HydrophobicContact CE1-CB 3.56Å; E217-R221 PolarHBondContact O-N 3.23Å; C218-R221 PolarHBondContact O-N 3.4Å; R219-R221 VanDerWaalsContact C-N 3.29Å; R219-R221 PolarHBondContact O-N 3.49Å; R221-H223 PolarHBondContact O-N 3.24Å; R221-T224 PolarHBondContact O-N 3.41Å; R221-T224 PolarHBondContact O-OG1 3.1Å; R221-D225 PolarHBondContact O-N 2.89Å
222	A	96.9	Very high	97.3	Very high	3 Å²	3	67.5 Å²	67.5	3%	0.025	36%	0.358	C	S	.	.	H	α-helix	trans	-57	-35.2	178.9	0	0	0	0	0	113	Y186 C218 R219 T224 D225 V228	Y186-A222 HydrophobicContact CD1-CB 4.18Å; Y186-A222 HydrophobicContact CD2-CB 3.79Å; Y186-A222 HydrophobicContact CE2-CB 4.25Å; Y186-A222 HydrophobicContact CG-CB 3.76Å; C218-A222 VanDerWaalsContact O-CB 3.24Å; C218-A222 WeakPolarHBondContact O-CB 3.41Å; C218-A222 PolarHBondContact O-N 3.37Å; R219-A222 PolarHBondContact O-N 2.8Å; A222-T224 PolarHBondContact O-N 2.97Å; A222-D225 PolarHBondContact O-N 3.43Å; A222-V228 HydrophobicContact CB-CG1 4.28Å; A222-V228 WeakPolarHBondContact O-CB 3.45Å
223	H	94.8	Very high	97.2	Very high	123 Å²	123	74.4 Å²	74.4	57%	0.569	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.8	176.6	-78.5	-53.3	0	0	0	114.1	R219 H220 R221 V229	R219-H223 PolarHBondContact NH2-NE2 3.22Å; R219-H223 PolarHBondContact O-CD2 2.95Å; R219-H223 PolarHBondContact O-N 2.84Å; H220-H223 PolarHBondContact O-N 3.31Å; R221-H223 PolarHBondContact O-N 3.24Å; H223-V229 WeakPolarHBondContact O-CG2 3.49Å
224	T	94.9	Very high	97.2	Very high	110 Å²	110	72.9 Å²	72.9	68%	0.675	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-9.2	177.7	62.9	0	0	0	0	113.6	R221 A222 A226	R221-T224 PolarHBondContact O-N 3.41Å; R221-T224 PolarHBondContact O-OG1 3.1Å; A222-T224 PolarHBondContact O-N 2.97Å; T224-A226 PolarHBondContact O-N 3.31Å
225	D	97.9	Very high	97.2	Very high	19 Å²	19	71.3 Å²	71.3	10%	0.102	36%	0.362	C	S	.	.			trans	-78	111.7	176.8	-169.5	-39.6	0	0	0	110.3	Y186 R221 A222 R227 V228 V229	Y186-D225 HydrophobicContact CE2-CB 4Å; Y186-D225 WeakPolarHBondContact CE2-OD2 3.23Å; Y186-D225 PolarHBondContact OH-OD2 3.43Å; R221-D225 PolarHBondContact O-N 2.89Å; A222-D225 PolarHBondContact O-N 3.43Å; D225-R227 PolarHBondContact O-N 3.48Å; D225-R227 VanDerWaalsContact O-N 3.08Å; D225-R227 VanDerWaalsContact OD1-CB 3.31Å; D225-R227 WeakPolarHBondContact OD1-CB 3.41Å; D225-R227 IonicContact OD1-CZ 3.6Å; D225-R227 PolarHBondContact OD1-N 2.97Å; D225-R227 IonicContact OD1-NE 3.58Å; D225-R227 PolarHBondContact OD1-NE 2.96Å; D225-R227 VanDerWaalsContact OD1-NE 3.07Å; D225-R227 IonicContact OD1-NH2 2.78Å; D225-R227 IonicContact OD2-CZ 2.71Å; D225-R227 IonicContact OD2-NE 3.85Å; D225-R227 IonicContact OD2-NH2 3.89Å; D225-R227 PolarHBondContact OD2-NH2 3.32Å; D225-V228 HydrophobicContact CB-CB 4.15Å; D225-V228 HydrophobicContact CB-CG2 3.88Å; D225-V228 PolarHBondContact O-N 2.87Å; D225-V229 WeakPolarHBondContact O-CG2 3.24Å; D225-V229 PolarHBondContact O-N 3Å
226	A	97.5	Very high	97.1	Very high	81 Å²	81	72 Å²	72	67%	0.669	37%	0.371	S	S	*	.	H	α-helix	trans	-55.3	-31	-177.2	0	0	0	0	0	113.4	T224 A230	T224-A226 PolarHBondContact O-N 3.31Å; A226-A230 VanDerWaalsContact O-CB 3.3Å; A226-A230 WeakPolarHBondContact O-CB 3.49Å; A226-A230 PolarHBondContact O-N 3.24Å
227	R	97.4	Very high	97	Very high	162 Å²	162	72 Å²	72	61%	0.611	37%	0.371	S	S	*	.	H	α-helix	trans	-70.5	-44.1	178.6	-58.5	169.4	-65.2	177	1.9	110.8	D225 A231	D225-R227 PolarHBondContact O-N 3.48Å; D225-R227 VanDerWaalsContact O-N 3.08Å; D225-R227 VanDerWaalsContact OD1-CB 3.31Å; D225-R227 WeakPolarHBondContact OD1-CB 3.41Å; D225-R227 IonicContact OD1-CZ 3.6Å; D225-R227 PolarHBondContact OD1-N 2.97Å; D225-R227 IonicContact OD1-NE 3.58Å; D225-R227 PolarHBondContact OD1-NE 2.96Å; D225-R227 VanDerWaalsContact OD1-NE 3.07Å; D225-R227 IonicContact OD1-NH2 2.78Å; D225-R227 IonicContact OD2-CZ 2.71Å; D225-R227 IonicContact OD2-NE 3.85Å; D225-R227 IonicContact OD2-NH2 3.89Å; D225-R227 PolarHBondContact OD2-NH2 3.32Å; R227-A231 WeakPolarHBondContact O-CB 3.28Å; R227-A231 PolarHBondContact O-N 3.35Å
228	V	97.8	Very high	97	Very high	4 Å²	4	69.3 Å²	69.3	2%	0.024	36%	0.359	C	S	.	.	H	α-helix	trans	-63.1	-49.1	175.6	177.7	0	0	0	0	109.9	A180 H181 Y186 A222 D225 A230 A231 V232	A180-V228 HydrophobicContact CB-CG2 4.2Å; A180-V228 VanDerWaalsContact O-CG2 3.31Å; A180-V228 WeakPolarHBondContact O-CG2 3.47Å; H181-V228 VanDerWaalsContact CE1-CG1 3.4Å; H181-V228 WeakPolarHBondContact CE1-CG1 3.13Å; H181-V228 WeakPolarHBondContact NE2-CG1 3.09Å; Y186-V228 HydrophobicContact CD2-CG2 3.86Å; Y186-V228 HydrophobicContact CE2-CG2 3.71Å; A222-V228 HydrophobicContact CB-CG1 4.28Å; A222-V228 WeakPolarHBondContact O-CB 3.45Å; D225-V228 HydrophobicContact CB-CB 4.15Å; D225-V228 HydrophobicContact CB-CG2 3.88Å; D225-V228 PolarHBondContact O-N 2.87Å; V228-A230 VanDerWaalsContact C-N 3.33Å; V228-A230 PolarHBondContact O-N 3.09Å; V228-A231 PolarHBondContact O-N 2.86Å; V228-V232 HydrophobicContact CG1-CG2 4.02Å; V228-V232 WeakPolarHBondContact O-CB 3.48Å; V228-V232 VanDerWaalsContact O-CG2 3.28Å; V228-V232 WeakPolarHBondContact O-CG2 3.38Å; V228-V232 PolarHBondContact O-N 3.34Å
229	V	97.6	Very high	96.9	Very high	58 Å²	58	70.3 Å²	70.3	35%	0.352	36%	0.364	S	S	.	.	H	α-helix	trans	-58	-45.4	-179.4	172.6	0	0	0	0	111.3	H223 D225 R233	H223-V229 WeakPolarHBondContact O-CG2 3.49Å; D225-V229 WeakPolarHBondContact O-CG2 3.24Å; D225-V229 PolarHBondContact O-N 3Å; V229-R233 VanDerWaalsContact O-CB 3.29Å; V229-R233 WeakPolarHBondContact O-CB 3.29Å; V229-R233 PolarHBondContact O-N 3.27Å
230	A	98.1	Very high	96.9	Very high	49 Å²	49	70.8 Å²	70.8	41%	0.405	37%	0.373	S	S	.	.	H	α-helix	trans	-63.9	-46	177.6	0	0	0	0	0	112.3	A226 V228 R233 N234	A226-A230 VanDerWaalsContact O-CB 3.3Å; A226-A230 WeakPolarHBondContact O-CB 3.49Å; A226-A230 PolarHBondContact O-N 3.24Å; V228-A230 VanDerWaalsContact C-N 3.33Å; V228-A230 PolarHBondContact O-N 3.09Å; A230-R233 PolarHBondContact O-N 3.35Å; A230-N234 PolarHBondContact O-N 3.38Å; A230-N234 VanDerWaalsContact O-N 3.16Å
231	A	98.2	Very high	97	Very high	14 Å²	14	67.6 Å²	67.6	12%	0.116	37%	0.366	C	S	.	.	H	α-helix	trans	-64.6	-43.6	179.6	0	0	0	0	0	112.1	A177 A180 R227 V228 N234 S235	A177-A231 HydrophobicContact CB-CB 4.5Å; A180-A231 HydrophobicContact CB-CB 3.9Å; R227-A231 WeakPolarHBondContact O-CB 3.28Å; R227-A231 PolarHBondContact O-N 3.35Å; V228-A231 PolarHBondContact O-N 2.86Å; A231-N234 PolarHBondContact O-N 2.85Å; A231-S235 PolarHBondContact O-N 3.3Å
232	V	97.2	Very high	97	Very high	48 Å²	48	67.9 Å²	67.9	29%	0.291	37%	0.372	S	S	.	.	H	α-helix	trans	-62.7	-45.6	175.7	172.4	0	0	0	0	110.6	A177 V228 N234 S235 V236	A177-V232 HydrophobicContact CB-CG2 4.4Å; V228-V232 HydrophobicContact CG1-CG2 4.02Å; V228-V232 WeakPolarHBondContact O-CB 3.48Å; V228-V232 VanDerWaalsContact O-CG2 3.28Å; V228-V232 WeakPolarHBondContact O-CG2 3.38Å; V228-V232 PolarHBondContact O-N 3.34Å; V232-N234 PolarHBondContact O-N 2.9Å; V232-S235 PolarHBondContact O-N 3.31Å; V232-V236 HydrophobicContact CG1-CG1 3.89Å; V232-V236 WeakPolarHBondContact O-CG1 3.4Å; V232-V236 WeakPolarHBondContact O-CG2 3.28Å; V232-V236 PolarHBondContact O-N 3.45Å
233	R	97.3	Very high	97	Very high	176 Å²	176	75 Å²	75	66%	0.664	40%	0.398	S	S	*	.	H	α-helix	trans	-53.9	-43.4	177.5	-177.3	-177.4	-66.4	178.6	-0.7	111.8	V229 A230 V236	V229-R233 VanDerWaalsContact O-CB 3.29Å; V229-R233 WeakPolarHBondContact O-CB 3.29Å; V229-R233 PolarHBondContact O-N 3.27Å; A230-R233 PolarHBondContact O-N 3.35Å; R233-V236 VanDerWaalsContact O-CG2 3.3Å; R233-V236 WeakPolarHBondContact O-CG2 3.4Å
234	N	97.5	Very high	97.2	Very high	101 Å²	101	72.4 Å²	72.4	54%	0.54	39%	0.388	S	S	.	.	H	α-helix	trans	-68.3	-41.5	177.6	-66.6	-14	0	0	0	111.7	A230 A231 V232 A237	A230-N234 PolarHBondContact O-N 3.38Å; A230-N234 VanDerWaalsContact O-N 3.16Å; A231-N234 PolarHBondContact O-N 2.85Å; V232-N234 PolarHBondContact O-N 2.9Å; N234-A237 WeakPolarHBondContact O-CB 3.49Å
235	S	97.1	Very high	97.3	Very high	10 Å²	10	68.4 Å²	68.4	7%	0.07	36%	0.362	C	S	.	.	H	α-helix	trans	-66.7	-40.1	178.6	-173.7	0	0	0	0	113.2	F174 A231 V232 A237 H238	F174-S235 WeakPolarHBondContact CA-OG 3.23Å; A231-S235 PolarHBondContact O-N 3.3Å; V232-S235 PolarHBondContact O-N 3.31Å; S235-A237 PolarHBondContact O-N 3Å; S235-H238 PolarHBondContact O-N 2.87Å
236	V	95.8	Very high	97.3	Very high	59 Å²	59	68 Å²	68	36%	0.358	36%	0.36	S	S	.	.	H	α-helix	trans	-70.5	-16.2	-176.9	-61.7	0	0	0	0	113	V232 R233 H238 L239	V232-V236 HydrophobicContact CG1-CG1 3.89Å; V232-V236 WeakPolarHBondContact O-CG1 3.4Å; V232-V236 WeakPolarHBondContact O-CG2 3.28Å; V232-V236 PolarHBondContact O-N 3.45Å; R233-V236 VanDerWaalsContact O-CG2 3.3Å; R233-V236 WeakPolarHBondContact O-CG2 3.4Å; V236-H238 PolarHBondContact O-N 3.03Å; V236-H238 VanDerWaalsContact O-N 3.1Å; V236-L239 HydrophobicContact CB-CB 4.47Å; V236-L239 HydrophobicContact CG1-CD2 4.14Å; V236-L239 WeakPolarHBondContact O-CB 3.33Å; V236-L239 PolarHBondContact O-N 2.91Å
237	A	96.5	Very high	97.4	Very high	54 Å²	54	64.1 Å²	64.1	45%	0.446	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.2	171.7	0	0	0	0	0	112.9	R163 N234 S235	R163-A237 PolarHBondContact NH1-O 3Å; N234-A237 WeakPolarHBondContact O-CB 3.49Å; S235-A237 PolarHBondContact O-N 3Å
238	H	96.4	Very high	97.4	Very high	53 Å²	53	60 Å²	60	25%	0.245	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.9	11.4	178.4	-54.1	-77.5	0	0	0	113.6	M162 R163 W170 S235 V236	M162-H238 HydrophobicContact CE-CB 4.17Å; R163-H238 PolarHBondContact N-O 3.23Å; W170-H238 HydrophobicContact CB-CB 3.66Å; S235-H238 PolarHBondContact O-N 2.87Å; V236-H238 PolarHBondContact O-N 3.03Å; V236-H238 VanDerWaalsContact O-N 3.1Å
239	L	96.1	Very high	97.4	Very high	22 Å²	22	61.1 Å²	61.1	12%	0.115	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.8	-171.5	-173	74	0	0	0	110.7	F160 Q161 M162 V236 S241 Q242	F160-L239 HydrophobicContact CB-CD1 3.62Å; F160-L239 HydrophobicContact CD1-CD1 3.86Å; F160-L239 HydrophobicContact CD1-CD2 4.31Å; F160-L239 HydrophobicContact CG-CD1 4.23Å; Q161-L239 WeakPolarHBondContact O-CD1 3.36Å; M162-L239 HydrophobicContact SD-CD1 3.61Å; V236-L239 HydrophobicContact CB-CB 4.47Å; V236-L239 HydrophobicContact CG1-CD2 4.14Å; V236-L239 WeakPolarHBondContact O-CB 3.33Å; V236-L239 PolarHBondContact O-N 2.91Å; L239-S241 VanDerWaalsContact CD1-O 3.29Å; L239-S241 WeakPolarHBondContact CD1-O 3.47Å; L239-Q242 HydrophobicContact CD2-CB 4Å; L239-Q242 HydrophobicContact CD2-CG 4.02Å
240	D	96.5	Very high	97.4	Very high	95 Å²	95	58.6 Å²	58.6	51%	0.508	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-42.2	172.7	-68.2	-26.6	0	0	0	111.6	Q161 R163	Q161-D240 HydrophobicContact CG-CB 4.39Å; Q161-D240 PolarHBondContact O-N 3.48Å; R163-D240 WeakPolarHBondContact CG-OD1 3.36Å; R163-D240 IonicContact NE-OD1 2.67Å; R163-D240 PolarHBondContact NE-OD1 3.18Å; R163-D240 VanDerWaalsContact NE-OD1 3.08Å
241	S	97.8	Very high	97.2	Very high	70 Å²	70	60.9 Å²	60.9	49%	0.49	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	161.1	174.2	64.2	0	0	0	0	111.8	Q161 L239	Q161-S241 WeakPolarHBondContact CB-OG 3.37Å; Q161-S241 PolarHBondContact N-O 2.85Å; Q161-S241 PolarHBondContact O-N 3.22Å; L239-S241 VanDerWaalsContact CD1-O 3.29Å; L239-S241 WeakPolarHBondContact CD1-O 3.47Å
242	Q	97.6	Very high	96.9	Very high	115 Å²	115	62.1 Å²	62.1	54%	0.537	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	153.7	170.7	58	178.8	-4.3	0	0	110.8	T159 F160 L239	T159-Q242 CarbonylContact O-C 3.59Å; T159-Q242 VanDerWaalsContact O-CA 3.25Å; T159-Q242 WeakPolarHBondContact O-CA 3.27Å; F160-Q242 HydrophobicContact CD1-CB 3.91Å; F160-Q242 HydrophobicContact CE1-CB 4.34Å; F160-Q242 VanDerWaalsContact CE1-OE1 3.25Å; L239-Q242 HydrophobicContact CD2-CB 4Å; L239-Q242 HydrophobicContact CD2-CG 4.02Å
243	R	97.8	Very high	96.9	Very high	151 Å²	151	60 Å²	60	57%	0.57	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	159	171.6	64.6	-178.9	-173.6	-174.1	1.9	109.6	V158 T159	V158-R243 CarbonylContact C-O 3.59Å; V158-R243 WeakPolarHBondContact CA-O 3.42Å; T159-R243 PolarHBondContact N-O 2.94Å; T159-R243 PolarHBondContact O-N 2.99Å
244	N	97.6	Very high	96.9	Very high	69 Å²	69	55.6 Å²	55.6	37%	0.369	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	162.4	174.5	71.2	-33.8	0	0	0	111.2	E156 L157 V158 R215	E156-N244 HydrophobicContact CG-CB 4.17Å; E156-N244 VanDerWaalsContact OE1-CB 3.23Å; E156-N244 WeakPolarHBondContact OE1-CB 3.24Å; E156-N244 PolarHBondContact OE1-ND2 3.03Å; L157-N244 CarbonylContact O-C 3.52Å; L157-N244 VanDerWaalsContact O-CA 3.3Å; L157-N244 WeakPolarHBondContact O-CA 3.43Å; V158-N244 HydrophobicContact CG1-CB 4.38Å; V158-N244 HydrophobicContact CG2-CB 4.09Å; R215-N244 PolarHBondContact NH2-ND2 2.98Å
245	Q	98.1	Very high	96.7	Very high	26 Å²	26	51.5 Å²	51.5	12%	0.121	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	139.9	169.3	58.3	-175	-7.4	0	0	109.8	V84 Y86 E156 L157 M247	V84-Q245 HydrophobicContact CG1-CB 3.9Å; Y86-Q245 CarbonylContact O-C 3.51Å; Y86-Q245 WeakPolarHBondContact O-CA 3.37Å; Y86-Q245 WeakPolarHBondContact O-CB 3.43Å; E156-Q245 VanDerWaalsContact CA-O 3.32Å; E156-Q245 WeakPolarHBondContact CA-O 3.47Å; L157-Q245 HydrophobicContact CB-CG 3.91Å; L157-Q245 PolarHBondContact N-O 2.95Å; L157-Q245 PolarHBondContact O-N 3.08Å; Q245-M247 HydrophobicContact CG-CG 4.06Å; Q245-M247 HydrophobicContact CG-SD 4.06Å
246	L	98.5	Very high	96.4	Very high	11 Å²	11	56 Å²	56	6%	0.058	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	134.2	172.5	-164.5	78.5	0	0	0	108.9	E85 Y86 V154 F155 E156 A212 R215 F248	E85-L246 PolarHBondContact N-O 3.4Å; Y86-L246 HydrophobicContact CD2-CB 3.85Å; Y86-L246 HydrophobicContact CD2-CD2 3.53Å; Y86-L246 HydrophobicContact CD2-CG 4.32Å; Y86-L246 HydrophobicContact CE2-CD2 3.82Å; Y86-L246 HydrophobicContact CG-CB 4.43Å; Y86-L246 PolarHBondContact N-O 2.99Å; Y86-L246 PolarHBondContact O-N 3.41Å; V154-L246 HydrophobicContact CB-CD1 4.26Å; V154-L246 HydrophobicContact CB-CG 4.45Å; V154-L246 HydrophobicContact CG2-CD1 3.93Å; F155-L246 CarbonylContact O-C 3.55Å; F155-L246 WeakPolarHBondContact O-CA 3.37Å; E156-L246 HydrophobicContact CB-CD1 4.49Å; A212-L246 HydrophobicContact CB-CD2 3.83Å; R215-L246 HydrophobicContact CG-CD1 4.37Å; L246-F248 HydrophobicContact CD2-CE2 4.34Å
247	M	98.4	Very high	96.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145	-170.6	-39.8	-178.8	-65.9	0	0	110.9	W82 T83 V84 F93 F155 L157 L206 Q245	W82-M247 HydrophobicContact CB-CB 3.67Å; W82-M247 HydrophobicContact CB-SD 4.35Å; W82-M247 HydrophobicContact CD2-CE 4.33Å; W82-M247 HydrophobicContact CG-CB 4.11Å; W82-M247 HydrophobicContact CG-CE 4.27Å; T83-M247 CarbonylContact O-C 3.53Å; T83-M247 WeakPolarHBondContact O-CA 3.25Å; V84-M247 HydrophobicContact CG2-CG 4.14Å; V84-M247 HydrophobicContact CG2-SD 4.37Å; F93-M247 HydrophobicContact CB-SD 4.15Å; F93-M247 HydrophobicContact CD1-CE 3.89Å; F93-M247 HydrophobicContact CD1-SD 3.62Å; F93-M247 HydrophobicContact CE1-CE 4.17Å; F93-M247 HydrophobicContact CE1-SD 4.37Å; F93-M247 HydrophobicContact CG-SD 4.09Å; F155-M247 HydrophobicContact CB-CB 4.46Å; F155-M247 HydrophobicContact CB-CE 3.97Å; F155-M247 PolarHBondContact N-O 3.15Å; F155-M247 PolarHBondContact O-N 3.32Å; L157-M247 HydrophobicContact CB-CE 3.77Å; L157-M247 HydrophobicContact CB-SD 4.05Å; L206-M247 HydrophobicContact CD1-CE 3.8Å; Q245-M247 HydrophobicContact CG-CG 4.06Å; Q245-M247 HydrophobicContact CG-SD 4.06Å
248	F	97.8	Very high	96.5	Very high	75 Å²	75	56 Å²	56	33%	0.329	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	132.2	176.2	-71.6	-99.8	0	0	0	109.2	W82 T83 E85 V154 L246 C250	W82-F248 CarbonylContact C-O 3.56Å; W82-F248 WeakPolarHBondContact CA-O 3.23Å; W82-F248 WeakPolarHBondContact CB-O 3.21Å; T83-F248 PolarHBondContact N-O 3.42Å; T83-F248 PolarHBondContact O-N 3.03Å; E85-F248 HydrophobicContact CB-CD2 3.66Å; E85-F248 HydrophobicContact CB-CE2 3.45Å; E85-F248 VanDerWaalsContact CB-CE2 3.45Å; E85-F248 HydrophobicContact CG-CD2 4.29Å; E85-F248 HydrophobicContact CG-CE2 3.7Å; V154-F248 HydrophobicContact CG1-CD1 3.95Å; V154-F248 HydrophobicContact CG1-CE1 3.52Å; V154-F248 HydrophobicContact CG1-CE2 4.48Å; V154-F248 HydrophobicContact CG1-CZ 3.82Å; L246-F248 HydrophobicContact CD2-CE2 4.34Å; F248-C250 PolarHBondContact O-N 3.43Å
249	P	97.7	Very high	96.5	Very high	27 Å²	27	56.2 Å²	56.2	18%	0.175	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	138.1	179.6	29.7	-34.7	0	0	0	109.8	W82 G153 F155 M255 K256	W82-P249 VanDerWaalsContact CD1-CA 3.41Å; G153-P249 WeakPolarHBondContact O-CD 3.3Å; F155-P249 HydrophobicContact CD2-CB 4.47Å; F155-P249 HydrophobicContact CD2-CG 4.4Å; F155-P249 HydrophobicContact CE2-CB 3.96Å; F155-P249 HydrophobicContact CE2-CG 3.92Å; P249-M255 WeakPolarHBondContact CB-O 3.5Å; P249-K256 HydrophobicContact CB-CB 4.17Å
250	C	97.1	Very high	96.5	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.034	30%	0.3	C	S	.	.			trans	-70.6	153.2	173	-59.1	0	0	0	0	110.4	C81 F92 F248 F252 S253	C81-C250 PolarHBondContact O-N 3.31Å; F92-C250 VanDerWaalsContact CE2-SG 3.58Å; F248-C250 PolarHBondContact O-N 3.43Å; C250-F252 HydrophobicContact CB-CD1 3.93Å; C250-F252 HydrophobicContact CB-CE1 3.59Å; C250-F252 HydrophobicContact CB-CE2 4.23Å; C250-F252 HydrophobicContact CB-CG 4.41Å; C250-F252 HydrophobicContact CB-CZ 3.75Å; C250-F252 PolarHBondContact O-N 3.23Å; C250-S253 WeakPolarHBondContact O-CB 3.31Å; C250-S253 PolarHBondContact O-N 2.94Å
251	P	94.1	Very high	96.5	Very high	98 Å²	98	55.9 Å²	55.9	64%	0.636	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-24.7	-178	-27.7	35.5	0	0	0	115.4	K256	P251-K256 VanDerWaalsContact O-CD 3.26Å; P251-K256 WeakPolarHBondContact O-CD 3.38Å; P251-K256 PolarHBondContact O-NZ 3.07Å
252	F	93.1	Very high	96.4	Very high	40 Å²	40	54.9 Å²	54.9	18%	0.175	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	2.4	178.7	57.3	-89.6	0	0	0	113.7	T65 N66 I69 C81 F92 C250	T65-F252 HydrophobicContact CG2-CE2 3.8Å; T65-F252 HydrophobicContact CG2-CZ 3.53Å; N66-F252 HydrophobicContact CB-CD1 3.55Å; N66-F252 HydrophobicContact CB-CE1 3.64Å; N66-F252 HydrophobicContact CB-CG 4.49Å; N66-F252 WeakPolarHBondContact OD1-CD1 3.29Å; I69-F252 HydrophobicContact CB-CD2 4.43Å; I69-F252 HydrophobicContact CB-CE2 4.35Å; I69-F252 HydrophobicContact CG1-CE2 4.34Å; I69-F252 HydrophobicContact CG2-CD2 3.67Å; I69-F252 HydrophobicContact CG2-CE2 4.06Å; I69-F252 HydrophobicContact CG2-CG 4.25Å; C81-F252 HydrophobicContact CB-CE2 4.31Å; C81-F252 WeakPolarHBondContact SG-CD2 3.42Å; C81-F252 WeakPolarHBondContact SG-CE2 3.49Å; F92-F252 HydrophobicContact CE2-CZ 4.06Å; F92-F252 HydrophobicContact CZ-CE2 4.28Å; F92-F252 HydrophobicContact CZ-CZ 4.16Å; C250-F252 HydrophobicContact CB-CD1 3.93Å; C250-F252 HydrophobicContact CB-CE1 3.59Å; C250-F252 HydrophobicContact CB-CE2 4.23Å; C250-F252 HydrophobicContact CB-CG 4.41Å; C250-F252 HydrophobicContact CB-CZ 3.75Å; C250-F252 PolarHBondContact O-N 3.23Å
253	S	96.7	Very high	96.3	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.014	26%	0.255	C	S	.	.			trans	-65.5	133.9	176	-176	0	0	0	0	110.3	G80 C81 C250 M255 K256	G80-S253 WeakPolarHBondContact CA-OG 3.39Å; C81-S253 PolarHBondContact N-OG 3.37Å; C81-S253 WeakPolarHBondContact O-CB 3.48Å; C81-S253 PolarHBondContact O-OG 3.04Å; C81-S253 WeakPolarHBondContact SG-CA 3.29Å; C81-S253 VanDerWaalsContact SG-CB 3.52Å; C250-S253 WeakPolarHBondContact O-CB 3.31Å; C250-S253 PolarHBondContact O-N 2.94Å; S253-M255 VanDerWaalsContact C-N 3.25Å; S253-M255 PolarHBondContact O-N 2.86Å; S253-M255 PolarHBondContact OG-N 2.84Å; S253-M255 PolarHBondContact OG-O 3.47Å; S253-K256 WeakPolarHBondContact O-CB 3.47Å; S253-K256 WeakPolarHBondContact O-CG 3.46Å
254	P	96.4	Very high	96.2	Very high	85 Å²	85	42.9 Å²	42.9	55%	0.552	23%	0.23	S	C	*	.	S	Bend	trans	-61.5	-34.9	169	-26.4	36.1	0	0	0	112.6	L78 K256	L78-P254 HydrophobicContact CB-CG 4.22Å; L78-P254 HydrophobicContact CD2-CG 4.18Å; L78-P254 HydrophobicContact CG-CG 4.11Å; P254-K256 PolarHBondContact O-N 2.78Å
255	M	94.7	Very high	96.1	Very high	15 Å²	15	40.8 Å²	40.8	7%	0.074	22%	0.219	C	C	.	.			trans	-93.2	80.6	169.3	-73.1	-178.8	171.8	0	0	109.4	I79 W82 L145 K146 P148 F155 P249 S253	I79-M255 HydrophobicContact CG2-CE 3.65Å; I79-M255 HydrophobicContact CG2-SD 3.78Å; I79-M255 VanDerWaalsContact O-CG 3.29Å; I79-M255 WeakPolarHBondContact O-CG 3.08Å; W82-M255 HydrophobicContact CH2-SD 4.19Å; W82-M255 HydrophobicContact CZ2-CB 3.94Å; W82-M255 HydrophobicContact CZ2-SD 4.1Å; L145-M255 HydrophobicContact CD1-CE 3.88Å; L145-M255 HydrophobicContact CD2-CE 4.24Å; L145-M255 HydrophobicContact CG-CE 3.99Å; K146-M255 WeakPolarHBondContact O-CE 3.3Å; P148-M255 HydrophobicContact CG-CB 4.18Å; P148-M255 HydrophobicContact CG-CG 4.34Å; F155-M255 HydrophobicContact CE1-CB 4.36Å; F155-M255 HydrophobicContact CZ-CB 4.21Å; P249-M255 WeakPolarHBondContact CB-O 3.5Å; S253-M255 VanDerWaalsContact C-N 3.25Å; S253-M255 PolarHBondContact O-N 2.86Å; S253-M255 PolarHBondContact OG-N 2.84Å; S253-M255 PolarHBondContact OG-O 3.47Å
256	K	90.6	Very high	95.9	Very high	105 Å²	105	42.1 Å²	42.1	46%	0.457	23%	0.228	S	C	.	.			trans	-126.1	0	177.4	69.3	176.5	174.1	178.9	0	113	Q151 G152 P249 P251 S253 P254	Q151-K256 WeakPolarHBondContact CA-O 3.41Å; G152-K256 WeakPolarHBondContact CA-OXT 3.31Å; G152-K256 PolarHBondContact N-OXT 2.89Å; P249-K256 HydrophobicContact CB-CB 4.17Å; P251-K256 VanDerWaalsContact O-CD 3.26Å; P251-K256 WeakPolarHBondContact O-CD 3.38Å; P251-K256 PolarHBondContact O-NZ 3.07Å; S253-K256 WeakPolarHBondContact O-CB 3.47Å; S253-K256 WeakPolarHBondContact O-CG 3.46Å; P254-K256 PolarHBondContact O-N 2.78Å

Retrieved 256 of 256 residues in 139.6 ms (Link to these results)

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